VA0D1_PONAB Loading...

V-type proton ATPase subunit d 1

Subunit of the V0 complex of vacuolar(H+)-ATPase (V-ATPase), a multisubunit enzyme composed of a peripheral complex (V1) that hydrolyzes ATP and a membrane integral complex (V0) that translocates protons (By similarity). V-ATPase is responsible for acidifying and maintaining the pH of intracellular compartments and in some cell types, is targeted to the plasma membrane, where it is responsible for acidifying the extracellular environment (By similarity). May play a role in coupling of proton transport and ATP hydrolysis (By similarity). In aerobic conditions, involved in intracellular iron homeostasis, thus triggering the activity of Fe(2+) prolyl hydroxylase (PHD) enzymes, and leading to HIF1A hydroxylation and subsequent proteasomal degradation (By similarity). May play a role in cilium biogenesis through regulation of the transport and the localization of proteins to the cilium (By similarity).

AlphaFold DB , UniProt , Accession Q5R6I1, Species PONAB (Pongo abelii, Sumatran orangutan), Gene ATP6V0D1, Length 351 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

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
1M38.3Very low70.8Confident248 Ų248114.8 Ų114.8100%1.22257%0.574SS**  061.10-144.6-179.3-138.300109.8
2S45.9Very low72.4Confident70 Ų70112.3 Ų112.349%0.4956%0.564SS.*  trans-138127.9152.253.10000103.3F4S2-F4 PolarHBondContact O-N 3.12Å
3F58.2Low74Confident192 Ų192104.3 Ų104.384%0.84252%0.524SS*.SBendtrans-76.5-6.7-167.7-104.7-92.1000114
4F66.5Low75.3Confident128 Ų12898.4 Ų98.456%0.56150%0.502SS*.  trans-15086.5177.2-63-77.2000109.3S2 E6 L7S2-F4 PolarHBondContact O-N 3.12Å; F4-E6 VanDerWaalsContact CA-OE2 3.22Å; F4-E6 WeakPolarHBondContact CA-OE2 3.41Å; F4-E6 PolarHBondContact O-N 3.39Å; F4-E6 VanDerWaalsContact O-N 3.17Å; F4-L7 HydrophobicContact CB-CD1 3.74Å; F4-L7 HydrophobicContact CB-CG 3.82Å; F4-L7 HydrophobicContact CD2-CD1 4.37Å; F4-L7 HydrophobicContact CG-CD1 4.37Å; F4-L7 PolarHBondContact O-N 2.9Å; F4-L7 VanDerWaalsContact O-N 3.17Å
5P66.7Low76.6Confident65 Ų65101 Ų10142%0.42250%0.504SS..THydrogen-bonded Turntrans-57.5-24.5176.623.9-32.8000112.5L7 Y8 F9P5-L7 PolarHBondContact O-N 3.38Å; P5-Y8 PolarHBondContact O-N 2.7Å; P5-F9 PolarHBondContact O-N 2.65Å; P5-F9 VanDerWaalsContact O-N 3.13Å
6E73.1Confident77.7Confident62 Ų6294.8 Ų94.829%0.2947%0.473SS..Hα-helixtrans-60.3-30.1177.9-5479.9-171.100112.5F4 Y8 F9 F310F4-E6 VanDerWaalsContact CA-OE2 3.22Å; F4-E6 WeakPolarHBondContact CA-OE2 3.41Å; F4-E6 PolarHBondContact O-N 3.39Å; F4-E6 VanDerWaalsContact O-N 3.17Å; E6-Y8 VanDerWaalsContact C-N 3.28Å; E6-Y8 PolarHBondContact O-N 3.13Å; E6-F9 PolarHBondContact O-N 2.73Å; E6-F310 HydrophobicContact CB-CB 4.12Å; E6-F310 HydrophobicContact CB-CD2 4.04Å; E6-F310 HydrophobicContact CB-CG 4.26Å; E6-F310 HydrophobicContact CG-CB 4.12Å; E6-F310 HydrophobicContact CG-CD2 4.3Å
7L77.9Confident78.7Confident128 Ų12889.7 Ų89.767%0.6745%0.448SS*.Hα-helixtrans-67.5-28.5-179.8-69.7175.1000113.1F4 P5F4-L7 HydrophobicContact CB-CD1 3.74Å; F4-L7 HydrophobicContact CB-CG 3.82Å; F4-L7 HydrophobicContact CD2-CD1 4.37Å; F4-L7 HydrophobicContact CG-CD1 4.37Å; F4-L7 PolarHBondContact O-N 2.9Å; F4-L7 VanDerWaalsContact O-N 3.17Å; P5-L7 PolarHBondContact O-N 3.38Å
8Y83.6Confident79.5Confident159 Ų15987.2 Ų87.262%0.62445%0.448SS*.Hα-helixtrans-104.9-10.6-178.4-62-80000112.7P5 E6 N10 V11P5-Y8 PolarHBondContact O-N 2.7Å; E6-Y8 VanDerWaalsContact C-N 3.28Å; E6-Y8 PolarHBondContact O-N 3.13Å; Y8-N10 VanDerWaalsContact C-N 3.27Å; Y8-N10 PolarHBondContact O-N 2.98Å; Y8-V11 WeakPolarHBondContact O-CB 3.48Å; Y8-V11 WeakPolarHBondContact O-CG2 3.36Å; Y8-V11 PolarHBondContact O-N 3.17Å
9F88.3Confident80.4Confident16 Ų1685 Ų857%0.0744%0.437CS..Hα-helixtrans-52.5-46-177.3-176.1-85.7000112.5P5 E6 V11 N13 E17 F310 F312P5-F9 PolarHBondContact O-N 2.65Å; P5-F9 VanDerWaalsContact O-N 3.13Å; E6-F9 PolarHBondContact O-N 2.73Å; F9-V11 PolarHBondContact O-N 3.19Å; F9-N13 HydrophobicContact CD1-CB 4.04Å; F9-N13 HydrophobicContact CE1-CB 3.58Å; F9-N13 HydrophobicContact CE2-CB 4.19Å; F9-N13 HydrophobicContact CG-CB 4.49Å; F9-N13 HydrophobicContact CZ-CB 3.68Å; F9-N13 WeakPolarHBondContact O-CB 3.24Å; F9-N13 PolarHBondContact O-N 3.29Å; F9-N13 PolarHBondContact O-ND2 3.08Å; F9-E17 HydrophobicContact CE1-CB 3.88Å; F9-E17 HydrophobicContact CE1-CG 4.4Å; F9-E17 WeakPolarHBondContact CE1-OE2 3.24Å; F9-E17 HydrophobicContact CZ-CB 4.4Å; F9-F310 HydrophobicContact CB-CB 4.07Å; F9-F310 HydrophobicContact CB-CD1 4.44Å; F9-F310 HydrophobicContact CD1-CB 4.05Å; F9-F310 AromaticContact CD1-CD1 3.86Å; F9-F310 HydrophobicContact CD1-CD1 3.86Å; F9-F310 HydrophobicContact CD1-CG 4.47Å; F9-F310 HydrophobicContact CD2-CB 4.23Å; F9-F310 VanDerWaalsContact CE2-C 3.44Å; F9-F310 HydrophobicContact CG-CB 3.84Å; F9-F310 HydrophobicContact CG-CD1 4.34Å; F9-F312 HydrophobicContact CD2-CE1 4.16Å; F9-F312 AromaticContact CE2-CD1 3.66Å; F9-F312 HydrophobicContact CE2-CD1 3.66Å; F9-F312 AromaticContact CE2-CE1 3.34Å; F9-F312 HydrophobicContact CE2-CE1 3.34Å; F9-F312 HydrophobicContact CE2-CZ 4.2Å; F9-F312 HydrophobicContact CZ-CD1 4.05Å; F9-F312 AromaticContact CZ-CE1 3.94Å; F9-F312 HydrophobicContact CZ-CE1 3.94Å
10N90.7Very high81.1Confident87 Ų8780.8 Ų80.847%0.46542%0.415SS..Hα-helixtrans-70.8-14.3-175.8-75.2-12.6000114.4Y8 D12 G14Y8-N10 VanDerWaalsContact C-N 3.27Å; Y8-N10 PolarHBondContact O-N 2.98Å; N10-D12 VanDerWaalsContact C-N 3.33Å; N10-G14 PolarHBondContact O-N 3.14Å
11V90.1Very high81.7Confident108 Ų10879.9 Ų79.966%0.65541%0.407SS*.Hα-helixtrans-61.7-46179.21780000110.1Y8 F9Y8-V11 WeakPolarHBondContact O-CB 3.48Å; Y8-V11 WeakPolarHBondContact O-CG2 3.36Å; Y8-V11 PolarHBondContact O-N 3.17Å; F9-V11 PolarHBondContact O-N 3.19Å
12D89.9Confident84.4Confident85 Ų8570.1 Ų70.146%0.45537%0.37SS..Hα-helixtrans-108-29.3-177.2-56.8-47.9000112.6N10N10-D12 VanDerWaalsContact C-N 3.33Å
13N92.6Very high86.6Confident8 Ų868.6 Ų68.64%0.04336%0.356CS..Hα-helixtrans-114.8-4.8-166.9-52.8-69.4000114.4F9 Y15 L16 E17 L93 F312F9-N13 HydrophobicContact CD1-CB 4.04Å; F9-N13 HydrophobicContact CE1-CB 3.58Å; F9-N13 HydrophobicContact CE2-CB 4.19Å; F9-N13 HydrophobicContact CG-CB 4.49Å; F9-N13 HydrophobicContact CZ-CB 3.68Å; F9-N13 WeakPolarHBondContact O-CB 3.24Å; F9-N13 PolarHBondContact O-N 3.29Å; F9-N13 PolarHBondContact O-ND2 3.08Å; N13-Y15 PolarHBondContact O-N 2.9Å; N13-L16 PolarHBondContact O-N 3.48Å; N13-L16 VanDerWaalsContact O-N 3.14Å; N13-E17 PolarHBondContact O-N 2.82Å; N13-L93 HydrophobicContact CB-CD2 4.48Å; N13-L93 WeakPolarHBondContact OD1-CB 3.37Å; N13-L93 VanDerWaalsContact OD1-CD2 3.29Å; N13-L93 WeakPolarHBondContact OD1-CD2 3.41Å; N13-F312 HydrophobicContact CB-CE1 4.35Å
14G92.3Very high88.2Confident21 Ų2162.3 Ų62.322%0.21633%0.328CS..Hα-helixtrans-63.1-40.1-17300000113.2N10 G18N10-G14 PolarHBondContact O-N 3.14Å; G14-G18 PolarHBondContact O-N 3.44Å
15Y94.3Very high89.4Confident138 Ų13860.1 Ų60.154%0.54133%0.333SS..Hα-helixtrans-60-47.1173.4170.3-108.5000111.6N13 G18 L19 H84N13-Y15 PolarHBondContact O-N 2.9Å; Y15-G18 PolarHBondContact O-N 3.5Å; Y15-L19 WeakPolarHBondContact O-CB 3.47Å; Y15-L19 PolarHBondContact O-N 3.18Å; Y15-H84 PolarHBondContact OH-NE2 3.37Å
16L95.3Very high90.6Very high1 Ų157.5 Ų57.51%0.00532%0.318CS..Hα-helixtrans-70.8-39.5-176.4-71.9176.7000112.8N13 G18 L19 V20 M85 H88 A89 L93 F315N13-L16 PolarHBondContact O-N 3.48Å; N13-L16 VanDerWaalsContact O-N 3.14Å; L16-G18 VanDerWaalsContact C-N 3.35Å; L16-L19 HydrophobicContact CD2-CD2 4.45Å; L16-L19 PolarHBondContact O-N 2.85Å; L16-V20 WeakPolarHBondContact O-CG1 3.46Å; L16-V20 PolarHBondContact O-N 2.96Å; L16-M85 HydrophobicContact CD2-CB 4.32Å; L16-M85 HydrophobicContact CD2-CG 4.39Å; L16-H88 HydrophobicContact CD1-CB 4.44Å; L16-H88 HydrophobicContact CD2-CB 3.97Å; L16-A89 HydrophobicContact CD1-CB 3.9Å; L16-L93 HydrophobicContact CB-CD2 4.22Å; L16-L93 HydrophobicContact CD1-CD2 3.49Å; L16-L93 VanDerWaalsContact CD1-CD2 3.49Å; L16-F315 HydrophobicContact CB-CE1 3.92Å; L16-F315 HydrophobicContact CB-CZ 3.72Å
17E93.8Very high91.4Very high9 Ų955 Ų554%0.04231%0.308CS..Hα-helixtrans-62.9-43.5173.1-178.4175.7-168.500110.9F9 N13 L19 V20 R21 F310F9-E17 HydrophobicContact CE1-CB 3.88Å; F9-E17 HydrophobicContact CE1-CG 4.4Å; F9-E17 WeakPolarHBondContact CE1-OE2 3.24Å; F9-E17 HydrophobicContact CZ-CB 4.4Å; N13-E17 PolarHBondContact O-N 2.82Å; E17-L19 VanDerWaalsContact C-N 3.32Å; E17-L19 PolarHBondContact O-N 3.37Å; E17-V20 VanDerWaalsContact O-CG1 3.32Å; E17-V20 WeakPolarHBondContact O-CG1 3.4Å; E17-R21 HydrophobicContact CG-CG 4.47Å; E17-R21 WeakPolarHBondContact O-CB 3.15Å; E17-R21 VanDerWaalsContact O-CG 3.24Å; E17-R21 WeakPolarHBondContact O-CG 3.48Å; E17-R21 PolarHBondContact O-N 3.19Å; E17-R21 IonicContact OE1-CZ 2.72Å; E17-R21 VanDerWaalsContact OE1-CZ 3.3Å; E17-R21 IonicContact OE1-NE 2.98Å; E17-R21 PolarHBondContact OE1-NE 2.92Å; E17-R21 IonicContact OE1-NH2 3.33Å; E17-R21 PolarHBondContact OE1-NH2 3.27Å; E17-F310 PolarHBondContact OE1-N 3Å; E17-F310 PolarHBondContact OE2-N 3.02Å
18G94.4Very high92.2Very high44 Ų4449 Ų4945%0.45428%0.276SS..Hα-helixtrans-60.2-43.1174.400000112.3G14 Y15 L16 G22G14-G18 PolarHBondContact O-N 3.44Å; Y15-G18 PolarHBondContact O-N 3.5Å; L16-G18 VanDerWaalsContact C-N 3.35Å; G18-G22 PolarHBondContact O-N 2.99Å
19L95Very high92.6Very high46 Ų4643.6 Ų43.624%0.24126%0.261CS..Hα-helixtrans-62.1-52.7177.9-179.464.6000111.8Y15 L16 E17 R21 G22 L23 M85Y15-L19 WeakPolarHBondContact O-CB 3.47Å; Y15-L19 PolarHBondContact O-N 3.18Å; L16-L19 HydrophobicContact CD2-CD2 4.45Å; L16-L19 PolarHBondContact O-N 2.85Å; E17-L19 VanDerWaalsContact C-N 3.32Å; E17-L19 PolarHBondContact O-N 3.37Å; L19-R21 VanDerWaalsContact C-N 3.29Å; L19-R21 PolarHBondContact O-N 3.33Å; L19-G22 CarbonylContact O-C 3.6Å; L19-G22 WeakPolarHBondContact O-CA 3.4Å; L19-G22 PolarHBondContact O-N 3.3Å; L19-L23 HydrophobicContact CG-CD1 4.31Å; L19-L23 WeakPolarHBondContact O-CG 3.4Å; L19-L23 PolarHBondContact O-N 2.98Å; L19-M85 HydrophobicContact CD2-CG 4.14Å
20V95.2Very high92.7Very high0 Ų048.3 Ų48.30%028%0.283CS..Hα-helixtrans-64.3-34.6-178.368.80000112L16 E17 G22 L23 K24 M85 V314 F315 F318L16-V20 WeakPolarHBondContact O-CG1 3.46Å; L16-V20 PolarHBondContact O-N 2.96Å; E17-V20 VanDerWaalsContact O-CG1 3.32Å; E17-V20 WeakPolarHBondContact O-CG1 3.4Å; V20-G22 VanDerWaalsContact C-N 3.34Å; V20-L23 PolarHBondContact O-N 3.37Å; V20-K24 WeakPolarHBondContact O-CB 3.24Å; V20-K24 PolarHBondContact O-N 2.8Å; V20-M85 HydrophobicContact CB-SD 3.97Å; V20-M85 HydrophobicContact CG2-SD 4.14Å; V20-V314 HydrophobicContact CG1-CB 4.33Å; V20-V314 HydrophobicContact CG1-CG2 3.75Å; V20-F315 HydrophobicContact CB-CD1 4.12Å; V20-F315 HydrophobicContact CB-CE1 4.03Å; V20-F315 HydrophobicContact CG1-CD1 4.12Å; V20-F315 HydrophobicContact CG1-CE1 3.84Å; V20-F315 HydrophobicContact CG1-CZ 4.17Å; V20-F315 HydrophobicContact CG2-CD1 4.27Å; V20-F318 HydrophobicContact CG2-CB 3.38Å; V20-F318 HydrophobicContact CG2-CD1 3.9Å; V20-F318 HydrophobicContact CG2-CD2 4.08Å; V20-F318 HydrophobicContact CG2-CG 3.51Å
21R94.1Very high92.7Very high62 Ų6246.9 Ų46.923%0.23428%0.284CS..Hα-helixtrans-67.5-35.1173.1-72.3179.3-177.6-73.5-7.1112.4E17 L19 A25 F306 N308E17-R21 HydrophobicContact CG-CG 4.47Å; E17-R21 WeakPolarHBondContact O-CB 3.15Å; E17-R21 VanDerWaalsContact O-CG 3.24Å; E17-R21 WeakPolarHBondContact O-CG 3.48Å; E17-R21 PolarHBondContact O-N 3.19Å; E17-R21 IonicContact OE1-CZ 2.72Å; E17-R21 VanDerWaalsContact OE1-CZ 3.3Å; E17-R21 IonicContact OE1-NE 2.98Å; E17-R21 PolarHBondContact OE1-NE 2.92Å; E17-R21 IonicContact OE1-NH2 3.33Å; E17-R21 PolarHBondContact OE1-NH2 3.27Å; L19-R21 VanDerWaalsContact C-N 3.29Å; L19-R21 PolarHBondContact O-N 3.33Å; R21-A25 PolarHBondContact O-N 3.15Å; R21-F306 PolarHBondContact NH1-O 3.41Å; R21-F306 VanDerWaalsContact NH1-O 3.11Å; R21-N308 PolarHBondContact NH2-O 3.5Å
22G93.8Very high92.8Very high43 Ų4344 Ų4444%0.44327%0.265SS..Hα-helixtrans-63.6-49.4170.400000111.9G18 L19 V20 K24 A25G18-G22 PolarHBondContact O-N 2.99Å; L19-G22 CarbonylContact O-C 3.6Å; L19-G22 WeakPolarHBondContact O-CA 3.4Å; L19-G22 PolarHBondContact O-N 3.3Å; V20-G22 VanDerWaalsContact C-N 3.34Å; G22-K24 VanDerWaalsContact C-N 3.25Å; G22-K24 PolarHBondContact O-N 2.95Å; G22-A25 VanDerWaalsContact O-CB 3.24Å; G22-A25 WeakPolarHBondContact O-CB 3.02Å; G22-A25 PolarHBondContact O-N 2.96Å
23L92.9Very high92.9Very high38 Ų3839.9 Ų39.920%0.19924%0.243CC..Hα-helixtrans-60.2-35.4176.6-66.5173.4000112.4L19 V20 A25 G26 E81 M85 F318L19-L23 HydrophobicContact CG-CD1 4.31Å; L19-L23 WeakPolarHBondContact O-CG 3.4Å; L19-L23 PolarHBondContact O-N 2.98Å; V20-L23 PolarHBondContact O-N 3.37Å; L23-A25 PolarHBondContact O-N 3.01Å; L23-G26 WeakPolarHBondContact O-CA 3.4Å; L23-G26 PolarHBondContact O-N 2.75Å; L23-E81 HydrophobicContact CD1-CB 4.3Å; L23-E81 HydrophobicContact CD1-CG 4.47Å; L23-E81 HydrophobicContact CD2-CG 4.35Å; L23-M85 HydrophobicContact CD1-SD 4.43Å; L23-F318 HydrophobicContact CB-CD2 4.31Å; L23-F318 HydrophobicContact CB-CE1 4.35Å; L23-F318 HydrophobicContact CB-CE2 3.46Å; L23-F318 VanDerWaalsContact CB-CE2 3.46Å; L23-F318 HydrophobicContact CB-CZ 3.48Å; L23-F318 VanDerWaalsContact CB-CZ 3.48Å; L23-F318 HydrophobicContact CD1-CE1 4.05Å; L23-F318 HydrophobicContact CD1-CZ 3.88Å; L23-F318 HydrophobicContact CG-CZ 4.25Å
24K92.2Very high92.9Very high61 Ų6143.4 Ų43.427%0.26526%0.261SS..Hα-helixtrans-62.6-26.8173.7178.2-99.3170.4-161.30112.9V20 G22 G26 V27 F306 F318 F351V20-K24 WeakPolarHBondContact O-CB 3.24Å; V20-K24 PolarHBondContact O-N 2.8Å; G22-K24 VanDerWaalsContact C-N 3.25Å; G22-K24 PolarHBondContact O-N 2.95Å; K24-G26 PolarHBondContact O-N 3.17Å; K24-V27 WeakPolarHBondContact O-CG2 3.48Å; K24-V27 PolarHBondContact O-N 3.37Å; K24-F306 HydrophobicContact CB-CD1 4.44Å; K24-F306 HydrophobicContact CB-CE1 3.79Å; K24-F306 HydrophobicContact CB-CZ 4.05Å; K24-F306 HydrophobicContact CD-CD1 4.1Å; K24-F306 HydrophobicContact CD-CE1 4.28Å; K24-F306 HydrophobicContact CD-CG 4.41Å; K24-F306 HydrophobicContact CG-CD1 3.95Å; K24-F306 HydrophobicContact CG-CD2 4.44Å; K24-F306 HydrophobicContact CG-CE1 3.65Å; K24-F306 HydrophobicContact CG-CE2 4.18Å; K24-F306 HydrophobicContact CG-CG 4.33Å; K24-F306 HydrophobicContact CG-CZ 3.78Å; K24-F318 HydrophobicContact CB-CD2 4.35Å; K24-F351 HydrophobicContact CD-CZ 4.29Å; K24-F351 VanDerWaalsContact CE-CE1 3.48Å; K24-F351 HydrophobicContact CG-CE2 4.26Å; K24-F351 HydrophobicContact CG-CZ 4.15Å
25A91.5Very high92.9Very high81 Ų8145.6 Ų45.667%0.66927%0.268SS*.Hα-helixtrans-69.9-22.8173.600000112.5R21 G22 L23 V27R21-A25 PolarHBondContact O-N 3.15Å; G22-A25 VanDerWaalsContact O-CB 3.24Å; G22-A25 WeakPolarHBondContact O-CB 3.02Å; G22-A25 PolarHBondContact O-N 2.96Å; L23-A25 PolarHBondContact O-N 3.01Å; A25-V27 VanDerWaalsContact C-N 3.29Å; A25-V27 PolarHBondContact O-N 3.05Å
26G90.7Very high92.8Very high10 Ų1039.2 Ų39.210%0.10324%0.243CC..THydrogen-bonded Turntrans-86.813.8174.500000115.3L23 K24 D53 K322L23-G26 WeakPolarHBondContact O-CA 3.4Å; L23-G26 PolarHBondContact O-N 2.75Å; K24-G26 PolarHBondContact O-N 3.17Å; G26-D53 WeakPolarHBondContact CA-OD2 3.18Å; G26-D53 PolarHBondContact N-OD2 2.97Å; G26-K322 PolarHBondContact O-NZ 3.17Å
27V91.9Very high92.6Very high11 Ų1140 Ų407%0.06725%0.248CC..SBendtrans-80.1131.6170.5177.70000108.6K24 A25 S29 K322 E325 I350 F351K24-V27 WeakPolarHBondContact O-CG2 3.48Å; K24-V27 PolarHBondContact O-N 3.37Å; A25-V27 VanDerWaalsContact C-N 3.29Å; A25-V27 PolarHBondContact O-N 3.05Å; V27-S29 PolarHBondContact O-N 3.4Å; V27-K322 HydrophobicContact CG2-CD 4.2Å; V27-E325 VanDerWaalsContact CA-OE1 3.25Å; V27-E325 WeakPolarHBondContact CA-OE1 3.5Å; V27-I350 HydrophobicContact CG1-CB 4.2Å; V27-I350 HydrophobicContact CG1-CD1 3.95Å; V27-I350 HydrophobicContact CG1-CG2 4.12Å; V27-F351 HydrophobicContact CB-CD2 3.81Å; V27-F351 HydrophobicContact CB-CE2 3.87Å; V27-F351 HydrophobicContact CG1-CD2 3.63Å; V27-F351 HydrophobicContact CG1-CE2 3.83Å; V27-F351 HydrophobicContact CG2-CE2 4.17Å
28L92.7Very high92.5Very high2 Ų246 Ų461%0.0128%0.276CS..PPolyproline II helixtrans-51.5126-179.9-65.4-175.4000110.7D32 Y33 L36 L49 T52 Y54 E325 I329L28-D32 HydrophobicContact CB-CB 4.11Å; L28-D32 HydrophobicContact CD2-CB 3.91Å; L28-D32 HydrophobicContact CG-CB 4.49Å; L28-Y33 HydrophobicContact CB-CD2 4.35Å; L28-Y33 HydrophobicContact CB-CE2 3.83Å; L28-Y33 HydrophobicContact CD1-CE1 4.17Å; L28-Y33 WeakPolarHBondContact O-CE2 3.39Å; L28-L36 HydrophobicContact CD1-CD1 3.77Å; L28-L49 HydrophobicContact CD1-CD2 4.26Å; L28-T52 HydrophobicContact CD2-CG2 3.61Å; L28-Y54 HydrophobicContact CD1-CE2 4.44Å; L28-Y54 HydrophobicContact CD2-CD2 4.43Å; L28-Y54 HydrophobicContact CD2-CE2 4.39Å; L28-Y54 HydrophobicContact CG-CE2 4.27Å; L28-E325 HydrophobicContact CB-CG 4.46Å; L28-E325 WeakPolarHBondContact CB-OE1 2.97Å; L28-E325 HydrophobicContact CD1-CG 4.13Å; L28-E325 HydrophobicContact CG-CG 4.16Å; L28-E325 VanDerWaalsContact CG-OE1 3.28Å; L28-E325 WeakPolarHBondContact CG-OE1 3.09Å; L28-E325 PolarHBondContact N-OE1 3.25Å; L28-I329 HydrophobicContact CD1-CD1 3.77Å; L28-I329 HydrophobicContact CD1-CG1 3.83Å
29S92.2Very high92.4Very high44 Ų4444.1 Ų44.131%0.30826%0.256SS..PPolyproline II helixtrans-77.8165.9174.870.90000111.1V27 A31 D32 Y33V27-S29 PolarHBondContact O-N 3.4Å; S29-A31 PolarHBondContact O-N 3.46Å; S29-A31 PolarHBondContact OG-N 2.63Å; S29-D32 WeakPolarHBondContact CB-OD2 3.3Å; S29-D32 PolarHBondContact N-OD2 2.83Å; S29-D32 WeakPolarHBondContact O-CB 3.45Å; S29-D32 PolarHBondContact O-N 3.04Å; S29-D32 VanDerWaalsContact OG-CG 3.31Å; S29-D32 PolarHBondContact OG-N 2.79Å; S29-D32 PolarHBondContact OG-OD2 3.31Å; S29-Y33 VanDerWaalsContact O-CD2 3.27Å; S29-Y33 WeakPolarHBondContact O-CD2 3.42Å; S29-Y33 PolarHBondContact O-N 3.3Å; S29-Y33 VanDerWaalsContact O-N 3.15Å
30Q90.2Very high92.2Very high115 Ų11549.2 Ų49.254%0.53728%0.279SS..Hα-helixtrans-51.9-36.2169.7-170.6177.212.200113.1Y33 L34 F351Q30-Y33 PolarHBondContact O-N 2.71Å; Q30-L34 WeakPolarHBondContact O-CG 3.14Å; Q30-L34 PolarHBondContact O-N 3.32Å; Q30-L34 VanDerWaalsContact O-N 3.09Å; Q30-F351 PolarHBondContact N-O 3.23Å
31A91.4Very high92Very high58 Ų5852.3 Ų52.348%0.47930%0.297SS..Hα-helixtrans-67-37.7178.200000112.1S29 L34 N35S29-A31 PolarHBondContact O-N 3.46Å; S29-A31 PolarHBondContact OG-N 2.63Å; A31-L34 PolarHBondContact O-N 2.83Å; A31-N35 PolarHBondContact O-N 3.17Å; A31-N35 VanDerWaalsContact O-N 3.15Å; A31-N35 PolarHBondContact O-ND2 3.34Å
32D92.5Very high91.9Very high46 Ų4650.4 Ų50.425%0.24629%0.292CS..Hα-helixtrans-64.9-45.1176.7-57.3-53.2000110.8L28 S29 L34 N35 L36L28-D32 HydrophobicContact CB-CB 4.11Å; L28-D32 HydrophobicContact CD2-CB 3.91Å; L28-D32 HydrophobicContact CG-CB 4.49Å; S29-D32 WeakPolarHBondContact CB-OD2 3.3Å; S29-D32 PolarHBondContact N-OD2 2.83Å; S29-D32 WeakPolarHBondContact O-CB 3.45Å; S29-D32 PolarHBondContact O-N 3.04Å; S29-D32 VanDerWaalsContact OG-CG 3.31Å; S29-D32 PolarHBondContact OG-N 2.79Å; S29-D32 PolarHBondContact OG-OD2 3.31Å; D32-L34 VanDerWaalsContact C-N 3.32Å; D32-L34 PolarHBondContact O-N 3.37Å; D32-N35 WeakPolarHBondContact O-CB 3.41Å; D32-N35 PolarHBondContact O-N 3.01Å; D32-N35 VanDerWaalsContact O-N 3.11Å; D32-L36 WeakPolarHBondContact O-CG 3.31Å; D32-L36 PolarHBondContact O-N 3.33Å
33Y92.8Very high91.7Very high0 Ų051.4 Ų51.40%029%0.285CS..Hα-helixtrans-59.5-41.2175.2-74-68.1000112.7L28 S29 Q30 N35 L36 V37 N328 I332 Y347L28-Y33 HydrophobicContact CB-CD2 4.35Å; L28-Y33 HydrophobicContact CB-CE2 3.83Å; L28-Y33 HydrophobicContact CD1-CE1 4.17Å; L28-Y33 WeakPolarHBondContact O-CE2 3.39Å; S29-Y33 VanDerWaalsContact O-CD2 3.27Å; S29-Y33 WeakPolarHBondContact O-CD2 3.42Å; S29-Y33 PolarHBondContact O-N 3.3Å; S29-Y33 VanDerWaalsContact O-N 3.15Å; Q30-Y33 PolarHBondContact O-N 2.71Å; Y33-N35 VanDerWaalsContact C-N 3.27Å; Y33-N35 PolarHBondContact O-N 3.1Å; Y33-L36 HydrophobicContact CD1-CD1 4.38Å; Y33-L36 PolarHBondContact O-N 3.4Å; Y33-L36 VanDerWaalsContact O-N 3.15Å; Y33-V37 VanDerWaalsContact O-CG2 3.32Å; Y33-V37 WeakPolarHBondContact O-CG2 3.22Å; Y33-V37 PolarHBondContact O-N 3.31Å; Y33-N328 HydrophobicContact CD1-CB 4.45Å; Y33-N328 HydrophobicContact CE1-CB 3.48Å; Y33-N328 VanDerWaalsContact CE1-CB 3.48Å; Y33-N328 PolarHBondContact OH-ND2 3.36Å; Y33-I332 HydrophobicContact CD1-CD1 3.87Å; Y33-I332 HydrophobicContact CE1-CD1 4.5Å; Y33-Y347 VanDerWaalsContact CB-CE2 3.47Å; Y33-Y347 AromaticContact CD1-CD2 3.89Å; Y33-Y347 HydrophobicContact CD1-CD2 3.89Å; Y33-Y347 AromaticContact CD1-CE2 3.99Å; Y33-Y347 HydrophobicContact CD1-CE2 3.99Å; Y33-Y347 HydrophobicContact CD1-CG 4.43Å; Y33-Y347 HydrophobicContact CD2-CD2 4.36Å; Y33-Y347 AromaticContact CD2-CE2 3.97Å; Y33-Y347 HydrophobicContact CD2-CE2 3.97Å; Y33-Y347 HydrophobicContact CE1-CD2 4.33Å; Y33-Y347 AromaticContact CG-CD2 3.91Å; Y33-Y347 HydrophobicContact CG-CD2 3.91Å; Y33-Y347 AromaticContact CG-CE2 3.54Å; Y33-Y347 HydrophobicContact CG-CE2 3.54Å
34L91.5Very high91.7Very high82 Ų8252.1 Ų52.143%0.42929%0.289SS..Hα-helixtrans-60.9-36.3176.1-71.5172.3000112.3Q30 A31 D32 Q38Q30-L34 WeakPolarHBondContact O-CG 3.14Å; Q30-L34 PolarHBondContact O-N 3.32Å; Q30-L34 VanDerWaalsContact O-N 3.09Å; A31-L34 PolarHBondContact O-N 2.83Å; D32-L34 VanDerWaalsContact C-N 3.32Å; D32-L34 PolarHBondContact O-N 3.37Å; L34-Q38 VanDerWaalsContact O-CG 3.32Å; L34-Q38 WeakPolarHBondContact O-CG 3.16Å; L34-Q38 PolarHBondContact O-N 2.95Å; L34-Q38 PolarHBondContact O-NE2 3.22Å
35N92.6Very high91.7Very high66 Ų6649.2 Ų49.235%0.35328%0.277SS..Hα-helixtrans-69.5-41.5174.2-65-33.9000111.4A31 D32 Y33 V37 Q38 C39A31-N35 PolarHBondContact O-N 3.17Å; A31-N35 VanDerWaalsContact O-N 3.15Å; A31-N35 PolarHBondContact O-ND2 3.34Å; D32-N35 WeakPolarHBondContact O-CB 3.41Å; D32-N35 PolarHBondContact O-N 3.01Å; D32-N35 VanDerWaalsContact O-N 3.11Å; Y33-N35 VanDerWaalsContact C-N 3.27Å; Y33-N35 PolarHBondContact O-N 3.1Å; N35-V37 PolarHBondContact O-N 3.49Å; N35-Q38 PolarHBondContact O-N 3.29Å; N35-C39 PolarHBondContact O-SG 3.17Å
36L92.2Very high91.6Very high4 Ų446.4 Ų46.42%0.02125%0.249CC..Hα-helixtrans-62.6-40.7178.1-65.6176.8000112.2L28 D32 Y33 Q38 C39 L45 H48 L49 I329 I332L28-L36 HydrophobicContact CD1-CD1 3.77Å; D32-L36 WeakPolarHBondContact O-CG 3.31Å; D32-L36 PolarHBondContact O-N 3.33Å; Y33-L36 HydrophobicContact CD1-CD1 4.38Å; Y33-L36 PolarHBondContact O-N 3.4Å; Y33-L36 VanDerWaalsContact O-N 3.15Å; L36-Q38 PolarHBondContact O-N 2.84Å; L36-C39 VanDerWaalsContact O-CB 3.26Å; L36-C39 WeakPolarHBondContact O-CB 3.49Å; L36-C39 PolarHBondContact O-N 3.44Å; L36-C39 PolarHBondContact O-SG 2.96Å; L36-C39 VanDerWaalsContact O-SG 3.38Å; L36-L45 HydrophobicContact CD2-CG 4.15Å; L36-H48 HydrophobicContact CD2-CB 3.88Å; L36-L49 HydrophobicContact CD1-CD2 4.16Å; L36-L49 HydrophobicContact CD2-CD2 4.02Å; L36-L49 HydrophobicContact CD2-CG 4.13Å; L36-I329 HydrophobicContact CD1-CG1 4.47Å; L36-I332 HydrophobicContact CB-CD1 4.18Å; L36-I332 HydrophobicContact CB-CG2 4.22Å
37V91.9Very high91.6Very high19 Ų1951 Ų5112%0.11527%0.271CS..Hα-helixtrans-62.3-29.4177169.20000112.4Y33 N35 C39 I332 I344 Y347Y33-V37 VanDerWaalsContact O-CG2 3.32Å; Y33-V37 WeakPolarHBondContact O-CG2 3.22Å; Y33-V37 PolarHBondContact O-N 3.31Å; N35-V37 PolarHBondContact O-N 3.49Å; V37-C39 VanDerWaalsContact C-N 3.33Å; V37-I332 HydrophobicContact CG2-CD1 4.23Å; V37-I344 HydrophobicContact CG1-CD1 4.2Å; V37-I344 HydrophobicContact CG1-CG1 4.26Å; V37-I344 HydrophobicContact CG1-CG2 3.67Å; V37-I344 HydrophobicContact CG2-CG1 4.27Å; V37-Y347 HydrophobicContact CG2-CD1 4.36Å; V37-Y347 HydrophobicContact CG2-CE1 3.85Å
38Q91.3Very high91.6Very high135 Ų13554 Ų5463%0.63128%0.284SS*.Hα-helixtrans-78.3-15.9-179.9-69.8172.126.700113.5L34 N35 L36L34-Q38 VanDerWaalsContact O-CG 3.32Å; L34-Q38 WeakPolarHBondContact O-CG 3.16Å; L34-Q38 PolarHBondContact O-N 2.95Å; L34-Q38 PolarHBondContact O-NE2 3.22Å; N35-Q38 PolarHBondContact O-N 3.29Å; L36-Q38 PolarHBondContact O-N 2.84Å
39C91.7Very high91.6Very high4 Ų453.9 Ų53.93%0.02728%0.283CS..  trans-57.5141.1-178.7-66.50000112.3N35 L36 V37 D44 L45 H48 I336 R341N35-C39 PolarHBondContact O-SG 3.17Å; L36-C39 VanDerWaalsContact O-CB 3.26Å; L36-C39 WeakPolarHBondContact O-CB 3.49Å; L36-C39 PolarHBondContact O-N 3.44Å; L36-C39 PolarHBondContact O-SG 2.96Å; L36-C39 VanDerWaalsContact O-SG 3.38Å; V37-C39 VanDerWaalsContact C-N 3.33Å; C39-D44 HydrophobicContact CB-CB 3.91Å; C39-L45 HydrophobicContact CB-CB 4.33Å; C39-H48 PolarHBondContact SG-CD2 2.91Å; C39-I336 HydrophobicContact CB-CD1 3.75Å; C39-R341 PolarHBondContact O-NH2 2.9Å
40E90.7Very high91.5Very high153 Ų15354.4 Ų54.472%0.71528%0.281SS*.SBendtrans-94.9-31.6177.9-67.5-168.7176.600113.1D44E40-D44 PolarHBondContact N-OD2 3.28Å
41T92Very high91.5Very high64 Ų6453.4 Ų53.439%0.39329%0.287SS..SBendtrans-129.5163.8-177.869.60000111.3E43 D44 L45T41-E43 PolarHBondContact O-N 3.2Å; T41-E43 PolarHBondContact OG1-N 2.92Å; T41-D44 PolarHBondContact N-OD2 3.27Å; T41-D44 PolarHBondContact O-N 3.41Å; T41-D44 PolarHBondContact OG1-N 2.98Å; T41-D44 PolarHBondContact OG1-OD2 2.9Å; T41-L45 PolarHBondContact O-N 3.38Å
42L91.4Very high91.5Very high23 Ų2351.9 Ų51.912%0.1227%0.271CS..Hα-helixtrans-66.3-23.5172.8-64.9-179.2000112.4K46 L65 V67 I70 A333 I336 A337L42-K46 WeakPolarHBondContact O-CB 3.43Å; L42-K46 PolarHBondContact O-N 3.47Å; L42-L65 HydrophobicContact CB-CB 4.39Å; L42-L65 HydrophobicContact CB-CD2 4.26Å; L42-L65 VanDerWaalsContact CD1-O 3.28Å; L42-L65 WeakPolarHBondContact CD1-O 3.33Å; L42-V67 HydrophobicContact CD1-CG2 4.24Å; L42-I70 HydrophobicContact CD2-CD1 4.15Å; L42-A333 HydrophobicContact CD2-CB 3.84Å; L42-I336 HydrophobicContact CD2-CB 4.43Å; L42-I336 HydrophobicContact CD2-CG2 4.26Å; L42-A337 HydrophobicContact CD1-CB 4.31Å
43E90Very high91.4Very high63 Ų6354.8 Ų54.829%0.29429%0.287SS..Hα-helixtrans-71.9-37.4174.3-62.8-66.517200111.1T41 L45 K46 L47 S63T41-E43 PolarHBondContact O-N 3.2Å; T41-E43 PolarHBondContact OG1-N 2.92Å; E43-L45 VanDerWaalsContact C-N 3.35Å; E43-K46 WeakPolarHBondContact O-CB 3.21Å; E43-K46 PolarHBondContact O-N 3.21Å; E43-L47 WeakPolarHBondContact O-CG 3.27Å; E43-L47 PolarHBondContact O-N 2.98Å; E43-S63 PolarHBondContact OE1-OG 3.23Å
44D91.7Very high91.2Very high54 Ų5455.2 Ų55.229%0.28929%0.289SS..Hα-helixtrans-63.3-43.9172.7-54.2-42.3000110.7C39 E40 T41 K46 L47 H48C39-D44 HydrophobicContact CB-CB 3.91Å; E40-D44 PolarHBondContact N-OD2 3.28Å; T41-D44 PolarHBondContact N-OD2 3.27Å; T41-D44 PolarHBondContact O-N 3.41Å; T41-D44 PolarHBondContact OG1-N 2.98Å; T41-D44 PolarHBondContact OG1-OD2 2.9Å; D44-K46 VanDerWaalsContact C-N 3.32Å; D44-K46 PolarHBondContact O-N 3.34Å; D44-L47 PolarHBondContact O-N 3.46Å; D44-H48 PolarHBondContact O-CD2 3.11Å; D44-H48 VanDerWaalsContact O-CD2 3.28Å; D44-H48 PolarHBondContact O-N 3.04Å
45L91.8Very high91.1Very high0 Ų052.3 Ų52.30%028%0.279CS..Hα-helixtrans-59.1-43.8175.5-178.7147.7000111.2L36 C39 T41 E43 H48 L49 I70 I329 I332 A333 I336L36-L45 HydrophobicContact CD2-CG 4.15Å; C39-L45 HydrophobicContact CB-CB 4.33Å; T41-L45 PolarHBondContact O-N 3.38Å; E43-L45 VanDerWaalsContact C-N 3.35Å; L45-H48 PolarHBondContact O-N 2.89Å; L45-L49 HydrophobicContact CD2-CD1 3.54Å; L45-L49 HydrophobicContact CD2-CG 4.24Å; L45-L49 HydrophobicContact CG-CD1 4.45Å; L45-L49 WeakPolarHBondContact O-CG 3.41Å; L45-L49 PolarHBondContact O-N 2.94Å; L45-I70 HydrophobicContact CD2-CD1 4.1Å; L45-I329 HydrophobicContact CD2-CG2 4.48Å; L45-I332 HydrophobicContact CD1-CG2 4.07Å; L45-A333 HydrophobicContact CD1-CB 4.03Å; L45-I336 HydrophobicContact CB-CD1 4.48Å; L45-I336 HydrophobicContact CD1-CD1 3.79Å
46K91Very high90.8Very high22 Ų2255.1 Ų55.110%0.09629%0.294CS..Hα-helixtrans-59.4-45.5174.5170.6176.5171179.80112L42 E43 D44 H48 L49 Q50 L58 L65L42-K46 WeakPolarHBondContact O-CB 3.43Å; L42-K46 PolarHBondContact O-N 3.47Å; E43-K46 WeakPolarHBondContact O-CB 3.21Å; E43-K46 PolarHBondContact O-N 3.21Å; D44-K46 VanDerWaalsContact C-N 3.32Å; D44-K46 PolarHBondContact O-N 3.34Å; K46-H48 PolarHBondContact O-N 2.91Å; K46-L49 PolarHBondContact O-N 2.92Å; K46-Q50 VanDerWaalsContact O-CG 3.32Å; K46-Q50 WeakPolarHBondContact O-CG 3.45Å; K46-Q50 PolarHBondContact O-N 2.67Å; K46-L58 HydrophobicContact CB-CD1 4.03Å; K46-L58 HydrophobicContact CD-CB 3.87Å; K46-L58 HydrophobicContact CD-CD1 4.27Å; K46-L58 WeakPolarHBondContact CE-O 3.49Å; K46-L58 HydrophobicContact CG-CB 3.96Å; K46-L58 HydrophobicContact CG-CD1 3.86Å; K46-L58 PolarHBondContact NZ-O 2.77Å; K46-L65 HydrophobicContact CB-CD2 4.09Å; K46-L65 HydrophobicContact CD-CD2 4.22Å
47L90.8Very high90.6Very high107 Ų10756.7 Ų56.756%0.5630%0.301SS*.Hα-helixtrans-62.4-41.6178.3-72.4170.6000112E43 D44 Q50 S51E43-L47 WeakPolarHBondContact O-CG 3.27Å; E43-L47 PolarHBondContact O-N 2.98Å; D44-L47 PolarHBondContact O-N 3.46Å; L47-Q50 WeakPolarHBondContact O-CB 3.46Å; L47-Q50 PolarHBondContact O-N 3.24Å; L47-S51 PolarHBondContact O-N 3.26Å
48H91.4Very high90.2Very high73 Ų7355.8 Ų55.834%0.33830%0.295SS..Hα-helixtrans-65.5-45.9175.8-81.5-67.3000111.8L36 C39 D44 L45 K46 Q50 S51L36-H48 HydrophobicContact CD2-CB 3.88Å; C39-H48 PolarHBondContact SG-CD2 2.91Å; D44-H48 PolarHBondContact O-CD2 3.11Å; D44-H48 VanDerWaalsContact O-CD2 3.28Å; D44-H48 PolarHBondContact O-N 3.04Å; L45-H48 PolarHBondContact O-N 2.89Å; K46-H48 PolarHBondContact O-N 2.91Å; H48-Q50 PolarHBondContact O-N 3.21Å; H48-S51 PolarHBondContact O-N 3.24Å; H48-S51 PolarHBondContact O-OG 3.35Å
49L91.5Very high89.6Confident0 Ų052 Ų520%029%0.286CS..Hα-helixtrans-60.9-34.3176.3-68.5177.3000112.2L28 L36 L45 K46 S51 T52 Y54 F57 I329L28-L49 HydrophobicContact CD1-CD2 4.26Å; L36-L49 HydrophobicContact CD1-CD2 4.16Å; L36-L49 HydrophobicContact CD2-CD2 4.02Å; L36-L49 HydrophobicContact CD2-CG 4.13Å; L45-L49 HydrophobicContact CD2-CD1 3.54Å; L45-L49 HydrophobicContact CD2-CG 4.24Å; L45-L49 HydrophobicContact CG-CD1 4.45Å; L45-L49 WeakPolarHBondContact O-CG 3.41Å; L45-L49 PolarHBondContact O-N 2.94Å; K46-L49 PolarHBondContact O-N 2.92Å; L49-S51 PolarHBondContact O-N 2.93Å; L49-T52 PolarHBondContact O-N 3.4Å; L49-T52 PolarHBondContact O-OG1 3.08Å; L49-Y54 HydrophobicContact CD2-CD2 4.11Å; L49-Y54 WeakPolarHBondContact O-CB 3.41Å; L49-F57 HydrophobicContact CB-CE1 3.9Å; L49-F57 HydrophobicContact CB-CZ 4.5Å; L49-F57 HydrophobicContact CD1-CE1 4.09Å; L49-F57 HydrophobicContact CD1-CZ 3.84Å; L49-I329 HydrophobicContact CD1-CG2 3.92Å; L49-I329 HydrophobicContact CD2-CD1 4.07Å; L49-I329 HydrophobicContact CD2-CG1 4.44Å
50Q90.7Very high89.1Confident54 Ų5459.4 Ų59.425%0.25233%0.326SS..Hα-helixtrans-61.6-27.6174.7-76.7174.8-13.500114.1K46 L47 H48 T52 G55K46-Q50 VanDerWaalsContact O-CG 3.32Å; K46-Q50 WeakPolarHBondContact O-CG 3.45Å; K46-Q50 PolarHBondContact O-N 2.67Å; L47-Q50 WeakPolarHBondContact O-CB 3.46Å; L47-Q50 PolarHBondContact O-N 3.24Å; H48-Q50 PolarHBondContact O-N 3.21Å; Q50-T52 VanDerWaalsContact C-N 3.26Å; Q50-G55 WeakPolarHBondContact CA-O 3.31Å; Q50-G55 WeakPolarHBondContact CG-O 3.41Å
51S90.3Very high88.8Confident95 Ų9554.1 Ų54.166%0.66430%0.301SS*.THydrogen-bonded Turntrans-78.5-8.2174.8690000114.4L47 H48 L49L47-S51 PolarHBondContact O-N 3.26Å; H48-S51 PolarHBondContact O-N 3.24Å; H48-S51 PolarHBondContact O-OG 3.35Å; L49-S51 PolarHBondContact O-N 2.93Å
52T91.6Very high88.1Confident25 Ų2555 Ų5515%0.15332%0.315CS..SBendtrans-99.9-178.4177.472.50000110.5L28 L49 Q50 Y54 G55L28-T52 HydrophobicContact CD2-CG2 3.61Å; L49-T52 PolarHBondContact O-N 3.4Å; L49-T52 PolarHBondContact O-OG1 3.08Å; Q50-T52 VanDerWaalsContact C-N 3.26Å; T52-Y54 PolarHBondContact O-N 3.24Å; T52-Y54 WeakPolarHBondContact OG1-CD2 3.49Å; T52-Y54 PolarHBondContact OG1-N 3.45Å; T52-G55 PolarHBondContact O-N 2.64Å
53D89.5Confident87.5Confident108 Ų10858 Ų5858%0.57834%0.338SS*.THydrogen-bonded Turntrans-63.4-8.6176.3-79.33.3000113.9G26 G55 K77G26-D53 WeakPolarHBondContact CA-OD2 3.18Å; G26-D53 PolarHBondContact N-OD2 2.97Å; D53-G55 VanDerWaalsContact C-N 3.27Å; D53-G55 PolarHBondContact O-N 3.28Å; D53-K77 PolarHBondContact O-NZ 2.9Å
54Y89.3Confident87.2Confident8 Ų860.5 Ų60.53%0.03136%0.36CS..THydrogen-bonded Turntrans-61.1-36.2166.1-79.8-78.1000112.2L28 L49 T52 F57 L74 K77 E325 I329L28-Y54 HydrophobicContact CD1-CE2 4.44Å; L28-Y54 HydrophobicContact CD2-CD2 4.43Å; L28-Y54 HydrophobicContact CD2-CE2 4.39Å; L28-Y54 HydrophobicContact CG-CE2 4.27Å; L49-Y54 HydrophobicContact CD2-CD2 4.11Å; L49-Y54 WeakPolarHBondContact O-CB 3.41Å; T52-Y54 PolarHBondContact O-N 3.24Å; T52-Y54 WeakPolarHBondContact OG1-CD2 3.49Å; T52-Y54 PolarHBondContact OG1-N 3.45Å; Y54-F57 HydrophobicContact CD1-CD1 4.24Å; Y54-F57 HydrophobicContact CD1-CE1 4.15Å; Y54-F57 HydrophobicContact CD1-CE2 4.44Å; Y54-F57 HydrophobicContact CD1-CG 4.43Å; Y54-F57 HydrophobicContact CD1-CZ 4.24Å; Y54-F57 HydrophobicContact CG-CD1 4.4Å; Y54-F57 HydrophobicContact CG-CE1 4.2Å; Y54-L74 HydrophobicContact CD1-CD2 3.73Å; Y54-L74 HydrophobicContact CE1-CD2 3.14Å; Y54-K77 HydrophobicContact CD1-CD 3.51Å; Y54-K77 HydrophobicContact CE1-CD 3.8Å; Y54-K77 HydrophobicContact CG-CD 4.47Å; Y54-K77 PolarHBondContact O-NZ 3.37Å; Y54-E325 PolarHBondContact OH-OE2 3.42Å; Y54-I329 HydrophobicContact CE2-CD1 3.72Å
55G88.9Confident86.9Confident22 Ų2258.7 Ų58.723%0.22735%0.35CS..THydrogen-bonded Turntrans55.3-142.2177.900000112.8Q50 T52 D53 F57Q50-G55 WeakPolarHBondContact CA-O 3.31Å; Q50-G55 WeakPolarHBondContact CG-O 3.41Å; T52-G55 PolarHBondContact O-N 2.64Å; D53-G55 VanDerWaalsContact C-N 3.27Å; D53-G55 PolarHBondContact O-N 3.28Å; G55-F57 PolarHBondContact O-N 3.37Å
56N87.4Confident86.9Confident124 Ų12461.8 Ų61.866%0.66337%0.369SS*.THydrogen-bonded Turntrans-81.530.9-173.2-69.9-29000114.7L58 A59N56-L58 PolarHBondContact O-N 3.45Å; N56-A59 HydrophobicContact CB-CB 3.97Å; N56-A59 VanDerWaalsContact O-CB 3.27Å; N56-A59 WeakPolarHBondContact O-CB 3.06Å; N56-A59 PolarHBondContact O-N 3.1Å; N56-A59 VanDerWaalsContact O-N 3.07Å
57F86.9Confident86.9Confident38 Ų3861.9 Ų61.917%0.16737%0.371CS..THydrogen-bonded Turntrans-63.3-25-17582.6-68.5000114.1L49 Y54 G55 R73 L74L49-F57 HydrophobicContact CB-CE1 3.9Å; L49-F57 HydrophobicContact CB-CZ 4.5Å; L49-F57 HydrophobicContact CD1-CE1 4.09Å; L49-F57 HydrophobicContact CD1-CZ 3.84Å; Y54-F57 HydrophobicContact CD1-CD1 4.24Å; Y54-F57 HydrophobicContact CD1-CE1 4.15Å; Y54-F57 HydrophobicContact CD1-CE2 4.44Å; Y54-F57 HydrophobicContact CD1-CG 4.43Å; Y54-F57 HydrophobicContact CD1-CZ 4.24Å; Y54-F57 HydrophobicContact CG-CD1 4.4Å; Y54-F57 HydrophobicContact CG-CE1 4.2Å; G55-F57 PolarHBondContact O-N 3.37Å; F57-R73 HydrophobicContact CD2-CB 3.79Å; F57-R73 HydrophobicContact CE2-CB 3.98Å; F57-L74 HydrophobicContact CE2-CD2 3.78Å; F57-L74 HydrophobicContact CE2-CG 4.09Å; F57-L74 HydrophobicContact CZ-CD2 3.94Å
58L84Confident86.9Confident0 Ų060.3 Ų60.30%037%0.369CS..THydrogen-bonded Turntrans-102.111176.5-65.8171.7000113.8K46 N56 N60 E61 L65 I70 R73K46-L58 HydrophobicContact CB-CD1 4.03Å; K46-L58 HydrophobicContact CD-CB 3.87Å; K46-L58 HydrophobicContact CD-CD1 4.27Å; K46-L58 WeakPolarHBondContact CE-O 3.49Å; K46-L58 HydrophobicContact CG-CB 3.96Å; K46-L58 HydrophobicContact CG-CD1 3.86Å; K46-L58 PolarHBondContact NZ-O 2.77Å; N56-L58 PolarHBondContact O-N 3.45Å; L58-N60 VanDerWaalsContact C-N 3.28Å; L58-N60 PolarHBondContact O-N 2.89Å; L58-E61 HydrophobicContact CD2-CG 4.13Å; L58-E61 PolarHBondContact O-N 2.96Å; L58-L65 HydrophobicContact CD1-CD2 4.18Å; L58-L65 HydrophobicContact CD2-CD1 4.32Å; L58-I70 HydrophobicContact CD1-CG1 4.42Å; L58-R73 HydrophobicContact CD2-CB 3.89Å; L58-R73 HydrophobicContact CD2-CG 3.97Å
59A79.7Confident86.9Confident54 Ų5458.6 Ų58.645%0.44636%0.364SS..THydrogen-bonded Turntrans-64.2-31.4-171.600000113.7N56N56-A59 HydrophobicContact CB-CB 3.97Å; N56-A59 VanDerWaalsContact O-CB 3.27Å; N56-A59 WeakPolarHBondContact O-CB 3.06Å; N56-A59 PolarHBondContact O-N 3.1Å; N56-A59 VanDerWaalsContact O-N 3.07Å
60N81.3Confident86.9Confident160 Ų16058.6 Ų58.686%0.85636%0.364SS*.THydrogen-bonded Turntrans-91.4-3.1-177-64.4-28.5000113.9L58L58-N60 VanDerWaalsContact C-N 3.28Å; L58-N60 PolarHBondContact O-N 2.89Å
61E83Confident87Confident42 Ų4257.9 Ų57.920%0.19636%0.362CS..PPolyproline II helixtrans-80.2126.9-178.6-66.5-55.5140.400111.5L58 L65 V69 R73L58-E61 HydrophobicContact CD2-CG 4.13Å; L58-E61 PolarHBondContact O-N 2.96Å; E61-L65 HydrophobicContact CB-CD1 4.18Å; E61-V69 HydrophobicContact CB-CG1 4.3Å; E61-V69 HydrophobicContact CG-CG1 3.64Å; E61-V69 WeakPolarHBondContact OE2-CG1 3.4Å; E61-R73 HydrophobicContact CG-CG 4.49Å; E61-R73 IonicContact OE1-CZ 3.88Å; E61-R73 IonicContact OE1-NE 2.75Å; E61-R73 PolarHBondContact OE1-NE 3.43Å; E61-R73 IonicContact OE1-NH2 3.81Å; E61-R73 PolarHBondContact OE1-NH2 3.41Å
62A78.3Confident87Confident84 Ų8457.1 Ų57.169%0.69435%0.35SS*.PPolyproline II helixtrans-75140.3176.900000111
63S78.7Confident87Confident84 Ų8460 Ų6059%0.58736%0.358SS*.SBendtrans-70.7145.9171-56.10000110.7E43E43-S63 PolarHBondContact OE1-OG 3.23Å
64P82.6Confident87.1Confident116 Ų11654.9 Ų54.975%0.75333%0.331SS*.SBendcis-80.7132.54.432-33.5000112.8
65L87.1Confident87.2Confident16 Ų1657.3 Ų57.38%0.08434%0.341CS..PPolyproline II helixtrans-65.5135.9172.8-167.565.4000109.9L42 K46 L58 E61 V69 I70L42-L65 HydrophobicContact CB-CB 4.39Å; L42-L65 HydrophobicContact CB-CD2 4.26Å; L42-L65 VanDerWaalsContact CD1-O 3.28Å; L42-L65 WeakPolarHBondContact CD1-O 3.33Å; K46-L65 HydrophobicContact CB-CD2 4.09Å; K46-L65 HydrophobicContact CD-CD2 4.22Å; L58-L65 HydrophobicContact CD1-CD2 4.18Å; L58-L65 HydrophobicContact CD2-CD1 4.32Å; E61-L65 HydrophobicContact CB-CD1 4.18Å; L65-V69 HydrophobicContact CD1-CB 4.34Å; L65-V69 HydrophobicContact CD1-CG1 3.89Å; L65-I70 HydrophobicContact CD1-CG1 4.18Å; L65-I70 HydrophobicContact CD2-CD1 3.7Å; L65-I70 HydrophobicContact CD2-CG1 3.73Å; L65-I70 HydrophobicContact CG-CD1 4.04Å; L65-I70 HydrophobicContact CG-CG1 3.86Å
66T90.9Very high87.3Confident66 Ų6660.7 Ų60.741%0.40535%0.352SS..  trans-113.5156.117568.60000110.1S68 V69 I70T66-S68 PolarHBondContact O-N 3.47Å; T66-V69 PolarHBondContact O-N 3.3Å; T66-V69 VanDerWaalsContact O-N 3.17Å; T66-V69 VanDerWaalsContact OG1-CG2 3.29Å; T66-V69 WeakPolarHBondContact OG1-CG2 3.43Å; T66-V69 PolarHBondContact OG1-N 2.88Å; T66-I70 PolarHBondContact O-N 2.89Å
67V91.8Very high87.5Confident24 Ų2457.1 Ų57.115%0.14533%0.33CS..Hα-helixtrans-61.6-36.4178.5-175.40000111.3L42 V69 I70 D71 V330 A333 E334 A337L42-V67 HydrophobicContact CD1-CG2 4.24Å; V67-V69 VanDerWaalsContact C-N 3.35Å; V67-V69 PolarHBondContact O-N 3.21Å; V67-I70 WeakPolarHBondContact O-CB 2.98Å; V67-I70 PolarHBondContact O-N 3.37Å; V67-D71 PolarHBondContact O-N 2.99Å; V67-V330 HydrophobicContact CG1-CG1 3.91Å; V67-A333 HydrophobicContact CG1-CB 4.06Å; V67-A333 HydrophobicContact CG2-CB 4.21Å; V67-E334 HydrophobicContact CB-CG 4.45Å; V67-E334 HydrophobicContact CG1-CG 3.64Å; V67-E334 HydrophobicContact CG2-CG 4.4Å; V67-A337 HydrophobicContact CG2-CB 3.83Å
68S90.8Very high87.8Confident73 Ų7355.9 Ų55.951%0.5133%0.325SS..Hα-helixtrans-58.3-45.1174.5-169.60000112.1T66 I70 D71 D72T66-S68 PolarHBondContact O-N 3.47Å; S68-I70 VanDerWaalsContact C-N 3.31Å; S68-I70 PolarHBondContact O-N 2.84Å; S68-D71 PolarHBondContact O-N 3.26Å; S68-D72 WeakPolarHBondContact O-CB 3.34Å; S68-D72 PolarHBondContact O-N 3.49Å
69V90.9Very high88.2Confident37 Ų3756.1 Ų56.122%0.22433%0.326CS..Hα-helixtrans-65-37.3179.4171.10000111.2E61 L65 T66 V67 R73E61-V69 HydrophobicContact CB-CG1 4.3Å; E61-V69 HydrophobicContact CG-CG1 3.64Å; E61-V69 WeakPolarHBondContact OE2-CG1 3.4Å; L65-V69 HydrophobicContact CD1-CB 4.34Å; L65-V69 HydrophobicContact CD1-CG1 3.89Å; T66-V69 PolarHBondContact O-N 3.3Å; T66-V69 VanDerWaalsContact O-N 3.17Å; T66-V69 VanDerWaalsContact OG1-CG2 3.29Å; T66-V69 WeakPolarHBondContact OG1-CG2 3.43Å; T66-V69 PolarHBondContact OG1-N 2.88Å; V67-V69 VanDerWaalsContact C-N 3.35Å; V67-V69 PolarHBondContact O-N 3.21Å; V69-R73 HydrophobicContact CG1-CG 4.47Å; V69-R73 WeakPolarHBondContact O-CB 3.41Å; V69-R73 VanDerWaalsContact O-CG 3.27Å; V69-R73 WeakPolarHBondContact O-CG 3.22Å; V69-R73 PolarHBondContact O-N 2.72Å; V69-R73 VanDerWaalsContact O-N 3.11Å
70I91.5Very high88.9Confident0 Ų057.8 Ų57.80%033%0.331CS..Hα-helixtrans-62.5-50.9174.4-63.8168000109.7L42 L45 L58 L65 T66 V67 S68 D72 R73 L74 I329 A333L42-I70 HydrophobicContact CD2-CD1 4.15Å; L45-I70 HydrophobicContact CD2-CD1 4.1Å; L58-I70 HydrophobicContact CD1-CG1 4.42Å; L65-I70 HydrophobicContact CD1-CG1 4.18Å; L65-I70 HydrophobicContact CD2-CD1 3.7Å; L65-I70 HydrophobicContact CD2-CG1 3.73Å; L65-I70 HydrophobicContact CG-CD1 4.04Å; L65-I70 HydrophobicContact CG-CG1 3.86Å; T66-I70 PolarHBondContact O-N 2.89Å; V67-I70 WeakPolarHBondContact O-CB 2.98Å; V67-I70 PolarHBondContact O-N 3.37Å; S68-I70 VanDerWaalsContact C-N 3.31Å; S68-I70 PolarHBondContact O-N 2.84Å; I70-D72 PolarHBondContact O-N 3.37Å; I70-R73 PolarHBondContact O-N 3.47Å; I70-L74 HydrophobicContact CG2-CD1 3.74Å; I70-L74 HydrophobicContact CG2-CG 4.15Å; I70-L74 WeakPolarHBondContact O-CB 3.43Å; I70-L74 WeakPolarHBondContact O-CG 3.44Å; I70-L74 PolarHBondContact O-N 2.86Å; I70-I329 HydrophobicContact CG2-CG2 4.22Å; I70-A333 HydrophobicContact CD1-CB 4.14Å
71D92.1Very high89.4Confident40 Ų4051.8 Ų51.821%0.21430%0.298CS..Hα-helixtrans-56.7-46.6179.4-173.732.2000112V67 S68 R73 L74 K75 V330V67-D71 PolarHBondContact O-N 2.99Å; S68-D71 PolarHBondContact O-N 3.26Å; D71-R73 PolarHBondContact O-N 3.25Å; D71-L74 PolarHBondContact O-N 3.2Å; D71-K75 VanDerWaalsContact CG-NZ 3.26Å; D71-K75 WeakPolarHBondContact O-CG 3.4Å; D71-K75 PolarHBondContact O-N 2.82Å; D71-K75 WeakPolarHBondContact OD1-CE 3.41Å; D71-K75 IonicContact OD1-NZ 3.8Å; D71-K75 PolarHBondContact OD1-NZ 2.89Å; D71-K75 WeakPolarHBondContact OD2-CE 3.49Å; D71-K75 IonicContact OD2-NZ 3.84Å; D71-K75 PolarHBondContact OD2-NZ 3.28Å; D71-V330 HydrophobicContact CB-CG2 3.76Å
72D90.7Very high90Very high78 Ų7850.1 Ų50.142%0.41729%0.29SS..Hα-helixtrans-61.9-44.2179.3-67.4-26.6000112.2S68 I70 K75 E76S68-D72 WeakPolarHBondContact O-CB 3.34Å; S68-D72 PolarHBondContact O-N 3.49Å; I70-D72 PolarHBondContact O-N 3.37Å; D72-K75 PolarHBondContact O-N 2.92Å; D72-E76 WeakPolarHBondContact O-CB 3.31Å; D72-E76 PolarHBondContact O-N 3.45Å
73R90.9Very high90.7Very high86 Ų8651.7 Ų51.733%0.32528%0.278SS..Hα-helixtrans-72.2-32.4179.8-67-63.2-173-164.6-3.3112.9F57 L58 E61 V69 I70 D71 E76 K77F57-R73 HydrophobicContact CD2-CB 3.79Å; F57-R73 HydrophobicContact CE2-CB 3.98Å; L58-R73 HydrophobicContact CD2-CB 3.89Å; L58-R73 HydrophobicContact CD2-CG 3.97Å; E61-R73 HydrophobicContact CG-CG 4.49Å; E61-R73 IonicContact OE1-CZ 3.88Å; E61-R73 IonicContact OE1-NE 2.75Å; E61-R73 PolarHBondContact OE1-NE 3.43Å; E61-R73 IonicContact OE1-NH2 3.81Å; E61-R73 PolarHBondContact OE1-NH2 3.41Å; V69-R73 HydrophobicContact CG1-CG 4.47Å; V69-R73 WeakPolarHBondContact O-CB 3.41Å; V69-R73 VanDerWaalsContact O-CG 3.27Å; V69-R73 WeakPolarHBondContact O-CG 3.22Å; V69-R73 PolarHBondContact O-N 2.72Å; V69-R73 VanDerWaalsContact O-N 3.11Å; I70-R73 PolarHBondContact O-N 3.47Å; D71-R73 PolarHBondContact O-N 3.25Å; R73-E76 WeakPolarHBondContact CD-OE2 3.28Å; R73-E76 IonicContact CZ-OE2 3.28Å; R73-E76 IonicContact NE-OE2 2.7Å; R73-E76 IonicContact NH1-OE1 3.71Å; R73-E76 IonicContact NH1-OE2 3.42Å; R73-E76 PolarHBondContact NH1-OE2 3.48Å; R73-K77 PolarHBondContact O-N 3.25Å; R73-K77 VanDerWaalsContact O-N 3.11Å
74L92.4Very high91.5Very high1 Ų151.2 Ų51.21%0.00527%0.266CS..Hα-helixtrans-62.9-48.6171.6-71.6172.3000110.6Y54 F57 I70 D71 E76 K77 M78 C326 I329 V330Y54-L74 HydrophobicContact CD1-CD2 3.73Å; Y54-L74 HydrophobicContact CE1-CD2 3.14Å; F57-L74 HydrophobicContact CE2-CD2 3.78Å; F57-L74 HydrophobicContact CE2-CG 4.09Å; F57-L74 HydrophobicContact CZ-CD2 3.94Å; I70-L74 HydrophobicContact CG2-CD1 3.74Å; I70-L74 HydrophobicContact CG2-CG 4.15Å; I70-L74 WeakPolarHBondContact O-CB 3.43Å; I70-L74 WeakPolarHBondContact O-CG 3.44Å; I70-L74 PolarHBondContact O-N 2.86Å; D71-L74 PolarHBondContact O-N 3.2Å; L74-E76 PolarHBondContact O-N 2.94Å; L74-K77 PolarHBondContact O-N 3.32Å; L74-M78 PolarHBondContact O-N 3.1Å; L74-M78 VanDerWaalsContact O-N 3.12Å; L74-C326 HydrophobicContact CB-CB 4.4Å; L74-C326 HydrophobicContact CD1-CB 4.41Å; L74-I329 HydrophobicContact CD1-CB 3.97Å; L74-I329 HydrophobicContact CD1-CD1 4.31Å; L74-I329 HydrophobicContact CD1-CG2 3.78Å; L74-I329 HydrophobicContact CD2-CD1 3.93Å; L74-V330 HydrophobicContact CD1-CG2 4.11Å
75K91.6Very high92.1Very high58 Ų5845.7 Ų45.725%0.25223%0.23SC..Hα-helixtrans-60.5-43.9176.1-71.7170.6-172.2157.30111.9D71 D72 K77 M78 V79D71-K75 VanDerWaalsContact CG-NZ 3.26Å; D71-K75 WeakPolarHBondContact O-CG 3.4Å; D71-K75 PolarHBondContact O-N 2.82Å; D71-K75 WeakPolarHBondContact OD1-CE 3.41Å; D71-K75 IonicContact OD1-NZ 3.8Å; D71-K75 PolarHBondContact OD1-NZ 2.89Å; D71-K75 WeakPolarHBondContact OD2-CE 3.49Å; D71-K75 IonicContact OD2-NZ 3.84Å; D71-K75 PolarHBondContact OD2-NZ 3.28Å; D72-K75 PolarHBondContact O-N 2.92Å; K75-K77 PolarHBondContact O-N 3.49Å; K75-M78 PolarHBondContact O-N 3.17Å; K75-V79 WeakPolarHBondContact O-CB 3.48Å; K75-V79 WeakPolarHBondContact O-CG2 3.44Å; K75-V79 PolarHBondContact O-N 3.07Å
76E91.4Very high92.4Very high94 Ų9447.9 Ų47.944%0.43924%0.238SC..Hα-helixtrans-59.5-45.1178.8-173.2179.5-167.600111.8D72 R73 L74 M78 V79 V80D72-E76 WeakPolarHBondContact O-CB 3.31Å; D72-E76 PolarHBondContact O-N 3.45Å; R73-E76 WeakPolarHBondContact CD-OE2 3.28Å; R73-E76 IonicContact CZ-OE2 3.28Å; R73-E76 IonicContact NE-OE2 2.7Å; R73-E76 IonicContact NH1-OE1 3.71Å; R73-E76 IonicContact NH1-OE2 3.42Å; R73-E76 PolarHBondContact NH1-OE2 3.48Å; L74-E76 PolarHBondContact O-N 2.94Å; E76-M78 PolarHBondContact O-N 3.23Å; E76-V79 PolarHBondContact O-N 3.15Å; E76-V80 WeakPolarHBondContact O-CG2 3.21Å; E76-V80 PolarHBondContact O-N 2.91Å
77K91.7Very high92.6Very high48 Ų4851 Ų5121%0.20925%0.252CS..Hα-helixtrans-59-48.4175.7-174.6-173.2172.486.50111.4D53 Y54 R73 L74 K75 V79 V80 E81D53-K77 PolarHBondContact O-NZ 2.9Å; Y54-K77 HydrophobicContact CD1-CD 3.51Å; Y54-K77 HydrophobicContact CE1-CD 3.8Å; Y54-K77 HydrophobicContact CG-CD 4.47Å; Y54-K77 PolarHBondContact O-NZ 3.37Å; R73-K77 PolarHBondContact O-N 3.25Å; R73-K77 VanDerWaalsContact O-N 3.11Å; L74-K77 PolarHBondContact O-N 3.32Å; K75-K77 PolarHBondContact O-N 3.49Å; K77-V79 VanDerWaalsContact C-N 3.29Å; K77-V79 PolarHBondContact O-N 2.91Å; K77-V80 PolarHBondContact O-N 3.14Å; K77-E81 WeakPolarHBondContact CE-OE1 3.12Å; K77-E81 IonicContact NZ-OE1 3.3Å; K77-E81 WeakPolarHBondContact O-CG 3.26Å; K77-E81 PolarHBondContact O-N 3.03Å; K77-E81 VanDerWaalsContact O-N 3.09Å
78M92.7Very high92.7Very high12 Ų1254.7 Ų54.76%0.05927%0.267CS..Hα-helixtrans-58.7-41.3177.3-174.9-177.776.500111.8L74 K75 E76 E81 F82 L132 K322 E323L74-M78 PolarHBondContact O-N 3.1Å; L74-M78 VanDerWaalsContact O-N 3.12Å; K75-M78 PolarHBondContact O-N 3.17Å; E76-M78 PolarHBondContact O-N 3.23Å; M78-E81 PolarHBondContact O-N 3.05Å; M78-F82 WeakPolarHBondContact O-CB 3.28Å; M78-F82 PolarHBondContact O-N 2.95Å; M78-L132 HydrophobicContact CE-CD1 4.12Å; M78-K322 HydrophobicContact CG-CB 4.44Å; M78-K322 HydrophobicContact SD-CB 4.24Å; M78-E323 HydrophobicContact CE-CG 4.1Å; M78-E323 HydrophobicContact SD-CG 3.81Å
79V92.9Very high92.9Very high5 Ų551.9 Ų51.93%0.0325%0.248CC..Hα-helixtrans-65.4-41.8178.5169.70000111.5K75 E76 K77 F82 R83 P131 L132K75-V79 WeakPolarHBondContact O-CB 3.48Å; K75-V79 WeakPolarHBondContact O-CG2 3.44Å; K75-V79 PolarHBondContact O-N 3.07Å; E76-V79 PolarHBondContact O-N 3.15Å; K77-V79 VanDerWaalsContact C-N 3.29Å; K77-V79 PolarHBondContact O-N 2.91Å; V79-F82 PolarHBondContact O-N 3.27Å; V79-R83 HydrophobicContact CG1-CG 4.23Å; V79-R83 WeakPolarHBondContact O-CB 3.48Å; V79-R83 VanDerWaalsContact O-CG 3.29Å; V79-R83 WeakPolarHBondContact O-CG 3.1Å; V79-R83 PolarHBondContact O-N 3.37Å; V79-P131 HydrophobicContact CG1-CB 4.21Å; V79-P131 HydrophobicContact CG2-CB 3.77Å; V79-P131 HydrophobicContact CG2-CG 4.19Å; V79-L132 HydrophobicContact CB-CD2 4.19Å; V79-L132 HydrophobicContact CG1-CD2 4.07Å; V79-L132 HydrophobicContact CG2-CD2 3.89Å; V79-L132 HydrophobicContact CG2-CG 3.82Å
80V92.8Very high93Very high90 Ų9057.6 Ų57.655%0.54527%0.267SS..Hα-helixtrans-62-46.1177.2170.10000110.8E76 K77 R83 H84E76-V80 WeakPolarHBondContact O-CG2 3.21Å; E76-V80 PolarHBondContact O-N 2.91Å; K77-V80 PolarHBondContact O-N 3.14Å; V80-R83 PolarHBondContact O-N 2.85Å; V80-H84 WeakPolarHBondContact O-CB 3.22Å; V80-H84 PolarHBondContact O-N 2.95Å
81E93.3Very high93Very high34 Ų3461.7 Ų61.716%0.15929%0.286CS..Hα-helixtrans-61.8-45.4177.1-70.2172.5-174.300111.4L23 K77 M78 H84 M85L23-E81 HydrophobicContact CD1-CB 4.3Å; L23-E81 HydrophobicContact CD1-CG 4.47Å; L23-E81 HydrophobicContact CD2-CG 4.35Å; K77-E81 WeakPolarHBondContact CE-OE1 3.12Å; K77-E81 IonicContact NZ-OE1 3.3Å; K77-E81 WeakPolarHBondContact O-CG 3.26Å; K77-E81 PolarHBondContact O-N 3.03Å; K77-E81 VanDerWaalsContact O-N 3.09Å; M78-E81 PolarHBondContact O-N 3.05Å; E81-H84 PolarHBondContact O-N 3.12Å; E81-M85 PolarHBondContact O-N 3.43Å; E81-M85 VanDerWaalsContact O-N 3.12Å
82F94.6Very high93.1Very high6 Ų662.1 Ų62.13%0.02629%0.291CS..Hα-helixtrans-63.5-48.1177.8-175.7-88.1000112.6M78 V79 H84 M85 R86 L97 I100 T101 L132 V319M78-F82 WeakPolarHBondContact O-CB 3.28Å; M78-F82 PolarHBondContact O-N 2.95Å; V79-F82 PolarHBondContact O-N 3.27Å; F82-H84 VanDerWaalsContact C-N 3.27Å; F82-H84 PolarHBondContact O-N 2.7Å; F82-M85 PolarHBondContact O-N 2.79Å; F82-M85 VanDerWaalsContact O-N 3.15Å; F82-R86 HydrophobicContact CE1-CB 4.39Å; F82-R86 PolarHBondContact O-N 3.02Å; F82-L97 HydrophobicContact CE2-CD2 4.01Å; F82-L97 HydrophobicContact CZ-CB 4.13Å; F82-L97 HydrophobicContact CZ-CD2 4.32Å; F82-L97 WeakPolarHBondContact CZ-O 3.35Å; F82-I100 HydrophobicContact CE2-CB 4.26Å; F82-I100 HydrophobicContact CE2-CD1 4.38Å; F82-I100 HydrophobicContact CE2-CG2 3.97Å; F82-I100 HydrophobicContact CZ-CB 4.27Å; F82-I100 HydrophobicContact CZ-CG2 4.3Å; F82-T101 HydrophobicContact CE1-CG2 3.51Å; F82-T101 HydrophobicContact CZ-CG2 3.73Å; F82-L132 HydrophobicContact CB-CD2 3.95Å; F82-L132 HydrophobicContact CD1-CD1 4.43Å; F82-L132 HydrophobicContact CD1-CD2 3.45Å; F82-L132 VanDerWaalsContact CD1-CD2 3.45Å; F82-L132 HydrophobicContact CE1-CD2 4.16Å; F82-L132 HydrophobicContact CG-CD1 4.23Å; F82-L132 HydrophobicContact CG-CD2 3.82Å; F82-V319 HydrophobicContact CD2-CG2 3.61Å; F82-V319 HydrophobicContact CE2-CG2 3.92Å
83R94.1Very high93.2Very high118 Ų11858.4 Ų58.445%0.44527%0.271SS..Hα-helixtrans-61.8-37.6178.2-74.9178.4-178.8175.42.1111.3V79 V80 R86 N87 P131V79-R83 HydrophobicContact CG1-CG 4.23Å; V79-R83 WeakPolarHBondContact O-CB 3.48Å; V79-R83 VanDerWaalsContact O-CG 3.29Å; V79-R83 WeakPolarHBondContact O-CG 3.1Å; V79-R83 PolarHBondContact O-N 3.37Å; V80-R83 PolarHBondContact O-N 2.85Å; R83-R86 PolarHBondContact O-N 3.33Å; R83-N87 VanDerWaalsContact O-CB 3.29Å; R83-N87 WeakPolarHBondContact O-CB 3.35Å; R83-N87 PolarHBondContact O-N 3.34Å; R83-N87 PolarHBondContact O-ND2 3.21Å; R83-N87 PolarHBondContact O-OD1 2.77Å; R83-P131 PolarHBondContact NH2-O 3.19Å; R83-P131 VanDerWaalsContact NH2-O 3.11Å
84H94.5Very high93.4Very high74 Ų7454.5 Ų54.534%0.34326%0.257SS..Hα-helixtrans-60.3-46.9174.4-177.186.9000111.6Y15 V80 E81 F82 H88Y15-H84 PolarHBondContact OH-NE2 3.37Å; V80-H84 WeakPolarHBondContact O-CB 3.22Å; V80-H84 PolarHBondContact O-N 2.95Å; E81-H84 PolarHBondContact O-N 3.12Å; F82-H84 VanDerWaalsContact C-N 3.27Å; F82-H84 PolarHBondContact O-N 2.7Å; H84-H88 AromaticContact CE1-CE1 3.35Å; H84-H88 PolarHBondContact CE1-CE1 2.73Å; H84-H88 AromaticContact CE1-ND1 3.79Å; H84-H88 AromaticContact ND1-CE1 3.72Å; H84-H88 AromaticContact NE2-CE1 3.79Å; H84-H88 AromaticContact NE2-ND1 3.84Å; H84-H88 PolarHBondContact O-N 2.95Å; H84-H88 PolarHBondContact O-ND1 3.31Å
85M94.7Very high93.5Very high0 Ų056.1 Ų56.10%027%0.268CS..Hα-helixtrans-62-46.1175.5-68.5-175.4-70.600111.7L16 L19 V20 L23 E81 F82 N87 H88 A89 L97 F315 F318L16-M85 HydrophobicContact CD2-CB 4.32Å; L16-M85 HydrophobicContact CD2-CG 4.39Å; L19-M85 HydrophobicContact CD2-CG 4.14Å; V20-M85 HydrophobicContact CB-SD 3.97Å; V20-M85 HydrophobicContact CG2-SD 4.14Å; L23-M85 HydrophobicContact CD1-SD 4.43Å; E81-M85 PolarHBondContact O-N 3.43Å; E81-M85 VanDerWaalsContact O-N 3.12Å; F82-M85 PolarHBondContact O-N 2.79Å; F82-M85 VanDerWaalsContact O-N 3.15Å; M85-N87 PolarHBondContact O-N 3.41Å; M85-H88 PolarHBondContact O-N 2.7Å; M85-A89 WeakPolarHBondContact O-CB 3.5Å; M85-A89 PolarHBondContact O-N 3.07Å; M85-L97 HydrophobicContact CB-CD1 4.44Å; M85-F315 HydrophobicContact SD-CD1 3.78Å; M85-F315 HydrophobicContact SD-CE1 4.02Å; M85-F318 HydrophobicContact CE-CD1 3.95Å; M85-F318 HydrophobicContact CE-CE1 4.03Å
86R94.4Very high93.7Very high62 Ų6253.3 Ų53.323%0.23426%0.256CS..Hα-helixtrans-62.3-39.3-179.7179.260.8-171.892.1-8.2113.4F82 R83 H88 A89 A94 L97 D98F82-R86 HydrophobicContact CE1-CB 4.39Å; F82-R86 PolarHBondContact O-N 3.02Å; R83-R86 PolarHBondContact O-N 3.33Å; R86-H88 VanDerWaalsContact C-N 3.29Å; R86-H88 PolarHBondContact O-N 3.05Å; R86-A89 PolarHBondContact O-N 3.2Å; R86-A94 PolarHBondContact NE-O 2.87Å; R86-A94 VanDerWaalsContact NH1-CB 3.34Å; R86-L97 HydrophobicContact CB-CD1 4.14Å; R86-D98 IonicContact CZ-OD1 3.72Å; R86-D98 IonicContact CZ-OD2 2.7Å; R86-D98 IonicContact NE-OD1 3.81Å; R86-D98 PolarHBondContact NE-OD1 2.77Å; R86-D98 IonicContact NE-OD2 3.6Å; R86-D98 VanDerWaalsContact NH2-CG 3.35Å; R86-D98 IonicContact NH2-OD1 3.09Å; R86-D98 PolarHBondContact NH2-OD1 3.1Å; R86-D98 IonicContact NH2-OD2 3.99Å; R86-D98 PolarHBondContact NH2-OD2 3.33Å
87N94.3Very high93.9Very high131 Ų13148.9 Ų48.970%0.70124%0.235SC*.Hα-helixtrans-68.9-26.1-179.4-72.6-13000113.3R83 M85R83-N87 VanDerWaalsContact O-CB 3.29Å; R83-N87 WeakPolarHBondContact O-CB 3.35Å; R83-N87 PolarHBondContact O-N 3.34Å; R83-N87 PolarHBondContact O-ND2 3.21Å; R83-N87 PolarHBondContact O-OD1 2.77Å; M85-N87 PolarHBondContact O-N 3.41Å
88H94.2Very high94Very high101 Ų10148.5 Ų48.547%0.46824%0.236SC..Hα-helixtrans-97.9-6.4177.6-67.685000112.6L16 H84 M85 R86L16-H88 HydrophobicContact CD1-CB 4.44Å; L16-H88 HydrophobicContact CD2-CB 3.97Å; H84-H88 AromaticContact CE1-CE1 3.35Å; H84-H88 PolarHBondContact CE1-CE1 2.73Å; H84-H88 AromaticContact CE1-ND1 3.79Å; H84-H88 AromaticContact ND1-CE1 3.72Å; H84-H88 AromaticContact NE2-CE1 3.79Å; H84-H88 AromaticContact NE2-ND1 3.84Å; H84-H88 PolarHBondContact O-N 2.95Å; H84-H88 PolarHBondContact O-ND1 3.31Å; M85-H88 PolarHBondContact O-N 2.7Å; R86-H88 VanDerWaalsContact C-N 3.29Å; R86-H88 PolarHBondContact O-N 3.05Å
89A94.6Very high94Very high14 Ų1449.1 Ų49.112%0.11624%0.238CC..PPolyproline II helixtrans-77134.4-179.800000111.3L16 M85 R86 L93 A94 L97L16-A89 HydrophobicContact CD1-CB 3.9Å; M85-A89 WeakPolarHBondContact O-CB 3.5Å; M85-A89 PolarHBondContact O-N 3.07Å; R86-A89 PolarHBondContact O-N 3.2Å; A89-L93 HydrophobicContact CB-CB 4.28Å; A89-L93 HydrophobicContact CB-CD2 4.01Å; A89-L93 HydrophobicContact CB-CG 3.84Å; A89-A94 HydrophobicContact CB-CB 4.36Å; A89-L97 HydrophobicContact CB-CD1 3.77Å
90Y93.1Very high94.1Very high158 Ų15849 Ų4962%0.6224%0.237SC*.PPolyproline II helixtrans-102.7163.9168.4-169.1-108.5000110.3L93 A94Y90-L93 WeakPolarHBondContact O-CA 3.21Å; Y90-L93 WeakPolarHBondContact O-CB 3.33Å; Y90-L93 PolarHBondContact O-N 3.32Å; Y90-A94 PolarHBondContact O-N 2.86Å
91E91.8Very high94.1Very high86 Ų8645.2 Ų45.240%0.40222%0.215SC..THydrogen-bonded Turntrans-62138.8175.9-69.2-58.6155.800111.1A94 S95E91-A94 HydrophobicContact CG-CB 4.48Å; E91-A94 WeakPolarHBondContact OE1-CB 3.36Å; E91-S95 PolarHBondContact OE1-N 3.29Å; E91-S95 PolarHBondContact OE1-OG 3.32Å; E91-S95 VanDerWaalsContact OE1-OG 3.13Å; E91-S95 VanDerWaalsContact OE2-CB 3.25Å; E91-S95 WeakPolarHBondContact OE2-CB 3.41Å; E91-S95 PolarHBondContact OE2-N 3.36Å; E91-S95 PolarHBondContact OE2-OG 2.92Å
92P93.5Very high94.1Very high48 Ų4845.4 Ų45.431%0.31221%0.214SC..THydrogen-bonded Turncis-90.2-1.7734.5-37.4000116A94 S95 F96 L200 F312P92-A94 VanDerWaalsContact C-N 3.31Å; P92-A94 PolarHBondContact O-N 3.44Å; P92-S95 PolarHBondContact O-N 2.94Å; P92-F96 PolarHBondContact O-N 3.3Å; P92-F96 VanDerWaalsContact O-N 3.09Å; P92-L200 HydrophobicContact CB-CD2 3.65Å; P92-L200 HydrophobicContact CG-CD2 3.82Å; P92-F312 HydrophobicContact CB-CE2 4.41Å; P92-F312 HydrophobicContact CG-CE2 3.62Å; P92-F312 HydrophobicContact CG-CZ 3.84Å
93L94.1Very high94Very high0 Ų045.6 Ų45.60%022%0.216CC..Hα-helixtrans-66.3-35-178.6175.760.4000111.8N13 L16 A89 Y90 F96 L97 F312 F315N13-L93 HydrophobicContact CB-CD2 4.48Å; N13-L93 WeakPolarHBondContact OD1-CB 3.37Å; N13-L93 VanDerWaalsContact OD1-CD2 3.29Å; N13-L93 WeakPolarHBondContact OD1-CD2 3.41Å; L16-L93 HydrophobicContact CB-CD2 4.22Å; L16-L93 HydrophobicContact CD1-CD2 3.49Å; L16-L93 VanDerWaalsContact CD1-CD2 3.49Å; A89-L93 HydrophobicContact CB-CB 4.28Å; A89-L93 HydrophobicContact CB-CD2 4.01Å; A89-L93 HydrophobicContact CB-CG 3.84Å; Y90-L93 WeakPolarHBondContact O-CA 3.21Å; Y90-L93 WeakPolarHBondContact O-CB 3.33Å; Y90-L93 PolarHBondContact O-N 3.32Å; L93-F96 HydrophobicContact CD1-CB 4.48Å; L93-F96 HydrophobicContact CD1-CD1 4.27Å; L93-F96 WeakPolarHBondContact O-CB 3.15Å; L93-F96 PolarHBondContact O-N 2.96Å; L93-L97 HydrophobicContact CD1-CD1 4.27Å; L93-L97 HydrophobicContact CD1-CD2 4.43Å; L93-L97 HydrophobicContact CD1-CG 4Å; L93-L97 HydrophobicContact CG-CD1 4.16Å; L93-L97 HydrophobicContact CG-CG 4.33Å; L93-L97 WeakPolarHBondContact O-CG 3.28Å; L93-L97 PolarHBondContact O-N 3.36Å; L93-F312 HydrophobicContact CB-CD1 4.27Å; L93-F312 HydrophobicContact CB-CE1 3.98Å; L93-F312 HydrophobicContact CB-CZ 4.24Å; L93-F312 HydrophobicContact CD1-CB 4.23Å; L93-F312 HydrophobicContact CD1-CD1 3.74Å; L93-F312 HydrophobicContact CD1-CE1 4.31Å; L93-F312 HydrophobicContact CD1-CG 4Å; L93-F312 HydrophobicContact CG-CD1 4.43Å; L93-F315 HydrophobicContact CD1-CD2 3.52Å; L93-F315 HydrophobicContact CD1-CE2 3.6Å; L93-F315 HydrophobicContact CD1-CG 4.06Å; L93-F315 HydrophobicContact CD1-CZ 4.18Å; L93-F315 HydrophobicContact CD2-CE1 4.32Å; L93-F315 HydrophobicContact CD2-CE2 3.85Å; L93-F315 HydrophobicContact CD2-CZ 3.72Å; L93-F315 HydrophobicContact CG-CE2 4.41Å
94A94.7Very high94Very high4 Ų440.4 Ų40.43%0.03320%0.197CC..Hα-helixtrans-53.6-55.5173.200000111.7R86 A89 Y90 E91 P92 F96 L97 D98R86-A94 PolarHBondContact NE-O 2.87Å; R86-A94 VanDerWaalsContact NH1-CB 3.34Å; A89-A94 HydrophobicContact CB-CB 4.36Å; Y90-A94 PolarHBondContact O-N 2.86Å; E91-A94 HydrophobicContact CG-CB 4.48Å; E91-A94 WeakPolarHBondContact OE1-CB 3.36Å; P92-A94 VanDerWaalsContact C-N 3.31Å; P92-A94 PolarHBondContact O-N 3.44Å; A94-F96 VanDerWaalsContact C-N 3.33Å; A94-F96 PolarHBondContact O-N 2.84Å; A94-L97 PolarHBondContact O-N 3.46Å; A94-D98 PolarHBondContact O-N 3.09Å
95S94.2Very high93.8Very high35 Ų3538 Ų3825%0.24519%0.186CC..Hα-helixtrans-58.1-42174.1-68.10000112.7E91 P92 L97 D98 F99E91-S95 PolarHBondContact OE1-N 3.29Å; E91-S95 PolarHBondContact OE1-OG 3.32Å; E91-S95 VanDerWaalsContact OE1-OG 3.13Å; E91-S95 VanDerWaalsContact OE2-CB 3.25Å; E91-S95 WeakPolarHBondContact OE2-CB 3.41Å; E91-S95 PolarHBondContact OE2-N 3.36Å; E91-S95 PolarHBondContact OE2-OG 2.92Å; P92-S95 PolarHBondContact O-N 2.94Å; S95-L97 VanDerWaalsContact C-N 3.33Å; S95-L97 PolarHBondContact O-N 3.02Å; S95-D98 WeakPolarHBondContact O-CB 3.43Å; S95-D98 PolarHBondContact O-N 3.41Å; S95-D98 VanDerWaalsContact O-N 3.16Å; S95-F99 VanDerWaalsContact O-CD2 3.24Å; S95-F99 WeakPolarHBondContact O-CD2 3.42Å; S95-F99 PolarHBondContact O-N 2.99Å
96F95.4Very high93.6Very high0 Ų038 Ų380%019%0.186CC..Hα-helixtrans-58.8-44.2178-178-90.6000112.2P92 L93 A94 F99 I100 F193 F196 L200 T204 M208 F312 F315P92-F96 PolarHBondContact O-N 3.3Å; P92-F96 VanDerWaalsContact O-N 3.09Å; L93-F96 HydrophobicContact CD1-CB 4.48Å; L93-F96 HydrophobicContact CD1-CD1 4.27Å; L93-F96 WeakPolarHBondContact O-CB 3.15Å; L93-F96 PolarHBondContact O-N 2.96Å; A94-F96 VanDerWaalsContact C-N 3.33Å; A94-F96 PolarHBondContact O-N 2.84Å; F96-F99 WeakPolarHBondContact O-CB 3.29Å; F96-F99 PolarHBondContact O-N 3.03Å; F96-I100 HydrophobicContact CD1-CD1 4.19Å; F96-I100 HydrophobicContact CE1-CD1 3.84Å; F96-I100 HydrophobicContact CE1-CG1 4.49Å; F96-I100 PolarHBondContact O-N 3.35Å; F96-F193 AromaticContact CD2-CE2 3.73Å; F96-F193 HydrophobicContact CD2-CE2 3.73Å; F96-F193 HydrophobicContact CD2-CZ 4.12Å; F96-F193 AromaticContact CE2-CE2 3.67Å; F96-F193 HydrophobicContact CE2-CE2 3.67Å; F96-F193 AromaticContact CE2-CZ 3.69Å; F96-F193 HydrophobicContact CE2-CZ 3.69Å; F96-F193 HydrophobicContact CZ-CE2 4.42Å; F96-F193 HydrophobicContact CZ-CZ 4.01Å; F96-F196 HydrophobicContact CB-CE1 3.84Å; F96-F196 HydrophobicContact CB-CZ 4.42Å; F96-F196 HydrophobicContact CD2-CD1 4.45Å; F96-F196 AromaticContact CD2-CE1 3.99Å; F96-F196 HydrophobicContact CD2-CE1 3.99Å; F96-F196 HydrophobicContact CG-CE1 4.42Å; F96-L200 HydrophobicContact CD2-CD1 4.5Å; F96-T204 HydrophobicContact CE2-CG2 4.49Å; F96-M208 HydrophobicContact CE2-CE 3.96Å; F96-M208 HydrophobicContact CE2-CG 3.91Å; F96-M208 HydrophobicContact CE2-SD 4.36Å; F96-M208 HydrophobicContact CZ-CE 3.68Å; F96-M208 HydrophobicContact CZ-CG 3.91Å; F96-M208 HydrophobicContact CZ-SD 3.87Å; F96-F312 HydrophobicContact CB-CD2 4.5Å; F96-F312 HydrophobicContact CD1-CB 3.85Å; F96-F312 HydrophobicContact CD2-CB 4.02Å; F96-F312 HydrophobicContact CE1-CB 3.9Å; F96-F312 WeakPolarHBondContact CE1-O 3.42Å; F96-F312 HydrophobicContact CE2-CB 4.08Å; F96-F312 HydrophobicContact CG-CB 3.91Å; F96-F312 HydrophobicContact CG-CD2 4.49Å; F96-F312 HydrophobicContact CZ-CB 4.01Å; F96-F312 WeakPolarHBondContact CZ-O 3.48Å; F96-F315 HydrophobicContact CE1-CB 4.2Å
97L95.5Very high93.5Very high0 Ų037.6 Ų37.60%019%0.188CC..Hα-helixtrans-68-36.5176.4-67.8175.7000111.3F82 M85 R86 A89 L93 A94 S95 F99 I100 T101 F315F82-L97 HydrophobicContact CE2-CD2 4.01Å; F82-L97 HydrophobicContact CZ-CB 4.13Å; F82-L97 HydrophobicContact CZ-CD2 4.32Å; F82-L97 WeakPolarHBondContact CZ-O 3.35Å; M85-L97 HydrophobicContact CB-CD1 4.44Å; R86-L97 HydrophobicContact CB-CD1 4.14Å; A89-L97 HydrophobicContact CB-CD1 3.77Å; L93-L97 HydrophobicContact CD1-CD1 4.27Å; L93-L97 HydrophobicContact CD1-CD2 4.43Å; L93-L97 HydrophobicContact CD1-CG 4Å; L93-L97 HydrophobicContact CG-CD1 4.16Å; L93-L97 HydrophobicContact CG-CG 4.33Å; L93-L97 WeakPolarHBondContact O-CG 3.28Å; L93-L97 PolarHBondContact O-N 3.36Å; A94-L97 PolarHBondContact O-N 3.46Å; S95-L97 VanDerWaalsContact C-N 3.33Å; S95-L97 PolarHBondContact O-N 3.02Å; L97-F99 VanDerWaalsContact C-N 3.33Å; L97-F99 PolarHBondContact O-N 2.92Å; L97-I100 HydrophobicContact CD2-CD1 4.06Å; L97-I100 WeakPolarHBondContact O-CB 3.47Å; L97-I100 PolarHBondContact O-N 3.26Å; L97-I100 VanDerWaalsContact O-N 3.14Å; L97-T101 PolarHBondContact O-N 3.41Å; L97-F315 HydrophobicContact CD2-CB 3.83Å; L97-F315 HydrophobicContact CD2-CD1 4.37Å; L97-F315 HydrophobicContact CD2-CG 4.23Å
98D93.7Very high93.3Very high41 Ų4131.5 Ų31.522%0.21916%0.156CC..Hα-helixtrans-61.6-41.3173.5-68.9-25.7000112R86 A94 S95 I100 T101 Y102R86-D98 IonicContact CZ-OD1 3.72Å; R86-D98 IonicContact CZ-OD2 2.7Å; R86-D98 IonicContact NE-OD1 3.81Å; R86-D98 PolarHBondContact NE-OD1 2.77Å; R86-D98 IonicContact NE-OD2 3.6Å; R86-D98 VanDerWaalsContact NH2-CG 3.35Å; R86-D98 IonicContact NH2-OD1 3.09Å; R86-D98 PolarHBondContact NH2-OD1 3.1Å; R86-D98 IonicContact NH2-OD2 3.99Å; R86-D98 PolarHBondContact NH2-OD2 3.33Å; A94-D98 PolarHBondContact O-N 3.09Å; S95-D98 WeakPolarHBondContact O-CB 3.43Å; S95-D98 PolarHBondContact O-N 3.41Å; S95-D98 VanDerWaalsContact O-N 3.16Å; D98-I100 VanDerWaalsContact C-N 3.25Å; D98-I100 PolarHBondContact O-N 2.84Å; D98-T101 WeakPolarHBondContact O-CA 3.44Å; D98-T101 WeakPolarHBondContact O-CB 3.42Å; D98-T101 PolarHBondContact O-N 2.78Å; D98-T101 PolarHBondContact O-OG1 3.05Å; D98-Y102 HydrophobicContact CB-CE1 4.19Å; D98-Y102 WeakPolarHBondContact O-CD1 3.2Å; D98-Y102 WeakPolarHBondContact O-CE1 3.4Å; D98-Y102 PolarHBondContact O-N 3.41Å
99F94.2Very high92.9Very high25 Ų2526.7 Ų26.711%0.1113%0.134CC..Hα-helixtrans-55.8-41173.2-87.3-75.1000112.1S95 F96 L97 T101 Y102 Y189 F193 F196S95-F99 VanDerWaalsContact O-CD2 3.24Å; S95-F99 WeakPolarHBondContact O-CD2 3.42Å; S95-F99 PolarHBondContact O-N 2.99Å; F96-F99 WeakPolarHBondContact O-CB 3.29Å; F96-F99 PolarHBondContact O-N 3.03Å; L97-F99 VanDerWaalsContact C-N 3.33Å; L97-F99 PolarHBondContact O-N 2.92Å; F99-T101 PolarHBondContact O-N 3.28Å; F99-Y102 AromaticContact CD1-CD2 3.76Å; F99-Y102 HydrophobicContact CD1-CD2 3.76Å; F99-Y102 AromaticContact CD1-CE2 3.88Å; F99-Y102 HydrophobicContact CD1-CE2 3.88Å; F99-Y102 HydrophobicContact CE1-CD2 4.22Å; F99-Y102 HydrophobicContact CE1-CE2 4.07Å; F99-Y102 HydrophobicContact CG-CD2 4.33Å; F99-Y102 HydrophobicContact CG-CE2 4.26Å; F99-Y102 WeakPolarHBondContact O-CB 3.27Å; F99-Y102 PolarHBondContact O-N 2.95Å; F99-Y102 VanDerWaalsContact O-N 3.11Å; F99-Y189 HydrophobicContact CD1-CD2 4.5Å; F99-Y189 HydrophobicContact CD1-CE2 4.3Å; F99-Y189 WeakPolarHBondContact O-CE2 3.19Å; F99-Y189 PolarHBondContact O-OH 3.09Å; F99-F193 HydrophobicContact CB-CD1 4.43Å; F99-F193 HydrophobicContact CB-CD2 3.56Å; F99-F193 HydrophobicContact CB-CE1 4.46Å; F99-F193 HydrophobicContact CB-CE2 3.61Å; F99-F193 HydrophobicContact CB-CG 4.01Å; F99-F193 HydrophobicContact CB-CZ 4.07Å; F99-F193 HydrophobicContact CD1-CB 3.87Å; F99-F193 AromaticContact CD1-CD2 3.97Å; F99-F193 HydrophobicContact CD1-CD2 3.97Å; F99-F193 HydrophobicContact CD1-CG 4.08Å; F99-F193 HydrophobicContact CD2-CD2 4.18Å; F99-F193 HydrophobicContact CE1-CB 4.35Å; F99-F193 HydrophobicContact CG-CB 4.44Å; F99-F193 AromaticContact CG-CD2 3.65Å; F99-F193 HydrophobicContact CG-CD2 3.65Å; F99-F193 HydrophobicContact CG-CE2 4.12Å; F99-F193 HydrophobicContact CG-CG 4.17Å; F99-F196 HydrophobicContact CD2-CB 4.47Å; F99-F196 AromaticContact CD2-CD1 3.85Å; F99-F196 HydrophobicContact CD2-CD1 3.85Å; F99-F196 HydrophobicContact CD2-CD2 4.41Å; F99-F196 HydrophobicContact CD2-CE1 4.14Å; F99-F196 AromaticContact CD2-CG 3.99Å; F99-F196 HydrophobicContact CD2-CG 3.99Å; F99-F196 HydrophobicContact CE2-CB 3.89Å; F99-F196 AromaticContact CE2-CD1 3.92Å; F99-F196 HydrophobicContact CE2-CD1 3.92Å; F99-F196 AromaticContact CE2-CD2 3.71Å; F99-F196 HydrophobicContact CE2-CD2 3.71Å; F99-F196 HydrophobicContact CE2-CE1 4.38Å; F99-F196 HydrophobicContact CE2-CE2 4.2Å; F99-F196 AromaticContact CE2-CG 3.56Å; F99-F196 HydrophobicContact CE2-CG 3.56Å; F99-F196 HydrophobicContact CZ-CB 4.07Å; F99-F196 HydrophobicContact CZ-CD2 4.48Å; F99-F196 HydrophobicContact CZ-CG 4.24Å
100I94.9Very high92.5Very high1 Ų126.2 Ų26.21%0.00513%0.129CC..Hα-helixtrans-59-38.4175-61.2175.2000111F82 F96 L97 D98 Y102 S103 Y104 F193 Y316 V319F82-I100 HydrophobicContact CE2-CB 4.26Å; F82-I100 HydrophobicContact CE2-CD1 4.38Å; F82-I100 HydrophobicContact CE2-CG2 3.97Å; F82-I100 HydrophobicContact CZ-CB 4.27Å; F82-I100 HydrophobicContact CZ-CG2 4.3Å; F96-I100 HydrophobicContact CD1-CD1 4.19Å; F96-I100 HydrophobicContact CE1-CD1 3.84Å; F96-I100 HydrophobicContact CE1-CG1 4.49Å; F96-I100 PolarHBondContact O-N 3.35Å; L97-I100 HydrophobicContact CD2-CD1 4.06Å; L97-I100 WeakPolarHBondContact O-CB 3.47Å; L97-I100 PolarHBondContact O-N 3.26Å; L97-I100 VanDerWaalsContact O-N 3.14Å; D98-I100 VanDerWaalsContact C-N 3.25Å; D98-I100 PolarHBondContact O-N 2.84Å; I100-Y102 VanDerWaalsContact C-N 3.28Å; I100-Y102 PolarHBondContact O-N 3.41Å; I100-S103 PolarHBondContact O-OG 2.9Å; I100-S103 VanDerWaalsContact O-OG 3.12Å; I100-Y104 HydrophobicContact CG2-CE2 4.13Å; I100-Y104 VanDerWaalsContact O-CD2 3.25Å; I100-Y104 WeakPolarHBondContact O-CD2 3.42Å; I100-Y104 WeakPolarHBondContact O-CE2 3.28Å; I100-F193 HydrophobicContact CG1-CZ 4.44Å; I100-Y316 HydrophobicContact CD1-CD2 4.27Å; I100-Y316 HydrophobicContact CG1-CD2 3.99Å; I100-V319 HydrophobicContact CG2-CG1 4.24Å
101T93.3Very high92.3Very high12 Ų1221.5 Ų21.57%0.07411%0.114CC..Hα-helixtrans-67.7-27.8179.270.80000113.2F82 L97 D98 F99 S103 Y104 M105F82-T101 HydrophobicContact CE1-CG2 3.51Å; F82-T101 HydrophobicContact CZ-CG2 3.73Å; L97-T101 PolarHBondContact O-N 3.41Å; D98-T101 WeakPolarHBondContact O-CA 3.44Å; D98-T101 WeakPolarHBondContact O-CB 3.42Å; D98-T101 PolarHBondContact O-N 2.78Å; D98-T101 PolarHBondContact O-OG1 3.05Å; F99-T101 PolarHBondContact O-N 3.28Å; T101-S103 VanDerWaalsContact C-N 3.3Å; T101-S103 PolarHBondContact O-N 2.92Å; T101-Y104 WeakPolarHBondContact O-CB 3.43Å; T101-Y104 PolarHBondContact O-N 2.98Å; T101-M105 WeakPolarHBondContact O-CG 3.22Å; T101-M105 PolarHBondContact O-N 2.78Å
102Y92.8Very high92Very high38 Ų3817.4 Ų17.415%0.14910%0.095CC..Hα-helixtrans-63.3-33.1-175-63.3-11.9000112.8D98 F99 I100 Y104 M105 I106 P159 L160 F163 Y189D98-Y102 HydrophobicContact CB-CE1 4.19Å; D98-Y102 WeakPolarHBondContact O-CD1 3.2Å; D98-Y102 WeakPolarHBondContact O-CE1 3.4Å; D98-Y102 PolarHBondContact O-N 3.41Å; F99-Y102 AromaticContact CD1-CD2 3.76Å; F99-Y102 HydrophobicContact CD1-CD2 3.76Å; F99-Y102 AromaticContact CD1-CE2 3.88Å; F99-Y102 HydrophobicContact CD1-CE2 3.88Å; F99-Y102 HydrophobicContact CE1-CD2 4.22Å; F99-Y102 HydrophobicContact CE1-CE2 4.07Å; F99-Y102 HydrophobicContact CG-CD2 4.33Å; F99-Y102 HydrophobicContact CG-CE2 4.26Å; F99-Y102 WeakPolarHBondContact O-CB 3.27Å; F99-Y102 PolarHBondContact O-N 2.95Å; F99-Y102 VanDerWaalsContact O-N 3.11Å; I100-Y102 VanDerWaalsContact C-N 3.28Å; I100-Y102 PolarHBondContact O-N 3.41Å; Y102-Y104 VanDerWaalsContact C-N 3.32Å; Y102-Y104 PolarHBondContact O-N 3.07Å; Y102-M105 HydrophobicContact CD1-SD 3.93Å; Y102-M105 HydrophobicContact CE1-SD 4.46Å; Y102-M105 PolarHBondContact O-N 3Å; Y102-I106 VanDerWaalsContact O-CG1 3.28Å; Y102-I106 WeakPolarHBondContact O-CG1 3.46Å; Y102-I106 PolarHBondContact O-N 3.19Å; Y102-P159 HydrophobicContact CD1-CG 3.99Å; Y102-P159 HydrophobicContact CE1-CB 3.86Å; Y102-P159 HydrophobicContact CE1-CG 3.35Å; Y102-P159 HydrophobicContact CE2-CB 4.46Å; Y102-L160 HydrophobicContact CG-CD2 4.32Å; Y102-F163 HydrophobicContact CD2-CE2 4.04Å; Y102-F163 HydrophobicContact CD2-CZ 4.26Å; Y102-Y189 HydrophobicContact CD2-CD2 4.46Å
103S93.2Very high91.5Very high10 Ų1015.1 Ų15.17%0.078%0.08CC..Hα-helixtrans-61.1-42.517461.40000111.9I100 T101 I106 D107 Y186I100-S103 PolarHBondContact O-OG 2.9Å; I100-S103 VanDerWaalsContact O-OG 3.12Å; T101-S103 VanDerWaalsContact C-N 3.3Å; T101-S103 PolarHBondContact O-N 2.92Å; S103-I106 PolarHBondContact O-N 3.43Å; S103-D107 PolarHBondContact O-N 3.21Å; S103-D107 VanDerWaalsContact O-N 3.07Å; S103-Y186 PolarHBondContact O-OH 3.41Å
104Y92.6Very high91.1Very high8 Ų817 Ų173%0.0319%0.092CC..Hα-helixtrans-70-35.5177.4-57.2-85.2000112.4I100 T101 Y102 D107 N108 H130 L132 V319 E323I100-Y104 HydrophobicContact CG2-CE2 4.13Å; I100-Y104 VanDerWaalsContact O-CD2 3.25Å; I100-Y104 WeakPolarHBondContact O-CD2 3.42Å; I100-Y104 WeakPolarHBondContact O-CE2 3.28Å; T101-Y104 WeakPolarHBondContact O-CB 3.43Å; T101-Y104 PolarHBondContact O-N 2.98Å; Y102-Y104 VanDerWaalsContact C-N 3.32Å; Y102-Y104 PolarHBondContact O-N 3.07Å; Y104-D107 PolarHBondContact O-N 3.06Å; Y104-N108 WeakPolarHBondContact O-CB 3.28Å; Y104-N108 VanDerWaalsContact O-CG 3.27Å; Y104-N108 PolarHBondContact O-N 3.27Å; Y104-H130 HydrophobicContact CD1-CB 4.11Å; Y104-H130 AromaticContact CD1-CE1 3.65Å; Y104-H130 AromaticContact CD1-CG 3.57Å; Y104-H130 AromaticContact CD1-ND1 3.2Å; Y104-H130 WeakPolarHBondContact CD1-ND1 3.44Å; Y104-H130 AromaticContact CE1-CE1 3.54Å; Y104-H130 AromaticContact CE1-ND1 3.62Å; Y104-H130 AromaticContact CE1-NE2 4Å; Y104-H130 AromaticContact CG-ND1 3.85Å; Y104-L132 HydrophobicContact CD1-CB 4.41Å; Y104-L132 HydrophobicContact CD2-CB 3.96Å; Y104-L132 HydrophobicContact CD2-CD1 4.36Å; Y104-L132 HydrophobicContact CE1-CD1 4.46Å; Y104-L132 HydrophobicContact CE2-CB 4.36Å; Y104-L132 HydrophobicContact CE2-CD1 3.91Å; Y104-L132 HydrophobicContact CG-CB 3.97Å; Y104-V319 VanDerWaalsContact OH-CG1 3.29Å; Y104-V319 WeakPolarHBondContact OH-CG1 3.32Å; Y104-E323 WeakPolarHBondContact CE1-OE1 3.42Å; Y104-E323 PolarHBondContact OH-OE1 2.97Å; Y104-E323 PolarHBondContact OH-OE2 3.13Å
105M90.8Very high90.7Very high23 Ų2317 Ų1711%0.1139%0.093CC..Hα-helixtrans-62.2-46174-66.6-178.4-178.600110T101 Y102 D107 N108 V109 P159 L160T101-M105 WeakPolarHBondContact O-CG 3.22Å; T101-M105 PolarHBondContact O-N 2.78Å; Y102-M105 HydrophobicContact CD1-SD 3.93Å; Y102-M105 HydrophobicContact CE1-SD 4.46Å; Y102-M105 PolarHBondContact O-N 3Å; M105-D107 VanDerWaalsContact C-N 3.34Å; M105-D107 PolarHBondContact O-N 3.35Å; M105-N108 PolarHBondContact O-N 3.18Å; M105-V109 WeakPolarHBondContact O-CB 3.37Å; M105-V109 WeakPolarHBondContact O-CG2 3.32Å; M105-V109 PolarHBondContact O-N 3.5Å; M105-P159 HydrophobicContact SD-CG 4.3Å; M105-L160 HydrophobicContact CB-CD1 3.89Å; M105-L160 HydrophobicContact CB-CG 4.43Å
106I90.6Very high90.1Very high0 Ų016.2 Ų16.20%09%0.086CC..Hα-helixtrans-56.5-49.1175.9-67.1163.6000110.2Y102 S103 N108 V109 I110 L160 L185 Y186 Y189Y102-I106 VanDerWaalsContact O-CG1 3.28Å; Y102-I106 WeakPolarHBondContact O-CG1 3.46Å; Y102-I106 PolarHBondContact O-N 3.19Å; S103-I106 PolarHBondContact O-N 3.43Å; I106-N108 PolarHBondContact O-N 3.39Å; I106-V109 PolarHBondContact O-N 2.93Å; I106-I110 HydrophobicContact CG2-CG1 4.32Å; I106-I110 VanDerWaalsContact O-CG1 3.26Å; I106-I110 WeakPolarHBondContact O-CG1 3.25Å; I106-I110 PolarHBondContact O-N 2.87Å; I106-L160 HydrophobicContact CD1-CD2 4.33Å; I106-L160 HydrophobicContact CG1-CD1 3.95Å; I106-L160 HydrophobicContact CG1-CD2 3.86Å; I106-L185 HydrophobicContact CD1-CB 4.05Å; I106-L185 HydrophobicContact CG1-CB 4.14Å; I106-L185 HydrophobicContact CG2-CB 3.92Å; I106-L185 HydrophobicContact CG2-CD1 4.03Å; I106-Y186 HydrophobicContact CB-CE2 4.23Å; I106-Y186 HydrophobicContact CG2-CD2 3.71Å; I106-Y186 HydrophobicContact CG2-CE2 3.52Å; I106-Y189 HydrophobicContact CD1-CD1 4.49Å; I106-Y189 HydrophobicContact CD1-CG 4.16Å
107D91.8Very high89.6Confident54 Ų5419.1 Ų19.129%0.28910%0.101SC..Hα-helixtrans-62.2-40.5179.8-73.4-23.3000113.3S103 Y104 M105 I110 L111 R182 Y186S103-D107 PolarHBondContact O-N 3.21Å; S103-D107 VanDerWaalsContact O-N 3.07Å; Y104-D107 PolarHBondContact O-N 3.06Å; M105-D107 VanDerWaalsContact C-N 3.34Å; M105-D107 PolarHBondContact O-N 3.35Å; D107-I110 PolarHBondContact O-N 3.27Å; D107-L111 WeakPolarHBondContact O-CB 3.41Å; D107-L111 PolarHBondContact O-N 3.48Å; D107-R182 IonicContact OD1-NE 3.55Å; D107-R182 IonicContact OD1-NH2 2.7Å; D107-Y186 WeakPolarHBondContact OD1-CE2 3.49Å; D107-Y186 PolarHBondContact OD1-OH 3.47Å; D107-Y186 PolarHBondContact OD2-OH 3.16Å
108N89.8Confident89.1Confident4 Ų423.4 Ų23.42%0.02112%0.121CC..Hα-helixtrans-64-44.1175.7-75.2-8.6000111.6Y104 M105 I106 I110 L111 L112 C129 H130 G133Y104-N108 WeakPolarHBondContact O-CB 3.28Å; Y104-N108 VanDerWaalsContact O-CG 3.27Å; Y104-N108 PolarHBondContact O-N 3.27Å; M105-N108 PolarHBondContact O-N 3.18Å; I106-N108 PolarHBondContact O-N 3.39Å; N108-I110 VanDerWaalsContact C-N 3.34Å; N108-I110 PolarHBondContact O-N 2.97Å; N108-L111 PolarHBondContact O-N 3.26Å; N108-L112 WeakPolarHBondContact O-CB 3.49Å; N108-L112 WeakPolarHBondContact O-CG 3.31Å; N108-L112 PolarHBondContact O-N 3.32Å; N108-C129 HydrophobicContact CB-CB 4.39Å; N108-C129 WeakPolarHBondContact OD1-CA 3.49Å; N108-C129 WeakPolarHBondContact OD1-CB 3.42Å; N108-H130 PolarHBondContact ND2-O 3.38Å; N108-H130 PolarHBondContact OD1-N 2.82Å; N108-G133 VanDerWaalsContact ND2-CA 3.3Å; N108-G133 WeakPolarHBondContact ND2-CA 3.16Å; N108-G133 PolarHBondContact ND2-O 3Å
109V85.4Confident88.6Confident0 Ų030.2 Ų30.20%015%0.152CC..Hα-helixtrans-60.4-46.4177.4170.60000110.5M105 I106 L111 L112 I113 F135 I154 L160M105-V109 WeakPolarHBondContact O-CB 3.37Å; M105-V109 WeakPolarHBondContact O-CG2 3.32Å; M105-V109 PolarHBondContact O-N 3.5Å; I106-V109 PolarHBondContact O-N 2.93Å; V109-L111 PolarHBondContact O-N 3.1Å; V109-L112 PolarHBondContact O-N 2.87Å; V109-I113 HydrophobicContact CG1-CD1 3.7Å; V109-I113 HydrophobicContact CG1-CG1 4.45Å; V109-I113 VanDerWaalsContact O-CG1 3.27Å; V109-I113 WeakPolarHBondContact O-CG1 3.42Å; V109-I113 PolarHBondContact O-N 3.02Å; V109-F135 HydrophobicContact CG2-CE1 4.18Å; V109-F135 HydrophobicContact CG2-CZ 4.49Å; V109-I154 HydrophobicContact CB-CG2 4.41Å; V109-I154 HydrophobicContact CG1-CD1 4.08Å; V109-I154 HydrophobicContact CG1-CG2 4.02Å; V109-I154 HydrophobicContact CG2-CD1 4.2Å; V109-I154 HydrophobicContact CG2-CG2 3.46Å; V109-I154 VanDerWaalsContact CG2-CG2 3.46Å; V109-L160 HydrophobicContact CG2-CD1 4.24Å
110I87.3Confident88.1Confident3 Ų335.2 Ų35.22%0.01517%0.17CC..Hα-helixtrans-61.9-44.6176.8-64.9-61.7000111I106 D107 N108 L112 I113 T114 I178 I181 R182 L185I106-I110 HydrophobicContact CG2-CG1 4.32Å; I106-I110 VanDerWaalsContact O-CG1 3.26Å; I106-I110 WeakPolarHBondContact O-CG1 3.25Å; I106-I110 PolarHBondContact O-N 2.87Å; D107-I110 PolarHBondContact O-N 3.27Å; N108-I110 VanDerWaalsContact C-N 3.34Å; N108-I110 PolarHBondContact O-N 2.97Å; I110-L112 VanDerWaalsContact C-N 3.34Å; I110-L112 PolarHBondContact O-N 2.75Å; I110-I113 PolarHBondContact O-N 2.94Å; I110-T114 WeakPolarHBondContact O-CB 3.27Å; I110-T114 PolarHBondContact O-N 2.96Å; I110-T114 PolarHBondContact O-OG1 3.48Å; I110-I178 HydrophobicContact CD1-CG2 4.02Å; I110-I178 HydrophobicContact CG2-CG2 3.73Å; I110-I181 HydrophobicContact CD1-CG2 4.06Å; I110-R182 HydrophobicContact CD1-CB 3.74Å; I110-R182 HydrophobicContact CG1-CB 3.84Å; I110-R182 HydrophobicContact CG1-CG 4.15Å; I110-R182 HydrophobicContact CG2-CB 4.49Å; I110-L185 HydrophobicContact CD1-CD1 4.48Å
111L88.5Confident87.5Confident59 Ų5937.6 Ų37.631%0.30919%0.187SC..Hα-helixtrans-60.1-42.4177.5-179.764.7000112.4D107 N108 V109 G115 K128D107-L111 WeakPolarHBondContact O-CB 3.41Å; D107-L111 PolarHBondContact O-N 3.48Å; N108-L111 PolarHBondContact O-N 3.26Å; V109-L111 PolarHBondContact O-N 3.1Å; L111-G115 PolarHBondContact O-N 3.3Å; L111-K128 HydrophobicContact CD2-CB 4.05Å
112L85.2Confident86.8Confident0 Ų037.8 Ų37.80%019%0.187CC..Hα-helixtrans-67.7-43.7179.4-69.7167.8000111.7N108 V109 I110 G115 T116 I122 L125 M138 V141 L150N108-L112 WeakPolarHBondContact O-CB 3.49Å; N108-L112 WeakPolarHBondContact O-CG 3.31Å; N108-L112 PolarHBondContact O-N 3.32Å; V109-L112 PolarHBondContact O-N 2.87Å; I110-L112 VanDerWaalsContact C-N 3.34Å; I110-L112 PolarHBondContact O-N 2.75Å; L112-G115 PolarHBondContact O-N 2.93Å; L112-T116 WeakPolarHBondContact O-CB 3.42Å; L112-T116 PolarHBondContact O-N 3.47Å; L112-T116 PolarHBondContact O-OG1 3.43Å; L112-I122 HydrophobicContact CD2-CG2 4.24Å; L112-L125 HydrophobicContact CD2-CB 4.02Å; L112-M138 HydrophobicContact CD1-SD 4.16Å; L112-V141 HydrophobicContact CD1-CG1 4.37Å; L112-L150 HydrophobicContact CB-CD2 4.06Å
113I83.5Confident86.3Confident0 Ų039.4 Ų39.40%021%0.208CC..Hα-helixtrans-64.5-49.5177.5-66.4170.5000110.3V109 I110 G115 T116 L117 P147 L150 Y151 I178V109-I113 HydrophobicContact CG1-CD1 3.7Å; V109-I113 HydrophobicContact CG1-CG1 4.45Å; V109-I113 VanDerWaalsContact O-CG1 3.27Å; V109-I113 WeakPolarHBondContact O-CG1 3.42Å; V109-I113 PolarHBondContact O-N 3.02Å; I110-I113 PolarHBondContact O-N 2.94Å; I113-G115 VanDerWaalsContact C-N 3.33Å; I113-G115 PolarHBondContact O-N 3.33Å; I113-T116 PolarHBondContact O-N 3.34Å; I113-L117 PolarHBondContact O-N 3Å; I113-P147 HydrophobicContact CG2-CB 4.28Å; I113-L150 HydrophobicContact CG1-CD2 3.98Å; I113-L150 HydrophobicContact CG1-CG 4.26Å; I113-Y151 HydrophobicContact CD1-CD2 4.08Å; I113-I178 HydrophobicContact CG2-CD1 3.88Å; I113-I178 HydrophobicContact CG2-CG1 3.92Å
114T86Confident85.9Confident40 Ų4044.5 Ų44.525%0.24523%0.231CC..Hα-helixtrans-61.2-41.8177.4-57.90000111.8I110 L117 H118 I178I110-T114 WeakPolarHBondContact O-CB 3.27Å; I110-T114 PolarHBondContact O-N 2.96Å; I110-T114 PolarHBondContact O-OG1 3.48Å; T114-L117 WeakPolarHBondContact O-CB 3.41Å; T114-L117 PolarHBondContact O-N 3.27Å; T114-H118 PolarHBondContact O-N 3.45Å; T114-H118 VanDerWaalsContact O-N 3.15Å; T114-H118 PolarHBondContact O-ND1 3.43Å; T114-I178 WeakPolarHBondContact OG1-CG2 3.19Å
115G85.7Confident85.5Confident5 Ų544.2 Ų44.25%0.05223%0.23CC..Hα-helixtrans-67-36.8178.900000113L111 L112 I113 H118 Q119 R120L111-G115 PolarHBondContact O-N 3.3Å; L112-G115 PolarHBondContact O-N 2.93Å; I113-G115 VanDerWaalsContact C-N 3.33Å; I113-G115 PolarHBondContact O-N 3.33Å; G115-H118 CarbonylContact O-C 3.49Å; G115-H118 PolarHBondContact O-N 2.98Å; G115-Q119 PolarHBondContact O-N 3.34Å; G115-R120 WeakPolarHBondContact O-CB 3.42Å; G115-R120 PolarHBondContact O-N 2.86Å
116T82.5Confident85.2Confident18 Ų1845.8 Ų45.811%0.1124%0.24CC..Hα-helixtrans-67.1-39.4174.6-55.20000111.4L112 I113 H118 Q119 P147 L150L112-T116 WeakPolarHBondContact O-CB 3.42Å; L112-T116 PolarHBondContact O-N 3.47Å; L112-T116 PolarHBondContact O-OG1 3.43Å; I113-T116 PolarHBondContact O-N 3.34Å; T116-H118 PolarHBondContact O-N 2.81Å; T116-Q119 PolarHBondContact O-N 3.16Å; T116-P147 HydrophobicContact CG2-CG 4.22Å; T116-L150 WeakPolarHBondContact OG1-CD2 3.28Å
117L84.3Confident84.9Confident60 Ų6050.4 Ų50.431%0.31427%0.271SS..Hα-helixtrans-58-38.7173.3-175.467000111.7I113 T114 Q119 P147 L173 E175 I178I113-L117 PolarHBondContact O-N 3Å; T114-L117 WeakPolarHBondContact O-CB 3.41Å; T114-L117 PolarHBondContact O-N 3.27Å; L117-Q119 PolarHBondContact O-N 2.93Å; L117-P147 HydrophobicContact CD1-CG 4.49Å; L117-L173 WeakPolarHBondContact CD1-O 3.46Å; L117-E175 HydrophobicContact CD2-CG 3.91Å; L117-I178 HydrophobicContact CB-CD1 4.47Å; L117-I178 HydrophobicContact CD2-CD1 3.73Å
118H85.2Confident84.6Confident91 Ų9154.1 Ų54.142%0.42128%0.284SS..THydrogen-bonded Turntrans-81.812.3175.9-71.489.5000114.4T114 G115 T116 R120 E175T114-H118 PolarHBondContact O-N 3.45Å; T114-H118 VanDerWaalsContact O-N 3.15Å; T114-H118 PolarHBondContact O-ND1 3.43Å; G115-H118 CarbonylContact O-C 3.49Å; G115-H118 PolarHBondContact O-N 2.98Å; T116-H118 PolarHBondContact O-N 2.81Å; H118-R120 HydrophobicContact CB-CG 4.4Å; H118-R120 PolarHBondContact O-N 2.9Å; H118-R120 VanDerWaalsContact O-N 3.17Å; H118-E175 IonicContact CE1-OE1 3.95Å; H118-E175 PolarHBondContact CE1-OE1 2.74Å; H118-E175 IonicContact NE2-OE1 2.74Å; H118-E175 PolarHBondContact NE2-OE1 3.32Å; H118-E175 VanDerWaalsContact NE2-OE1 3.08Å
119Q82.2Confident84.5Confident183 Ų18354.5 Ų54.586%0.85529%0.287SS*.THydrogen-bonded Turntrans57.727.3179.9-54.6176.5-4.500113.8G115 T116 L117G115-Q119 PolarHBondContact O-N 3.34Å; T116-Q119 PolarHBondContact O-N 3.16Å; L117-Q119 PolarHBondContact O-N 2.93Å
120R83.7Confident84.7Confident131 Ų13156.1 Ų56.149%0.49430%0.295SS..  trans-82142.6172.5-64.4-175179.3173.51109.7G115 H118 L125G115-R120 WeakPolarHBondContact O-CB 3.42Å; G115-R120 PolarHBondContact O-N 2.86Å; H118-R120 HydrophobicContact CB-CG 4.4Å; H118-R120 PolarHBondContact O-N 2.9Å; H118-R120 VanDerWaalsContact O-N 3.17Å; R120-L125 HydrophobicContact CB-CD1 4.31Å; R120-L125 HydrophobicContact CB-CD2 4.25Å; R120-L125 HydrophobicContact CB-CG 4.29Å
121S82.3Confident84.8Confident51 Ų5158.3 Ų58.336%0.35731%0.309SS..  trans-67.1138.9176.572.70000110.1A123 E124 L125S121-A123 PolarHBondContact O-N 3.21Å; S121-E124 WeakPolarHBondContact O-CB 3.39Å; S121-E124 PolarHBondContact O-N 3.06Å; S121-E124 WeakPolarHBondContact OG-CG 3.46Å; S121-E124 PolarHBondContact OG-N 3.23Å; S121-E124 PolarHBondContact OG-OE1 3.29Å; S121-L125 PolarHBondContact O-N 3.12Å
122I80.1Confident84.8Confident16 Ų1655.9 Ų55.98%0.08230%0.296CS..Hα-helixtrans-60.8-34.6178.5-66.4169.7000110.4L112 E124 L125 V126 V141 N142L112-I122 HydrophobicContact CD2-CG2 4.24Å; I122-E124 PolarHBondContact O-N 3.43Å; I122-L125 PolarHBondContact O-N 3.4Å; I122-V126 HydrophobicContact CG2-CG2 3.87Å; I122-V126 WeakPolarHBondContact O-CG2 3.32Å; I122-V126 PolarHBondContact O-N 3.11Å; I122-V141 HydrophobicContact CD1-CG1 3.83Å; I122-V141 WeakPolarHBondContact CD1-O 3.37Å; I122-V141 HydrophobicContact CG1-CG1 4.49Å; I122-V141 HydrophobicContact CG2-CG1 3.82Å; I122-N142 WeakPolarHBondContact CB-OD1 3.2Å; I122-N142 WeakPolarHBondContact CG2-OD1 3.32Å
123A81.6Confident84.8Confident71 Ų7155.9 Ų55.959%0.58730%0.296SS*.Hα-helixtrans-57.9-29.5173.600000113.8S121 P127S121-A123 PolarHBondContact O-N 3.21Å; A123-P127 WeakPolarHBondContact O-CD 3.3Å
124E84.4Confident84.7Confident118 Ų11858.5 Ų58.555%0.55131%0.314SS*.Hα-helixtrans-82.4-22173.6-74.4164.2-135.600113.4S121 I122S121-E124 WeakPolarHBondContact O-CB 3.39Å; S121-E124 PolarHBondContact O-N 3.06Å; S121-E124 WeakPolarHBondContact OG-CG 3.46Å; S121-E124 PolarHBondContact OG-N 3.23Å; S121-E124 PolarHBondContact OG-OE1 3.29Å; I122-E124 PolarHBondContact O-N 3.43Å
125L84.6Confident84.4Confident1 Ų157.7 Ų57.71%0.00531%0.308CS..Hα-helixtrans-89.9-35-177.8-62.8169.9000112.5L112 R120 S121 I122 K128 C129L112-L125 HydrophobicContact CD2-CB 4.02Å; R120-L125 HydrophobicContact CB-CD1 4.31Å; R120-L125 HydrophobicContact CB-CD2 4.25Å; R120-L125 HydrophobicContact CB-CG 4.29Å; S121-L125 PolarHBondContact O-N 3.12Å; I122-L125 PolarHBondContact O-N 3.4Å; L125-K128 WeakPolarHBondContact O-CA 3.29Å; L125-K128 WeakPolarHBondContact O-CB 3.41Å; L125-K128 PolarHBondContact O-N 3.46Å; L125-C129 PolarHBondContact O-N 3.25Å; L125-C129 PolarHBondContact O-SG 3.35Å; L125-C129 VanDerWaalsContact O-SG 3.37Å
126V84.1Confident83.7Confident56 Ų5665.8 Ų65.834%0.33934%0.344SS..G310 helixtrans-54.5-44.5-179.9168.20000112.3I122 K128 C129I122-V126 HydrophobicContact CG2-CG2 3.87Å; I122-V126 WeakPolarHBondContact O-CG2 3.32Å; I122-V126 PolarHBondContact O-N 3.11Å; V126-K128 PolarHBondContact O-N 2.63Å; V126-K128 VanDerWaalsContact O-N 3.15Å; V126-C129 VanDerWaalsContact O-CB 3.32Å; V126-C129 WeakPolarHBondContact O-CB 3.46Å; V126-C129 PolarHBondContact O-N 3.36Å
127P84.9Confident83.1Confident98 Ų9867.6 Ų67.664%0.63635%0.351SS*.G310 helixtrans-62.8-20.7175.7-23.534.8000114.3A123A123-P127 WeakPolarHBondContact O-CD 3.3Å
128K86Confident82.4Confident131 Ų13165.9 Ų65.957%0.5734%0.342SS*.G310 helixtrans-88.8-11.6178-59.1-179.4-178.7176.70112.9L111 L125 V126L111-K128 HydrophobicContact CD2-CB 4.05Å; L125-K128 WeakPolarHBondContact O-CA 3.29Å; L125-K128 WeakPolarHBondContact O-CB 3.41Å; L125-K128 PolarHBondContact O-N 3.46Å; V126-K128 PolarHBondContact O-N 2.63Å; V126-K128 VanDerWaalsContact O-N 3.15Å
129C87.5Confident81.5Confident13 Ų1369.2 Ų69.29%0.08836%0.358CS..SBendtrans-71.8145.2177.9-660000110.5N108 L125 V126 M138N108-C129 HydrophobicContact CB-CB 4.39Å; N108-C129 WeakPolarHBondContact OD1-CA 3.49Å; N108-C129 WeakPolarHBondContact OD1-CB 3.42Å; L125-C129 PolarHBondContact O-N 3.25Å; L125-C129 PolarHBondContact O-SG 3.35Å; L125-C129 VanDerWaalsContact O-SG 3.37Å; V126-C129 VanDerWaalsContact O-CB 3.32Å; V126-C129 WeakPolarHBondContact O-CB 3.46Å; V126-C129 PolarHBondContact O-N 3.36Å; C129-M138 HydrophobicContact CB-CE 4.12Å
130H89.9Confident80.8Confident33 Ų3362.9 Ų62.915%0.15334%0.337CS..  trans-72.2129177.6-166.3-90.5000110.6Y104 N108 L132 G133Y104-H130 HydrophobicContact CD1-CB 4.11Å; Y104-H130 AromaticContact CD1-CE1 3.65Å; Y104-H130 AromaticContact CD1-CG 3.57Å; Y104-H130 AromaticContact CD1-ND1 3.2Å; Y104-H130 WeakPolarHBondContact CD1-ND1 3.44Å; Y104-H130 AromaticContact CE1-CE1 3.54Å; Y104-H130 AromaticContact CE1-ND1 3.62Å; Y104-H130 AromaticContact CE1-NE2 4Å; Y104-H130 AromaticContact CG-ND1 3.85Å; N108-H130 PolarHBondContact ND2-O 3.38Å; N108-H130 PolarHBondContact OD1-N 2.82Å; H130-L132 WeakPolarHBondContact ND1-CB 3.48Å; H130-L132 PolarHBondContact ND1-N 3.2Å; H130-L132 PolarHBondContact O-N 2.9Å; H130-L132 VanDerWaalsContact O-N 3.13Å; H130-G133 PolarHBondContact O-N 3.28Å
131P88.5Confident80Confident49 Ų4956.8 Ų56.832%0.31831%0.314SS..G310 helixtrans-67.5-15.2-173.9-19.730.2000115.6V79 R83 S134V79-P131 HydrophobicContact CG1-CB 4.21Å; V79-P131 HydrophobicContact CG2-CB 3.77Å; V79-P131 HydrophobicContact CG2-CG 4.19Å; R83-P131 PolarHBondContact NH2-O 3.19Å; R83-P131 VanDerWaalsContact NH2-O 3.11Å; P131-S134 PolarHBondContact O-OG 3.11Å
132L89.2Confident79.4Confident9 Ų958.4 Ų58.45%0.04732%0.319CS..G310 helixtrans-76.6-24.3170.8-68.3-177.2000113.2M78 V79 F82 Y104 H130 S134M78-L132 HydrophobicContact CE-CD1 4.12Å; V79-L132 HydrophobicContact CB-CD2 4.19Å; V79-L132 HydrophobicContact CG1-CD2 4.07Å; V79-L132 HydrophobicContact CG2-CD2 3.89Å; V79-L132 HydrophobicContact CG2-CG 3.82Å; F82-L132 HydrophobicContact CB-CD2 3.95Å; F82-L132 HydrophobicContact CD1-CD1 4.43Å; F82-L132 HydrophobicContact CD1-CD2 3.45Å; F82-L132 VanDerWaalsContact CD1-CD2 3.45Å; F82-L132 HydrophobicContact CE1-CD2 4.16Å; F82-L132 HydrophobicContact CG-CD1 4.23Å; F82-L132 HydrophobicContact CG-CD2 3.82Å; Y104-L132 HydrophobicContact CD1-CB 4.41Å; Y104-L132 HydrophobicContact CD2-CB 3.96Å; Y104-L132 HydrophobicContact CD2-CD1 4.36Å; Y104-L132 HydrophobicContact CE1-CD1 4.46Å; Y104-L132 HydrophobicContact CE2-CB 4.36Å; Y104-L132 HydrophobicContact CE2-CD1 3.91Å; Y104-L132 HydrophobicContact CG-CB 3.97Å; H130-L132 WeakPolarHBondContact ND1-CB 3.48Å; H130-L132 PolarHBondContact ND1-N 3.2Å; H130-L132 PolarHBondContact O-N 2.9Å; H130-L132 VanDerWaalsContact O-N 3.13Å; L132-S134 VanDerWaalsContact C-N 3.27Å
133G83.7Confident78.9Confident0 Ų064.2 Ų64.20%035%0.349CS..G310 helixtrans-92.617.6177.200000112.8N108 H130N108-G133 VanDerWaalsContact ND2-CA 3.3Å; N108-G133 WeakPolarHBondContact ND2-CA 3.16Å; N108-G133 PolarHBondContact ND2-O 3Å; H130-G133 PolarHBondContact O-N 3.28Å
134S82.9Confident78.5Confident54 Ų5461.4 Ų61.438%0.37833%0.326SS..  trans-79.7130.9-179.764.80000111.8P131 L132 M138P131-S134 PolarHBondContact O-OG 3.11Å; L132-S134 VanDerWaalsContact C-N 3.27Å; S134-M138 VanDerWaalsContact CA-CE 3.44Å
135F78.2Confident77.9Confident24 Ų2463.9 Ų63.911%0.10534%0.337CS..  trans-124152.2174.453.4-88.8000109.8V109 Q137 M138 V141 I154 T158V109-F135 HydrophobicContact CG2-CE1 4.18Å; V109-F135 HydrophobicContact CG2-CZ 4.49Å; F135-Q137 HydrophobicContact CD2-CB 3.99Å; F135-Q137 HydrophobicContact CE2-CB 4.24Å; F135-Q137 PolarHBondContact O-N 3.42Å; F135-Q137 VanDerWaalsContact O-N 3.17Å; F135-M138 HydrophobicContact CD1-CG 4.12Å; F135-M138 HydrophobicContact CD2-CG 4.1Å; F135-M138 HydrophobicContact CE1-CG 3.84Å; F135-M138 HydrophobicContact CE2-CB 4.48Å; F135-M138 HydrophobicContact CE2-CG 3.83Å; F135-M138 HydrophobicContact CG-CG 4.24Å; F135-M138 HydrophobicContact CZ-CG 3.69Å; F135-M138 WeakPolarHBondContact O-CB 3.48Å; F135-M138 PolarHBondContact O-N 3.45Å; F135-V141 HydrophobicContact CE2-CG2 4.27Å; F135-I154 HydrophobicContact CE2-CG1 4.25Å; F135-I154 HydrophobicContact CZ-CD1 4.34Å; F135-I154 HydrophobicContact CZ-CG1 3.97Å; F135-I154 HydrophobicContact CZ-CG2 4.3Å; F135-T158 HydrophobicContact CD2-CG2 4.2Å; F135-T158 HydrophobicContact CE2-CG2 4.48Å; F135-T158 HydrophobicContact CG-CG2 4.24Å
136E71.5Confident77.4Confident174 Ų17466.7 Ų66.781%0.81335%0.354SS*.THydrogen-bonded Turntrans-57-35-171.3-64.2-173.816100112.7M138E136-M138 PolarHBondContact O-N 2.91Å
137Q69.6Low77Confident57 Ų5765.1 Ų65.127%0.26635%0.346SS..THydrogen-bonded Turntrans-77.50.8-177.4-60.775.19.400113.5F135 E139 A140 V141 D157F135-Q137 HydrophobicContact CD2-CB 3.99Å; F135-Q137 HydrophobicContact CE2-CB 4.24Å; F135-Q137 PolarHBondContact O-N 3.42Å; F135-Q137 VanDerWaalsContact O-N 3.17Å; Q137-E139 PolarHBondContact O-N 3.35Å; Q137-E139 VanDerWaalsContact O-N 3.1Å; Q137-A140 HydrophobicContact CB-CB 4.4Å; Q137-A140 WeakPolarHBondContact O-CA 3.44Å; Q137-A140 WeakPolarHBondContact O-CB 3.48Å; Q137-A140 PolarHBondContact O-N 3.42Å; Q137-V141 WeakPolarHBondContact O-CG2 3.46Å; Q137-V141 PolarHBondContact O-N 2.94Å; Q137-D157 HydrophobicContact CG-CB 4.31Å
138M70.1Confident76.6Confident23 Ų2361.9 Ų61.911%0.11333%0.327CS..Hα-helixtrans-56.2-25.5170.6-86-135.9-125.400112.5L112 C129 S134 F135 E136 V141L112-M138 HydrophobicContact CD1-SD 4.16Å; C129-M138 HydrophobicContact CB-CE 4.12Å; S134-M138 VanDerWaalsContact CA-CE 3.44Å; F135-M138 HydrophobicContact CD1-CG 4.12Å; F135-M138 HydrophobicContact CD2-CG 4.1Å; F135-M138 HydrophobicContact CE1-CG 3.84Å; F135-M138 HydrophobicContact CE2-CB 4.48Å; F135-M138 HydrophobicContact CE2-CG 3.83Å; F135-M138 HydrophobicContact CG-CG 4.24Å; F135-M138 HydrophobicContact CZ-CG 3.69Å; F135-M138 WeakPolarHBondContact O-CB 3.48Å; F135-M138 PolarHBondContact O-N 3.45Å; E136-M138 PolarHBondContact O-N 2.91Å; M138-V141 WeakPolarHBondContact O-CB 3.33Å
139E65.8Low76.2Confident161 Ų16160.4 Ų60.475%0.75232%0.322SS*.Hα-helixtrans-72.8-38172.7-65.6-171174.700112.6Q137 V141 N142Q137-E139 PolarHBondContact O-N 3.35Å; Q137-E139 VanDerWaalsContact O-N 3.1Å; E139-V141 VanDerWaalsContact C-N 3.27Å; E139-V141 PolarHBondContact O-N 3.35Å; E139-N142 VanDerWaalsContact O-CB 3.31Å; E139-N142 WeakPolarHBondContact O-CB 3.32Å; E139-N142 PolarHBondContact O-N 3.21Å; E139-N142 PolarHBondContact O-ND2 3Å; E139-N142 VanDerWaalsContact O-ND2 3.11Å
140A67.3Low75.7Confident51 Ų5159.8 Ų59.842%0.42132%0.318SS..Hα-helixtrans-67.8-30.9177.600000111.8Q137 N142 I143Q137-A140 HydrophobicContact CB-CB 4.4Å; Q137-A140 WeakPolarHBondContact O-CA 3.44Å; Q137-A140 WeakPolarHBondContact O-CB 3.48Å; Q137-A140 PolarHBondContact O-N 3.42Å; A140-N142 PolarHBondContact O-N 3.26Å; A140-I143 WeakPolarHBondContact O-CB 3.2Å; A140-I143 PolarHBondContact O-N 3.43Å
141V68.2Low74.9Confident2 Ų259.1 Ų59.11%0.01231%0.314CS..Hα-helixtrans-54-33172.9157.30000111.8L112 I122 F135 Q137 M138 E139 I143 A144 L150 I154L112-V141 HydrophobicContact CD1-CG1 4.37Å; I122-V141 HydrophobicContact CD1-CG1 3.83Å; I122-V141 WeakPolarHBondContact CD1-O 3.37Å; I122-V141 HydrophobicContact CG1-CG1 4.49Å; I122-V141 HydrophobicContact CG2-CG1 3.82Å; F135-V141 HydrophobicContact CE2-CG2 4.27Å; Q137-V141 WeakPolarHBondContact O-CG2 3.46Å; Q137-V141 PolarHBondContact O-N 2.94Å; M138-V141 WeakPolarHBondContact O-CB 3.33Å; E139-V141 VanDerWaalsContact C-N 3.27Å; E139-V141 PolarHBondContact O-N 3.35Å; V141-I143 PolarHBondContact O-N 3.41Å; V141-A144 WeakPolarHBondContact O-CB 3.29Å; V141-A144 PolarHBondContact O-N 2.88Å; V141-L150 HydrophobicContact CB-CD1 3.79Å; V141-L150 HydrophobicContact CG1-CD1 3.2Å; V141-L150 HydrophobicContact CG2-CD1 3.57Å; V141-I154 HydrophobicContact CG2-CD1 4.19Å; V141-I154 HydrophobicContact CG2-CG1 3.73Å
142N68.7Low74.3Confident86 Ų8659.8 Ų59.846%0.4632%0.315SS..THydrogen-bonded Turntrans-58.3-17.4177-68.9-52.7000114.7I122 E139 A140I122-N142 WeakPolarHBondContact CB-OD1 3.2Å; I122-N142 WeakPolarHBondContact CG2-OD1 3.32Å; E139-N142 VanDerWaalsContact O-CB 3.31Å; E139-N142 WeakPolarHBondContact O-CB 3.32Å; E139-N142 PolarHBondContact O-N 3.21Å; E139-N142 PolarHBondContact O-ND2 3Å; E139-N142 VanDerWaalsContact O-ND2 3.11Å; A140-N142 PolarHBondContact O-N 3.26Å
143I70.4Confident73.7Confident137 Ų13761.3 Ų61.370%0.70333%0.329SS*.THydrogen-bonded Turntrans-86.3-25.6-179.3-56.6169.8000111.1A140 V141 Q145A140-I143 WeakPolarHBondContact O-CB 3.2Å; A140-I143 PolarHBondContact O-N 3.43Å; V141-I143 PolarHBondContact O-N 3.41Å; I143-Q145 PolarHBondContact O-N 3.42Å
144A72.8Confident73.3Confident13 Ų1361.4 Ų61.411%0.10733%0.33CS..  trans-68.1125.8-177.200000110.8V141 E149 L150V141-A144 WeakPolarHBondContact O-CB 3.29Å; V141-A144 PolarHBondContact O-N 2.88Å; A144-E149 HydrophobicContact CB-CB 3.94Å; A144-L150 HydrophobicContact CB-CB 3.81Å; A144-L150 HydrophobicContact CB-CD1 4.35Å
145Q71.7Confident72.7Confident170 Ų17060.2 Ų60.279%0.79432%0.319SS*.  trans-99.9-20.3179.5-62.5-170.1-3.400112.2I143 E149I143-Q145 PolarHBondContact O-N 3.42Å; Q145-E149 PolarHBondContact N-OE2 3.42Å
146T75.4Confident72.3Confident59 Ų5964.4 Ų64.436%0.36235%0.346SS..SBendtrans-116.1148.3178.568.50000111A148 E149 L150T146-A148 PolarHBondContact O-N 3.11Å; T146-E149 PolarHBondContact N-OE2 3.43Å; T146-E149 PolarHBondContact O-N 2.73Å; T146-E149 WeakPolarHBondContact OG1-CB 3.49Å; T146-E149 VanDerWaalsContact OG1-CG 3.24Å; T146-E149 WeakPolarHBondContact OG1-CG 3.12Å; T146-E149 PolarHBondContact OG1-N 3.11Å; T146-E149 VanDerWaalsContact OG1-N 3.12Å; T146-L150 WeakPolarHBondContact O-CB 3.35Å; T146-L150 PolarHBondContact O-N 3.46Å
147P75.3Confident72.3Confident24 Ų2461.1 Ų61.116%0.15633%0.334CS..Hα-helixtrans-54.6-31.6172.3-28.637000113.4I113 T116 L117 Y151 L173I113-P147 HydrophobicContact CG2-CB 4.28Å; T116-P147 HydrophobicContact CG2-CG 4.22Å; L117-P147 HydrophobicContact CD1-CG 4.49Å; P147-Y151 WeakPolarHBondContact O-CB 3.37Å; P147-Y151 PolarHBondContact O-N 2.66Å; P147-L173 HydrophobicContact CB-CB 4.31Å; P147-L173 HydrophobicContact CB-CD1 3.58Å
148A75.7Confident72.7Confident30 Ų3058.8 Ų58.825%0.24832%0.324CS..Hα-helixtrans-72.1-42.3177.700000112.9T146 L150 Y151 N152 L173T146-A148 PolarHBondContact O-N 3.11Å; A148-L150 VanDerWaalsContact C-N 3.3Å; A148-L150 PolarHBondContact O-N 3.18Å; A148-Y151 PolarHBondContact O-N 3.17Å; A148-N152 WeakPolarHBondContact O-CB 3.25Å; A148-N152 PolarHBondContact O-N 2.65Å; A148-N152 PolarHBondContact O-ND2 2.9Å; A148-L173 HydrophobicContact CB-CD1 4.33Å
149E77.4Confident73.1Confident99 Ų9960.6 Ų60.646%0.46334%0.337SS..Hα-helixtrans-61.6-42.4171.9-77.3168.5-17700111.2A144 Q145 T146 N152 A153A144-E149 HydrophobicContact CB-CB 3.94Å; Q145-E149 PolarHBondContact N-OE2 3.42Å; T146-E149 PolarHBondContact N-OE2 3.43Å; T146-E149 PolarHBondContact O-N 2.73Å; T146-E149 WeakPolarHBondContact OG1-CB 3.49Å; T146-E149 VanDerWaalsContact OG1-CG 3.24Å; T146-E149 WeakPolarHBondContact OG1-CG 3.12Å; T146-E149 PolarHBondContact OG1-N 3.11Å; T146-E149 VanDerWaalsContact OG1-N 3.12Å; E149-N152 PolarHBondContact O-N 3.05Å; E149-A153 VanDerWaalsContact O-CB 3.24Å; E149-A153 WeakPolarHBondContact O-CB 3.16Å; E149-A153 PolarHBondContact O-N 3.31Å
150L76.7Confident73.7Confident0 Ų052.9 Ų52.90%030%0.301CS..Hα-helixtrans-62.1-49.5177.8175.257.2000111L112 I113 T116 V141 A144 T146 A148 A153 I154L112-L150 HydrophobicContact CB-CD2 4.06Å; I113-L150 HydrophobicContact CG1-CD2 3.98Å; I113-L150 HydrophobicContact CG1-CG 4.26Å; T116-L150 WeakPolarHBondContact OG1-CD2 3.28Å; V141-L150 HydrophobicContact CB-CD1 3.79Å; V141-L150 HydrophobicContact CG1-CD1 3.2Å; V141-L150 HydrophobicContact CG2-CD1 3.57Å; A144-L150 HydrophobicContact CB-CB 3.81Å; A144-L150 HydrophobicContact CB-CD1 4.35Å; T146-L150 WeakPolarHBondContact O-CB 3.35Å; T146-L150 PolarHBondContact O-N 3.46Å; A148-L150 VanDerWaalsContact C-N 3.3Å; A148-L150 PolarHBondContact O-N 3.18Å; L150-A153 PolarHBondContact O-N 3.46Å; L150-I154 HydrophobicContact CD1-CD1 3.49Å; L150-I154 VanDerWaalsContact CD1-CD1 3.49Å; L150-I154 HydrophobicContact CD1-CG1 4.01Å; L150-I154 HydrophobicContact CG-CD1 3.77Å; L150-I154 WeakPolarHBondContact O-CB 3.44Å; L150-I154 WeakPolarHBondContact O-CG1 3.47Å; L150-I154 PolarHBondContact O-N 2.8Å
151Y73.3Confident74.2Confident20 Ų2052.3 Ų52.38%0.07830%0.296CS..Hα-helixtrans-53.2-56.5175.1179.4-98.8000110.2I113 P147 A148 A153 I154 L155 F164I113-Y151 HydrophobicContact CD1-CD2 4.08Å; P147-Y151 WeakPolarHBondContact O-CB 3.37Å; P147-Y151 PolarHBondContact O-N 2.66Å; A148-Y151 PolarHBondContact O-N 3.17Å; Y151-A153 PolarHBondContact O-N 3.44Å; Y151-I154 PolarHBondContact O-N 3.31Å; Y151-L155 HydrophobicContact CD1-CD1 3.61Å; Y151-L155 HydrophobicContact CD1-CG 4.17Å; Y151-L155 HydrophobicContact CE1-CD1 3.18Å; Y151-L155 HydrophobicContact CE1-CG 4.1Å; Y151-L155 HydrophobicContact CE2-CD1 4.3Å; Y151-L155 HydrophobicContact CG-CD1 4.32Å; Y151-L155 HydrophobicContact CG-CG 4.45Å; Y151-L155 WeakPolarHBondContact O-CB 3.4Å; Y151-L155 WeakPolarHBondContact O-CG 3.12Å; Y151-L155 PolarHBondContact O-N 3.36Å; Y151-F164 HydrophobicContact CD2-CE1 4.21Å; Y151-F164 AromaticContact CE2-CD1 3.66Å; Y151-F164 HydrophobicContact CE2-CD1 3.66Å; Y151-F164 AromaticContact CE2-CE1 3.33Å; Y151-F164 HydrophobicContact CE2-CE1 3.33Å; Y151-F164 HydrophobicContact CE2-CZ 4.23Å; Y151-F164 AromaticContact CZ-CD1 3.69Å; Y151-F164 AromaticContact CZ-CE1 3.88Å; Y151-F164 WeakPolarHBondContact OH-CD1 3.47Å
152N77.1Confident74.7Confident62 Ų6255.3 Ų55.333%0.33232%0.321SS..Hα-helixtrans-61.4-39.5-179.7-75.5-29.1000113.4A148 E149 I154 L155 V156 E170A148-N152 WeakPolarHBondContact O-CB 3.25Å; A148-N152 PolarHBondContact O-N 2.65Å; A148-N152 PolarHBondContact O-ND2 2.9Å; E149-N152 PolarHBondContact O-N 3.05Å; N152-I154 PolarHBondContact O-N 3.08Å; N152-L155 PolarHBondContact O-N 3.33Å; N152-V156 VanDerWaalsContact O-CG2 3.31Å; N152-V156 WeakPolarHBondContact O-CG2 3.38Å; N152-V156 PolarHBondContact O-N 3.19Å; N152-E170 PolarHBondContact ND2-OE1 3Å; N152-E170 PolarHBondContact OD1-OE1 2.93Å
153A76.8Confident75.1Confident42 Ų4252.1 Ų52.135%0.34730%0.303SS..Hα-helixtrans-64.3-39.717700000112.3E149 L150 Y151E149-A153 VanDerWaalsContact O-CB 3.24Å; E149-A153 WeakPolarHBondContact O-CB 3.16Å; E149-A153 PolarHBondContact O-N 3.31Å; L150-A153 PolarHBondContact O-N 3.46Å; Y151-A153 PolarHBondContact O-N 3.44Å
154I73.9Confident75.1Confident2 Ų246.2 Ų46.21%0.0127%0.273CS..Hα-helixtrans-70.1-37.9176.4-68.7170000110.6V109 F135 V141 L150 Y151 N152 V156 T158V109-I154 HydrophobicContact CB-CG2 4.41Å; V109-I154 HydrophobicContact CG1-CD1 4.08Å; V109-I154 HydrophobicContact CG1-CG2 4.02Å; V109-I154 HydrophobicContact CG2-CD1 4.2Å; V109-I154 HydrophobicContact CG2-CG2 3.46Å; V109-I154 VanDerWaalsContact CG2-CG2 3.46Å; F135-I154 HydrophobicContact CE2-CG1 4.25Å; F135-I154 HydrophobicContact CZ-CD1 4.34Å; F135-I154 HydrophobicContact CZ-CG1 3.97Å; F135-I154 HydrophobicContact CZ-CG2 4.3Å; V141-I154 HydrophobicContact CG2-CD1 4.19Å; V141-I154 HydrophobicContact CG2-CG1 3.73Å; L150-I154 HydrophobicContact CD1-CD1 3.49Å; L150-I154 VanDerWaalsContact CD1-CD1 3.49Å; L150-I154 HydrophobicContact CD1-CG1 4.01Å; L150-I154 HydrophobicContact CG-CD1 3.77Å; L150-I154 WeakPolarHBondContact O-CB 3.44Å; L150-I154 WeakPolarHBondContact O-CG1 3.47Å; L150-I154 PolarHBondContact O-N 2.8Å; Y151-I154 PolarHBondContact O-N 3.31Å; N152-I154 PolarHBondContact O-N 3.08Å; I154-V156 PolarHBondContact O-N 3.21Å; I154-T158 HydrophobicContact CG2-CG2 4.08Å; I154-T158 WeakPolarHBondContact O-CB 3.46Å; I154-T158 WeakPolarHBondContact O-CG2 3.2Å; I154-T158 PolarHBondContact O-N 3.07Å; I154-T158 PolarHBondContact O-OG1 2.94Å
155L70.8Confident74.6Confident28 Ų2853.4 Ų53.415%0.14730%0.304CS..Hα-helixtrans-67.7-34.6-175.5-74.9-168000114.7Y151 N152 D157 A161 F164Y151-L155 HydrophobicContact CD1-CD1 3.61Å; Y151-L155 HydrophobicContact CD1-CG 4.17Å; Y151-L155 HydrophobicContact CE1-CD1 3.18Å; Y151-L155 HydrophobicContact CE1-CG 4.1Å; Y151-L155 HydrophobicContact CE2-CD1 4.3Å; Y151-L155 HydrophobicContact CG-CD1 4.32Å; Y151-L155 HydrophobicContact CG-CG 4.45Å; Y151-L155 WeakPolarHBondContact O-CB 3.4Å; Y151-L155 WeakPolarHBondContact O-CG 3.12Å; Y151-L155 PolarHBondContact O-N 3.36Å; N152-L155 PolarHBondContact O-N 3.33Å; L155-D157 VanDerWaalsContact C-N 3.32Å; L155-D157 PolarHBondContact O-N 3.46Å; L155-A161 WeakPolarHBondContact O-CB 3.36Å; L155-F164 HydrophobicContact CD1-CB 4.33Å; L155-F164 HydrophobicContact CD1-CG 4.38Å; L155-F164 HydrophobicContact CD2-CB 3.75Å; L155-F164 HydrophobicContact CD2-CD1 3.65Å; L155-F164 HydrophobicContact CD2-CD2 2.93Å; L155-F164 HydrophobicContact CD2-CE1 3.82Å; L155-F164 HydrophobicContact CD2-CE2 3.13Å; L155-F164 HydrophobicContact CD2-CG 3.18Å; L155-F164 HydrophobicContact CD2-CZ 3.55Å; L155-F164 HydrophobicContact CG-CD2 4.39Å; L155-F164 HydrophobicContact CG-CG 4.4Å
156V70.4Confident74.1Confident112 Ų11252.5 Ų52.568%0.67931%0.305SS*.Hα-helixtrans-67.3-35.2-168.6171.30000112.2N152 I154N152-V156 VanDerWaalsContact O-CG2 3.31Å; N152-V156 WeakPolarHBondContact O-CG2 3.38Å; N152-V156 PolarHBondContact O-N 3.19Å; I154-V156 PolarHBondContact O-N 3.21Å
157D71.6Confident73.4Confident105 Ų10550.7 Ų50.756%0.56129%0.294SS*.Hα-helixtrans-118.2-4.9-169.4-66.6-37.3000114.4Q137 L155Q137-D157 HydrophobicContact CG-CB 4.31Å; L155-D157 VanDerWaalsContact C-N 3.32Å; L155-D157 PolarHBondContact O-N 3.46Å
158T76.9Confident72.6Confident9 Ų953.4 Ų53.46%0.05531%0.306CS..SBendtrans-87.6146.6178.959.50000111.5F135 I154 L160 A161F135-T158 HydrophobicContact CD2-CG2 4.2Å; F135-T158 HydrophobicContact CE2-CG2 4.48Å; F135-T158 HydrophobicContact CG-CG2 4.24Å; I154-T158 HydrophobicContact CG2-CG2 4.08Å; I154-T158 WeakPolarHBondContact O-CB 3.46Å; I154-T158 WeakPolarHBondContact O-CG2 3.2Å; I154-T158 PolarHBondContact O-N 3.07Å; I154-T158 PolarHBondContact O-OG1 2.94Å; T158-L160 PolarHBondContact O-N 3.42Å; T158-A161 VanDerWaalsContact O-CB 3.28Å; T158-A161 WeakPolarHBondContact O-CB 3.38Å; T158-A161 PolarHBondContact O-N 3.39Å
159P78.8Confident71.7Confident60 Ų6056.3 Ų56.339%0.3933%0.325SS..G310 helixtrans-61.8-15.2172.226.9-34.8000112.3Y102 M105 A161Y102-P159 HydrophobicContact CD1-CG 3.99Å; Y102-P159 HydrophobicContact CE1-CB 3.86Å; Y102-P159 HydrophobicContact CE1-CG 3.35Å; Y102-P159 HydrophobicContact CE2-CB 4.46Å; M105-P159 HydrophobicContact SD-CG 4.3Å; P159-A161 PolarHBondContact O-N 3.31Å
160L79.7Confident70.8Confident0 Ų057.1 Ų57.10%033%0.329CS..G310 helixtrans-65.8-20.5173.7-56.1-177.3000112.7Y102 M105 I106 V109 T158 A162 F163 F164Y102-L160 HydrophobicContact CG-CD2 4.32Å; M105-L160 HydrophobicContact CB-CD1 3.89Å; M105-L160 HydrophobicContact CB-CG 4.43Å; I106-L160 HydrophobicContact CD1-CD2 4.33Å; I106-L160 HydrophobicContact CG1-CD1 3.95Å; I106-L160 HydrophobicContact CG1-CD2 3.86Å; V109-L160 HydrophobicContact CG2-CD1 4.24Å; T158-L160 PolarHBondContact O-N 3.42Å; L160-A162 PolarHBondContact O-N 3.47Å; L160-F163 HydrophobicContact CB-CD2 4.34Å; L160-F163 HydrophobicContact CD2-CD2 3.8Å; L160-F163 HydrophobicContact CD2-CE2 3.91Å; L160-F163 WeakPolarHBondContact O-CA 3.37Å; L160-F163 VanDerWaalsContact O-CB 3.27Å; L160-F163 WeakPolarHBondContact O-CB 3.5Å; L160-F163 PolarHBondContact O-N 2.82Å; L160-F164 HydrophobicContact CB-CD2 4.23Å; L160-F164 HydrophobicContact CB-CE2 3.83Å; L160-F164 WeakPolarHBondContact O-CD2 3.49Å
161A77.1Confident69.7Low39 Ų3964.9 Ų64.932%0.32237%0.365SS..G310 helixtrans-48.8-38.2179.900000113.1L155 T158 P159 F163 F164L155-A161 WeakPolarHBondContact O-CB 3.36Å; T158-A161 VanDerWaalsContact O-CB 3.28Å; T158-A161 WeakPolarHBondContact O-CB 3.38Å; T158-A161 PolarHBondContact O-N 3.39Å; P159-A161 PolarHBondContact O-N 3.31Å; A161-F163 PolarHBondContact O-N 2.92Å; A161-F164 PolarHBondContact O-N 3.49Å
162A77.7Confident69Low64 Ų6470 Ų7053%0.52939%0.394SS..G310 helixtrans-62.8-25.917800000113.1L160L160-A162 PolarHBondContact O-N 3.47Å
163F77.7Confident68.4Low19 Ų1968.9 Ų68.98%0.08339%0.387CS..G310 helixtrans-87.1-15.1-179.7-54.2-37.2000113.4Y102 L160 A161 L185 A188Y102-F163 HydrophobicContact CD2-CE2 4.04Å; Y102-F163 HydrophobicContact CD2-CZ 4.26Å; L160-F163 HydrophobicContact CB-CD2 4.34Å; L160-F163 HydrophobicContact CD2-CD2 3.8Å; L160-F163 HydrophobicContact CD2-CE2 3.91Å; L160-F163 WeakPolarHBondContact O-CA 3.37Å; L160-F163 VanDerWaalsContact O-CB 3.27Å; L160-F163 WeakPolarHBondContact O-CB 3.5Å; L160-F163 PolarHBondContact O-N 2.82Å; A161-F163 PolarHBondContact O-N 2.92Å; F163-L185 HydrophobicContact CB-CD2 4.01Å; F163-A188 HydrophobicContact CB-CB 3.66Å; F163-A188 HydrophobicContact CD1-CB 3.84Å; F163-A188 HydrophobicContact CG-CB 3.97Å
164F71.2Confident68.1Low14 Ų1470 Ų706%0.06139%0.388CS..SBendtrans-91.3-4-177.7-78-85.6000114.4Y151 L155 L160 A161 D166 C167 I181 L185Y151-F164 HydrophobicContact CD2-CE1 4.21Å; Y151-F164 AromaticContact CE2-CD1 3.66Å; Y151-F164 HydrophobicContact CE2-CD1 3.66Å; Y151-F164 AromaticContact CE2-CE1 3.33Å; Y151-F164 HydrophobicContact CE2-CE1 3.33Å; Y151-F164 HydrophobicContact CE2-CZ 4.23Å; Y151-F164 AromaticContact CZ-CD1 3.69Å; Y151-F164 AromaticContact CZ-CE1 3.88Å; Y151-F164 WeakPolarHBondContact OH-CD1 3.47Å; L155-F164 HydrophobicContact CD1-CB 4.33Å; L155-F164 HydrophobicContact CD1-CG 4.38Å; L155-F164 HydrophobicContact CD2-CB 3.75Å; L155-F164 HydrophobicContact CD2-CD1 3.65Å; L155-F164 HydrophobicContact CD2-CD2 2.93Å; L155-F164 HydrophobicContact CD2-CE1 3.82Å; L155-F164 HydrophobicContact CD2-CE2 3.13Å; L155-F164 HydrophobicContact CD2-CG 3.18Å; L155-F164 HydrophobicContact CD2-CZ 3.55Å; L155-F164 HydrophobicContact CG-CD2 4.39Å; L155-F164 HydrophobicContact CG-CG 4.4Å; L160-F164 HydrophobicContact CB-CD2 4.23Å; L160-F164 HydrophobicContact CB-CE2 3.83Å; L160-F164 WeakPolarHBondContact O-CD2 3.49Å; A161-F164 PolarHBondContact O-N 3.49Å; F164-D166 PolarHBondContact O-N 3.25Å; F164-D166 VanDerWaalsContact O-N 3.1Å; F164-C167 HydrophobicContact CD1-CB 3.97Å; F164-C167 WeakPolarHBondContact O-CB 3.28Å; F164-C167 PolarHBondContact O-N 2.93Å; F164-I181 HydrophobicContact CE1-CG2 3.93Å; F164-L185 HydrophobicContact CD1-CD2 3.68Å; F164-L185 HydrophobicContact CD1-CG 4.39Å; F164-L185 HydrophobicContact CD2-CD2 3.48Å; F164-L185 VanDerWaalsContact CD2-CD2 3.48Å; F164-L185 HydrophobicContact CE1-CD1 3.6Å; F164-L185 HydrophobicContact CE1-CD2 3.47Å; F164-L185 VanDerWaalsContact CE1-CD2 3.47Å; F164-L185 HydrophobicContact CE1-CG 3.85Å; F164-L185 HydrophobicContact CE2-CD1 4.05Å; F164-L185 HydrophobicContact CE2-CD2 3.29Å; F164-L185 HydrophobicContact CE2-CG 4.26Å; F164-L185 HydrophobicContact CG-CD2 3.72Å; F164-L185 HydrophobicContact CZ-CD1 3.32Å; F164-L185 HydrophobicContact CZ-CD2 3.32Å; F164-L185 HydrophobicContact CZ-CG 3.83Å
165Q61.9Low68Low164 Ų16475.4 Ų75.477%0.76641%0.413SS*.THydrogen-bonded Turntrans-59.5-26.2-177.9-66.5-173.4-8.500113.2
166D60.2Low68.1Low151 Ų15177.7 Ų77.781%0.80742%0.424SS*.THydrogen-bonded Turntrans-98.41.8178.7-63.2-33.9000113.2F164F164-D166 PolarHBondContact O-N 3.25Å; F164-D166 VanDerWaalsContact O-N 3.1Å
167C61.1Low68.5Low21 Ų2173.8 Ų73.814%0.14240%0.399CS..SBendtrans-83.4145.9-176-74.80000112.9F164 T184F164-C167 HydrophobicContact CD1-CB 3.97Å; F164-C167 WeakPolarHBondContact O-CB 3.28Å; F164-C167 PolarHBondContact O-N 2.93Å; C167-T184 WeakPolarHBondContact SG-CG2 3.36Å
168I58.8Low69Low80 Ų8068.9 Ų68.941%0.4137%0.373SS..PPolyproline II helixtrans-49.4146.2-171.4-64.2163.9000113.2I180I168-I180 HydrophobicContact CD1-CB 4.42Å; I168-I180 HydrophobicContact CD1-CG2 3.46Å; I168-I180 VanDerWaalsContact CD1-CG2 3.46Å
169S57Low69.4Low91 Ų9172.4 Ų72.464%0.63639%0.389SS*.PPolyproline II helixtrans-49.3138.5171.949.50000112.1Q171S169-Q171 PolarHBondContact O-N 2.89Å
170E57.6Low69.7Low116 Ų11670.6 Ų70.654%0.54238%0.376SS..THydrogen-bonded Turntrans-49.7-4.3-176-62.1179.6146.100117.1N152N152-E170 PolarHBondContact ND2-OE1 3Å; N152-E170 PolarHBondContact OD1-OE1 2.93Å
171Q53.5Low69.9Low163 Ų16371 Ų7176%0.76238%0.377SS*.THydrogen-bonded Turntrans-87.3-7-153-76-165.3-18.700118.7S169S169-Q171 PolarHBondContact O-N 2.89Å
172D59.3Low70.6Confident129 Ų12972.3 Ų72.369%0.6937%0.374SS*.  trans-155.282.6167.7-79.6-51.7000110D174 N177D172-D174 VanDerWaalsContact C-N 3.29Å; D172-D174 PolarHBondContact O-N 3.32Å; D172-N177 PolarHBondContact O-ND2 3.09Å
173L63.6Low71.2Confident37 Ų3770.3 Ų70.319%0.19435%0.354CS..  trans-73.983173.9-69.7169.2000110.3L117 P147 A148 I181L117-L173 WeakPolarHBondContact CD1-O 3.46Å; P147-L173 HydrophobicContact CB-CB 4.31Å; P147-L173 HydrophobicContact CB-CD1 3.58Å; A148-L173 HydrophobicContact CB-CD1 4.33Å; L173-I181 HydrophobicContact CD2-CD1 3.51Å
174D71.9Confident71.7Confident66 Ų6670.5 Ų70.535%0.35336%0.357SS..  trans-95.9172.1167.267.920.8000111.5D172 M176 N177 I178D172-D174 VanDerWaalsContact C-N 3.29Å; D172-D174 PolarHBondContact O-N 3.32Å; D174-M176 PolarHBondContact O-N 3.37Å; D174-M176 WeakPolarHBondContact OD1-CB 3.45Å; D174-M176 PolarHBondContact OD1-N 3.02Å; D174-N177 PolarHBondContact O-N 2.88Å; D174-N177 VanDerWaalsContact OD1-CB 3.24Å; D174-N177 WeakPolarHBondContact OD1-CB 3.38Å; D174-N177 PolarHBondContact OD1-N 3.49Å; D174-N177 PolarHBondContact OD1-ND2 2.94Å; D174-N177 VanDerWaalsContact OD1-ND2 3.13Å; D174-I178 WeakPolarHBondContact O-CG1 3.27Å; D174-I178 PolarHBondContact O-N 3.3Å
175E72Confident72.6Confident116 Ų11669.8 Ų69.854%0.54235%0.354SS..Hα-helixtrans-58.2-37-179.2-70.1-177.5-17700112.9L117 H118 I178 E179L117-E175 HydrophobicContact CD2-CG 3.91Å; H118-E175 IonicContact CE1-OE1 3.95Å; H118-E175 PolarHBondContact CE1-OE1 2.74Å; H118-E175 IonicContact NE2-OE1 2.74Å; H118-E175 PolarHBondContact NE2-OE1 3.32Å; H118-E175 VanDerWaalsContact NE2-OE1 3.08Å; E175-I178 PolarHBondContact O-N 2.93Å; E175-E179 PolarHBondContact O-N 2.87Å
176M71.4Confident74.1Confident76 Ų7663.1 Ų63.137%0.37432%0.322SS..Hα-helixtrans-65-44.7178-177.9177.966.100110.3D174 I178 E179 I180D174-M176 PolarHBondContact O-N 3.37Å; D174-M176 WeakPolarHBondContact OD1-CB 3.45Å; D174-M176 PolarHBondContact OD1-N 3.02Å; M176-I178 VanDerWaalsContact C-N 3.28Å; M176-I178 PolarHBondContact O-N 3.31Å; M176-E179 PolarHBondContact O-N 3.01Å; M176-I180 HydrophobicContact CG-CD1 4.02Å; M176-I180 VanDerWaalsContact O-CG1 3.3Å; M176-I180 WeakPolarHBondContact O-CG1 3.47Å; M176-I180 PolarHBondContact O-N 2.72Å
177N78.8Confident75.6Confident29 Ų2957.2 Ų57.216%0.15529%0.289CS..Hα-helixtrans-66.2-31.3178.2-70.4-30.4000111.5D172 D174 I180 I181D172-N177 PolarHBondContact O-ND2 3.09Å; D174-N177 PolarHBondContact O-N 2.88Å; D174-N177 VanDerWaalsContact OD1-CB 3.24Å; D174-N177 WeakPolarHBondContact OD1-CB 3.38Å; D174-N177 PolarHBondContact OD1-N 3.49Å; D174-N177 PolarHBondContact OD1-ND2 2.94Å; D174-N177 VanDerWaalsContact OD1-ND2 3.13Å; N177-I180 PolarHBondContact O-N 3.33Å; N177-I181 WeakPolarHBondContact O-CB 3.28Å; N177-I181 WeakPolarHBondContact O-CD1 3.33Å; N177-I181 WeakPolarHBondContact O-CG1 3.28Å; N177-I181 PolarHBondContact O-N 2.74Å
178I83.2Confident77.1Confident2 Ų257.3 Ų57.31%0.0129%0.292CS..Hα-helixtrans-65.7-44.4172.8-64.2166.9000111.7I110 I113 T114 L117 D174 E175 M176 I180 I181 R182I110-I178 HydrophobicContact CD1-CG2 4.02Å; I110-I178 HydrophobicContact CG2-CG2 3.73Å; I113-I178 HydrophobicContact CG2-CD1 3.88Å; I113-I178 HydrophobicContact CG2-CG1 3.92Å; T114-I178 WeakPolarHBondContact OG1-CG2 3.19Å; L117-I178 HydrophobicContact CB-CD1 4.47Å; L117-I178 HydrophobicContact CD2-CD1 3.73Å; D174-I178 WeakPolarHBondContact O-CG1 3.27Å; D174-I178 PolarHBondContact O-N 3.3Å; E175-I178 PolarHBondContact O-N 2.93Å; M176-I178 VanDerWaalsContact C-N 3.28Å; M176-I178 PolarHBondContact O-N 3.31Å; I178-I180 VanDerWaalsContact C-N 3.31Å; I178-I180 PolarHBondContact O-N 3.1Å; I178-I181 PolarHBondContact O-N 2.73Å; I178-R182 WeakPolarHBondContact O-CB 3.13Å; I178-R182 PolarHBondContact O-N 2.64Å
179E84.7Confident78.8Confident84 Ų8453.8 Ų53.839%0.39327%0.273SS..Hα-helixtrans-67.2-33.2175.9-75.1-60.5142.500112.1E175 M176 R182 N183E175-E179 PolarHBondContact O-N 2.87Å; M176-E179 PolarHBondContact O-N 3.01Å; E179-R182 PolarHBondContact O-N 3.13Å; E179-R182 IonicContact OE1-CZ 3.53Å; E179-R182 IonicContact OE1-NH1 2.92Å; E179-R182 PolarHBondContact OE1-NH1 2.94Å; E179-R182 WeakPolarHBondContact OE2-CD 3.47Å; E179-R182 IonicContact OE2-NH1 2.88Å; E179-N183 WeakPolarHBondContact O-CB 3.32Å; E179-N183 PolarHBondContact O-N 3.29Å; E179-N183 PolarHBondContact O-ND2 3.1Å
180I85.4Confident80.6Confident22 Ų2249.5 Ų49.511%0.11324%0.243CC..Hα-helixtrans-64.9-44.5171.5-67.4167.2000110.7I168 M176 N177 I178 N183 T184 L232 L240I168-I180 HydrophobicContact CD1-CB 4.42Å; I168-I180 HydrophobicContact CD1-CG2 3.46Å; I168-I180 VanDerWaalsContact CD1-CG2 3.46Å; M176-I180 HydrophobicContact CG-CD1 4.02Å; M176-I180 VanDerWaalsContact O-CG1 3.3Å; M176-I180 WeakPolarHBondContact O-CG1 3.47Å; M176-I180 PolarHBondContact O-N 2.72Å; N177-I180 PolarHBondContact O-N 3.33Å; I178-I180 VanDerWaalsContact C-N 3.31Å; I178-I180 PolarHBondContact O-N 3.1Å; I180-N183 PolarHBondContact O-N 3.22Å; I180-T184 WeakPolarHBondContact O-CB 3.16Å; I180-T184 PolarHBondContact O-N 3.31Å; I180-T184 PolarHBondContact O-OG1 3.46Å; I180-L232 HydrophobicContact CD1-CD1 4.05Å; I180-L232 HydrophobicContact CG1-CD1 4.42Å; I180-L240 HydrophobicContact CG2-CD2 3.83Å
181I84.9Confident82.4Confident8 Ų845.7 Ų45.74%0.04123%0.225CC..Hα-helixtrans-60.1-47.9175.4-71161.5000109.9I110 F164 L173 N177 I178 N183 T184 L185I110-I181 HydrophobicContact CD1-CG2 4.06Å; F164-I181 HydrophobicContact CE1-CG2 3.93Å; L173-I181 HydrophobicContact CD2-CD1 3.51Å; N177-I181 WeakPolarHBondContact O-CB 3.28Å; N177-I181 WeakPolarHBondContact O-CD1 3.33Å; N177-I181 WeakPolarHBondContact O-CG1 3.28Å; N177-I181 PolarHBondContact O-N 2.74Å; I178-I181 PolarHBondContact O-N 2.73Å; I181-N183 VanDerWaalsContact C-N 3.33Å; I181-N183 PolarHBondContact O-N 2.88Å; I181-T184 PolarHBondContact O-N 3.48Å; I181-L185 HydrophobicContact CG2-CD1 3.76Å; I181-L185 HydrophobicContact CG2-CG 4.26Å; I181-L185 WeakPolarHBondContact O-CB 3.4Å; I181-L185 VanDerWaalsContact O-CG 3.28Å; I181-L185 WeakPolarHBondContact O-CG 3.23Å; I181-L185 PolarHBondContact O-N 3.33Å
182R90Very high84.3Confident66 Ų6639.8 Ų39.825%0.24920%0.202CC..Hα-helixtrans-52.6-52.1175.7177.9-179.1-110166.1-4.6110.8D107 I110 I178 E179 T184 L185 Y186D107-R182 IonicContact OD1-NE 3.55Å; D107-R182 IonicContact OD1-NH2 2.7Å; I110-R182 HydrophobicContact CD1-CB 3.74Å; I110-R182 HydrophobicContact CG1-CB 3.84Å; I110-R182 HydrophobicContact CG1-CG 4.15Å; I110-R182 HydrophobicContact CG2-CB 4.49Å; I178-R182 WeakPolarHBondContact O-CB 3.13Å; I178-R182 PolarHBondContact O-N 2.64Å; E179-R182 PolarHBondContact O-N 3.13Å; E179-R182 IonicContact OE1-CZ 3.53Å; E179-R182 IonicContact OE1-NH1 2.92Å; E179-R182 PolarHBondContact OE1-NH1 2.94Å; E179-R182 WeakPolarHBondContact OE2-CD 3.47Å; E179-R182 IonicContact OE2-NH1 2.88Å; R182-T184 VanDerWaalsContact C-N 3.35Å; R182-T184 PolarHBondContact O-N 3.38Å; R182-L185 PolarHBondContact O-N 2.63Å; R182-Y186 HydrophobicContact CG-CD2 3.82Å; R182-Y186 HydrophobicContact CG-CE2 4Å; R182-Y186 WeakPolarHBondContact O-CB 3.2Å; R182-Y186 VanDerWaalsContact O-CD2 3.31Å; R182-Y186 WeakPolarHBondContact O-CD2 3.25Å; R182-Y186 PolarHBondContact O-N 3.28Å
183N90.9Very high86Confident22 Ų2233.6 Ų33.612%0.11817%0.169CC..Hα-helixtrans-66.5-36.4-177.8-73.2-49000113E179 I180 I181 K187 R219 I223 L240E179-N183 WeakPolarHBondContact O-CB 3.32Å; E179-N183 PolarHBondContact O-N 3.29Å; E179-N183 PolarHBondContact O-ND2 3.1Å; I180-N183 PolarHBondContact O-N 3.22Å; I181-N183 VanDerWaalsContact C-N 3.33Å; I181-N183 PolarHBondContact O-N 2.88Å; N183-K187 VanDerWaalsContact O-CB 3.32Å; N183-K187 WeakPolarHBondContact O-CB 3.21Å; N183-K187 PolarHBondContact O-N 3.3Å; N183-R219 PolarHBondContact OD1-NH1 3.3Å; N183-R219 PolarHBondContact OD1-NH2 3.46Å; N183-R219 VanDerWaalsContact OD1-NH2 3.09Å; N183-I223 HydrophobicContact CB-CD1 4.01Å; N183-I223 WeakPolarHBondContact OD1-CD1 3.4Å; N183-I223 WeakPolarHBondContact OD1-CG1 2.84Å; N183-L240 HydrophobicContact CB-CB 4.21Å; N183-L240 HydrophobicContact CB-CD1 4.4Å; N183-L240 HydrophobicContact CB-CD2 4Å; N183-L240 HydrophobicContact CB-CG 4.42Å
184T88.4Confident87.5Confident23 Ų2334.6 Ų34.614%0.14117%0.17CC..Hα-helixtrans-65.4-43.4175.7-53.90000111.4C167 I180 I181 R182 K187 A188 L240C167-T184 WeakPolarHBondContact SG-CG2 3.36Å; I180-T184 WeakPolarHBondContact O-CB 3.16Å; I180-T184 PolarHBondContact O-N 3.31Å; I180-T184 PolarHBondContact O-OG1 3.46Å; I181-T184 PolarHBondContact O-N 3.48Å; R182-T184 VanDerWaalsContact C-N 3.35Å; R182-T184 PolarHBondContact O-N 3.38Å; T184-K187 WeakPolarHBondContact O-CB 3.43Å; T184-K187 PolarHBondContact O-N 3.25Å; T184-A188 PolarHBondContact O-N 2.5Å; T184-L240 WeakPolarHBondContact OG1-CD2 3.42Å
185L90.3Very high88.6Confident0 Ų038 Ų380%018%0.182CC..Hα-helixtrans-64.1-46.8176.6-70.9169.8000112.5I106 I110 F163 F164 I181 R182 K187 A188 Y189I106-L185 HydrophobicContact CD1-CB 4.05Å; I106-L185 HydrophobicContact CG1-CB 4.14Å; I106-L185 HydrophobicContact CG2-CB 3.92Å; I106-L185 HydrophobicContact CG2-CD1 4.03Å; I110-L185 HydrophobicContact CD1-CD1 4.48Å; F163-L185 HydrophobicContact CB-CD2 4.01Å; F164-L185 HydrophobicContact CD1-CD2 3.68Å; F164-L185 HydrophobicContact CD1-CG 4.39Å; F164-L185 HydrophobicContact CD2-CD2 3.48Å; F164-L185 VanDerWaalsContact CD2-CD2 3.48Å; F164-L185 HydrophobicContact CE1-CD1 3.6Å; F164-L185 HydrophobicContact CE1-CD2 3.47Å; F164-L185 VanDerWaalsContact CE1-CD2 3.47Å; F164-L185 HydrophobicContact CE1-CG 3.85Å; F164-L185 HydrophobicContact CE2-CD1 4.05Å; F164-L185 HydrophobicContact CE2-CD2 3.29Å; F164-L185 HydrophobicContact CE2-CG 4.26Å; F164-L185 HydrophobicContact CG-CD2 3.72Å; F164-L185 HydrophobicContact CZ-CD1 3.32Å; F164-L185 HydrophobicContact CZ-CD2 3.32Å; F164-L185 HydrophobicContact CZ-CG 3.83Å; I181-L185 HydrophobicContact CG2-CD1 3.76Å; I181-L185 HydrophobicContact CG2-CG 4.26Å; I181-L185 WeakPolarHBondContact O-CB 3.4Å; I181-L185 VanDerWaalsContact O-CG 3.28Å; I181-L185 WeakPolarHBondContact O-CG 3.23Å; I181-L185 PolarHBondContact O-N 3.33Å; R182-L185 PolarHBondContact O-N 2.63Å; L185-K187 VanDerWaalsContact C-N 3.28Å; L185-K187 PolarHBondContact O-N 3.14Å; L185-A188 PolarHBondContact O-N 3.01Å; L185-Y189 VanDerWaalsContact O-CB 3.25Å; L185-Y189 WeakPolarHBondContact O-CB 3.46Å; L185-Y189 PolarHBondContact O-N 2.92Å
186Y92.8Very high89.7Confident23 Ų2334.2 Ų34.29%0.0916%0.164CC..Hα-helixtrans-63-36.7177-92.9-76.4000112.1S103 I106 D107 R182 Y189 L190 R219S103-Y186 PolarHBondContact O-OH 3.41Å; I106-Y186 HydrophobicContact CB-CE2 4.23Å; I106-Y186 HydrophobicContact CG2-CD2 3.71Å; I106-Y186 HydrophobicContact CG2-CE2 3.52Å; D107-Y186 WeakPolarHBondContact OD1-CE2 3.49Å; D107-Y186 PolarHBondContact OD1-OH 3.47Å; D107-Y186 PolarHBondContact OD2-OH 3.16Å; R182-Y186 HydrophobicContact CG-CD2 3.82Å; R182-Y186 HydrophobicContact CG-CE2 4Å; R182-Y186 WeakPolarHBondContact O-CB 3.2Å; R182-Y186 VanDerWaalsContact O-CD2 3.31Å; R182-Y186 WeakPolarHBondContact O-CD2 3.25Å; R182-Y186 PolarHBondContact O-N 3.28Å; Y186-Y189 HydrophobicContact CD1-CD1 4.01Å; Y186-Y189 HydrophobicContact CE1-CD1 4.43Å; Y186-L190 VanDerWaalsContact O-CB 3.29Å; Y186-L190 WeakPolarHBondContact O-CB 3.45Å; Y186-L190 WeakPolarHBondContact O-CG 3.43Å; Y186-L190 PolarHBondContact O-N 3.11Å; Y186-R219 VanDerWaalsContact CG-CZ 3.42Å; Y186-R219 VanDerWaalsContact CG-NH2 3.33Å
187K93Very high90.8Very high28 Ų2830.6 Ų30.612%0.12215%0.146CC..Hα-helixtrans-58.8-54.3172.4163173.5-176.9160.40111.4N183 T184 L185 Y189 L190 E191 K239 F241 P242 H243N183-K187 VanDerWaalsContact O-CB 3.32Å; N183-K187 WeakPolarHBondContact O-CB 3.21Å; N183-K187 PolarHBondContact O-N 3.3Å; T184-K187 WeakPolarHBondContact O-CB 3.43Å; T184-K187 PolarHBondContact O-N 3.25Å; L185-K187 VanDerWaalsContact C-N 3.28Å; L185-K187 PolarHBondContact O-N 3.14Å; K187-Y189 VanDerWaalsContact C-N 3.33Å; K187-Y189 PolarHBondContact O-N 3.25Å; K187-L190 PolarHBondContact O-N 2.7Å; K187-E191 WeakPolarHBondContact CE-OE1 3.34Å; K187-E191 WeakPolarHBondContact O-CB 3.2Å; K187-E191 WeakPolarHBondContact O-CG 3.45Å; K187-E191 PolarHBondContact O-N 3.28Å; K187-K239 VanDerWaalsContact CD-O 3.27Å; K187-K239 WeakPolarHBondContact CD-O 3.42Å; K187-K239 PolarHBondContact NZ-O 3.33Å; K187-F241 VanDerWaalsContact CD-O 3.28Å; K187-F241 WeakPolarHBondContact CD-O 3.21Å; K187-F241 WeakPolarHBondContact CE-O 3.46Å; K187-F241 PolarHBondContact NZ-O 2.88Å; K187-P242 HydrophobicContact CB-CB 4.49Å; K187-P242 HydrophobicContact CB-CG 4.3Å; K187-P242 HydrophobicContact CG-CB 4.47Å; K187-H243 PolarHBondContact NZ-CE1 3.4Å
188A92.1Very high91.5Very high23 Ų2332.8 Ų32.819%0.1916%0.16CC..Hα-helixtrans-62.7-40.5-179.300000112F163 T184 L185 S192F163-A188 HydrophobicContact CB-CB 3.66Å; F163-A188 HydrophobicContact CD1-CB 3.84Å; F163-A188 HydrophobicContact CG-CB 3.97Å; T184-A188 PolarHBondContact O-N 2.5Å; L185-A188 PolarHBondContact O-N 3.01Å; A188-S192 WeakPolarHBondContact O-CB 3.36Å; A188-S192 PolarHBondContact O-N 3.36Å
189Y94.3Very high92Very high6 Ų639.9 Ų39.92%0.02420%0.198CC..Hα-helixtrans-59.3-53.1173.6160.6-113.2000112.1F99 Y102 I106 L185 Y186 K187 E191 S192 F193F99-Y189 HydrophobicContact CD1-CD2 4.5Å; F99-Y189 HydrophobicContact CD1-CE2 4.3Å; F99-Y189 WeakPolarHBondContact O-CE2 3.19Å; F99-Y189 PolarHBondContact O-OH 3.09Å; Y102-Y189 HydrophobicContact CD2-CD2 4.46Å; I106-Y189 HydrophobicContact CD1-CD1 4.49Å; I106-Y189 HydrophobicContact CD1-CG 4.16Å; L185-Y189 VanDerWaalsContact O-CB 3.25Å; L185-Y189 WeakPolarHBondContact O-CB 3.46Å; L185-Y189 PolarHBondContact O-N 2.92Å; Y186-Y189 HydrophobicContact CD1-CD1 4.01Å; Y186-Y189 HydrophobicContact CE1-CD1 4.43Å; K187-Y189 VanDerWaalsContact C-N 3.33Å; K187-Y189 PolarHBondContact O-N 3.25Å; Y189-E191 PolarHBondContact O-N 2.7Å; Y189-S192 PolarHBondContact O-N 2.95Å; Y189-F193 HydrophobicContact CE2-CB 4.15Å; Y189-F193 HydrophobicContact CE2-CD1 4.1Å; Y189-F193 HydrophobicContact CE2-CG 4.37Å; Y189-F193 AromaticContact CZ-CD1 3.91Å; Y189-F193 WeakPolarHBondContact O-CB 3.31Å; Y189-F193 PolarHBondContact O-N 3.26Å; Y189-F193 WeakPolarHBondContact OH-CD1 3.45Å
190L94.8Very high92.3Very high1 Ų138.5 Ų38.51%0.00519%0.193CC..Hα-helixtrans-64.1-40.7-177.7-73.6172.7000111.7Y186 K187 Y194 L212 E215 A216 P242Y186-L190 VanDerWaalsContact O-CB 3.29Å; Y186-L190 WeakPolarHBondContact O-CB 3.45Å; Y186-L190 WeakPolarHBondContact O-CG 3.43Å; Y186-L190 PolarHBondContact O-N 3.11Å; K187-L190 PolarHBondContact O-N 2.7Å; L190-Y194 WeakPolarHBondContact O-CB 3.24Å; L190-Y194 PolarHBondContact O-N 3.15Å; L190-L212 HydrophobicContact CD2-CD2 4.26Å; L190-E215 HydrophobicContact CD1-CG 4.13Å; L190-E215 HydrophobicContact CD2-CB 4.18Å; L190-E215 HydrophobicContact CD2-CG 3.7Å; L190-A216 HydrophobicContact CD1-CB 4.41Å; L190-P242 HydrophobicContact CB-CB 4.4Å; L190-P242 HydrophobicContact CD1-CB 4.35Å; L190-P242 HydrophobicContact CD1-CG 3.91Å
191E94.4Very high92.5Very high36 Ų3638.6 Ų38.617%0.16820%0.199CC..Hα-helixtrans-67-39.9176.4-72-176.2-170.400112.2K187 Y189 K195 H243K187-E191 WeakPolarHBondContact CE-OE1 3.34Å; K187-E191 WeakPolarHBondContact O-CB 3.2Å; K187-E191 WeakPolarHBondContact O-CG 3.45Å; K187-E191 PolarHBondContact O-N 3.28Å; Y189-E191 PolarHBondContact O-N 2.7Å; E191-K195 WeakPolarHBondContact O-CB 3.47Å; E191-K195 WeakPolarHBondContact O-CD 3.32Å; E191-K195 WeakPolarHBondContact O-CG 3.37Å; E191-K195 PolarHBondContact O-N 2.88Å; E191-H243 IonicContact OE1-CE1 2.67Å; E191-H243 IonicContact OE1-CG 2.82Å; E191-H243 PolarHBondContact OE1-N 2.98Å; E191-H243 IonicContact OE1-ND1 3.63Å; E191-H243 PolarHBondContact OE1-ND1 3.4Å
192S94.1Very high92.7Very high38 Ų3840 Ų4027%0.26622%0.215SC..Hα-helixtrans-66.2-45.3175.9-172.30000111.4A188 Y189 Y194 K195 F196A188-S192 WeakPolarHBondContact O-CB 3.36Å; A188-S192 PolarHBondContact O-N 3.36Å; Y189-S192 PolarHBondContact O-N 2.95Å; S192-Y194 PolarHBondContact O-N 3.24Å; S192-K195 PolarHBondContact O-N 3.41Å; S192-F196 WeakPolarHBondContact O-CB 3.5Å; S192-F196 PolarHBondContact O-N 2.91Å
193F95Very high92.7Very high0 Ų038.2 Ų38.20%021%0.212CC..Hα-helixtrans-68.3-37-179.9-169.4-160.1000112F96 F99 I100 Y189 F196 C197 M208 L212 Y316F96-F193 AromaticContact CD2-CE2 3.73Å; F96-F193 HydrophobicContact CD2-CE2 3.73Å; F96-F193 HydrophobicContact CD2-CZ 4.12Å; F96-F193 AromaticContact CE2-CE2 3.67Å; F96-F193 HydrophobicContact CE2-CE2 3.67Å; F96-F193 AromaticContact CE2-CZ 3.69Å; F96-F193 HydrophobicContact CE2-CZ 3.69Å; F96-F193 HydrophobicContact CZ-CE2 4.42Å; F96-F193 HydrophobicContact CZ-CZ 4.01Å; F99-F193 HydrophobicContact CB-CD1 4.43Å; F99-F193 HydrophobicContact CB-CD2 3.56Å; F99-F193 HydrophobicContact CB-CE1 4.46Å; F99-F193 HydrophobicContact CB-CE2 3.61Å; F99-F193 HydrophobicContact CB-CG 4.01Å; F99-F193 HydrophobicContact CB-CZ 4.07Å; F99-F193 HydrophobicContact CD1-CB 3.87Å; F99-F193 AromaticContact CD1-CD2 3.97Å; F99-F193 HydrophobicContact CD1-CD2 3.97Å; F99-F193 HydrophobicContact CD1-CG 4.08Å; F99-F193 HydrophobicContact CD2-CD2 4.18Å; F99-F193 HydrophobicContact CE1-CB 4.35Å; F99-F193 HydrophobicContact CG-CB 4.44Å; F99-F193 AromaticContact CG-CD2 3.65Å; F99-F193 HydrophobicContact CG-CD2 3.65Å; F99-F193 HydrophobicContact CG-CE2 4.12Å; F99-F193 HydrophobicContact CG-CG 4.17Å; I100-F193 HydrophobicContact CG1-CZ 4.44Å; Y189-F193 HydrophobicContact CE2-CB 4.15Å; Y189-F193 HydrophobicContact CE2-CD1 4.1Å; Y189-F193 HydrophobicContact CE2-CG 4.37Å; Y189-F193 AromaticContact CZ-CD1 3.91Å; Y189-F193 WeakPolarHBondContact O-CB 3.31Å; Y189-F193 PolarHBondContact O-N 3.26Å; Y189-F193 WeakPolarHBondContact OH-CD1 3.45Å; F193-F196 HydrophobicContact CD2-CD1 4.21Å; F193-F196 HydrophobicContact CE2-CD1 4.29Å; F193-F196 PolarHBondContact O-N 3.41Å; F193-C197 VanDerWaalsContact CE2-SG 3.59Å; F193-C197 PolarHBondContact O-N 3.22Å; F193-C197 PolarHBondContact O-SG 3.42Å; F193-M208 HydrophobicContact CE1-CE 3.79Å; F193-M208 HydrophobicContact CZ-CE 3.62Å; F193-L212 HydrophobicContact CB-CD1 4.31Å; F193-L212 HydrophobicContact CD1-CD1 3.82Å; F193-L212 HydrophobicContact CD1-CD2 3.49Å; F193-L212 VanDerWaalsContact CD1-CD2 3.49Å; F193-L212 HydrophobicContact CD1-CG 4.31Å; F193-L212 HydrophobicContact CD2-CD1 4.44Å; F193-L212 HydrophobicContact CE1-CD1 4.26Å; F193-L212 HydrophobicContact CE1-CD2 3.79Å; F193-L212 HydrophobicContact CG-CD1 3.92Å; F193-L212 HydrophobicContact CG-CD2 4.36Å; F193-Y316 AromaticContact CE1-CD2 3.93Å; F193-Y316 HydrophobicContact CE1-CD2 3.93Å; F193-Y316 AromaticContact CE1-CE2 4Å; F193-Y316 HydrophobicContact CE1-CE2 4Å; F193-Y316 HydrophobicContact CZ-CD2 4.29Å
194Y95.6Very high92.8Very high57 Ų5737.7 Ų37.722%0.22421%0.209CC..Hα-helixtrans-60.9-50.7171.8-172-90.6000110.9L190 S192 F196 C197 T198 C209 L212 E213 C244L190-Y194 WeakPolarHBondContact O-CB 3.24Å; L190-Y194 PolarHBondContact O-N 3.15Å; S192-Y194 PolarHBondContact O-N 3.24Å; Y194-F196 VanDerWaalsContact C-N 3.29Å; Y194-F196 PolarHBondContact O-N 3.18Å; Y194-C197 PolarHBondContact O-N 2.98Å; Y194-C197 VanDerWaalsContact O-N 3.14Å; Y194-T198 PolarHBondContact O-N 3.29Å; Y194-T198 PolarHBondContact O-OG1 3.02Å; Y194-C209 HydrophobicContact CD2-CB 4.27Å; Y194-C209 HydrophobicContact CE2-CB 3.56Å; Y194-L212 HydrophobicContact CD2-CB 4.1Å; Y194-E213 HydrophobicContact CE2-CG 3.81Å; Y194-E213 WeakPolarHBondContact CE2-OE1 3.32Å; Y194-E213 PolarHBondContact OH-OE1 3.44Å; Y194-C244 HydrophobicContact CD1-CB 3.87Å; Y194-C244 HydrophobicContact CD2-CB 3.78Å; Y194-C244 HydrophobicContact CE1-CB 4.41Å; Y194-C244 HydrophobicContact CE2-CB 4.34Å; Y194-C244 HydrophobicContact CG-CB 3.51Å
195K95.1Very high93Very high138 Ų13837.2 Ų37.260%0.621%0.208SC*.Hα-helixtrans-57.3-41.4176.4-73.8167.7-171.6167.30112E191 S192 T198 L199E191-K195 WeakPolarHBondContact O-CB 3.47Å; E191-K195 WeakPolarHBondContact O-CD 3.32Å; E191-K195 WeakPolarHBondContact O-CG 3.37Å; E191-K195 PolarHBondContact O-N 2.88Å; S192-K195 PolarHBondContact O-N 3.41Å; K195-T198 PolarHBondContact O-N 3.45Å; K195-L199 WeakPolarHBondContact O-CB 3.49Å; K195-L199 PolarHBondContact O-N 3.35Å
196F94.6Very high93.1Very high37 Ų3742.8 Ų42.816%0.16224%0.237CC..Hα-helixtrans-61.5-48.8175.3178.3-100.9000111.5F96 F99 S192 F193 Y194 T198 L199 L200F96-F196 HydrophobicContact CB-CE1 3.84Å; F96-F196 HydrophobicContact CB-CZ 4.42Å; F96-F196 HydrophobicContact CD2-CD1 4.45Å; F96-F196 AromaticContact CD2-CE1 3.99Å; F96-F196 HydrophobicContact CD2-CE1 3.99Å; F96-F196 HydrophobicContact CG-CE1 4.42Å; F99-F196 HydrophobicContact CD2-CB 4.47Å; F99-F196 AromaticContact CD2-CD1 3.85Å; F99-F196 HydrophobicContact CD2-CD1 3.85Å; F99-F196 HydrophobicContact CD2-CD2 4.41Å; F99-F196 HydrophobicContact CD2-CE1 4.14Å; F99-F196 AromaticContact CD2-CG 3.99Å; F99-F196 HydrophobicContact CD2-CG 3.99Å; F99-F196 HydrophobicContact CE2-CB 3.89Å; F99-F196 AromaticContact CE2-CD1 3.92Å; F99-F196 HydrophobicContact CE2-CD1 3.92Å; F99-F196 AromaticContact CE2-CD2 3.71Å; F99-F196 HydrophobicContact CE2-CD2 3.71Å; F99-F196 HydrophobicContact CE2-CE1 4.38Å; F99-F196 HydrophobicContact CE2-CE2 4.2Å; F99-F196 AromaticContact CE2-CG 3.56Å; F99-F196 HydrophobicContact CE2-CG 3.56Å; F99-F196 HydrophobicContact CZ-CB 4.07Å; F99-F196 HydrophobicContact CZ-CD2 4.48Å; F99-F196 HydrophobicContact CZ-CG 4.24Å; S192-F196 WeakPolarHBondContact O-CB 3.5Å; S192-F196 PolarHBondContact O-N 2.91Å; F193-F196 HydrophobicContact CD2-CD1 4.21Å; F193-F196 HydrophobicContact CE2-CD1 4.29Å; F193-F196 PolarHBondContact O-N 3.41Å; Y194-F196 VanDerWaalsContact C-N 3.29Å; Y194-F196 PolarHBondContact O-N 3.18Å; F196-T198 PolarHBondContact O-N 3.4Å; F196-L199 PolarHBondContact O-N 3.23Å; F196-L200 HydrophobicContact CD1-CD1 4.01Å; F196-L200 HydrophobicContact CE1-CD1 3.48Å; F196-L200 VanDerWaalsContact CE1-CD1 3.48Å; F196-L200 HydrophobicContact CE1-CG 4.18Å; F196-L200 HydrophobicContact CZ-CD1 3.87Å; F196-L200 HydrophobicContact CZ-CD2 4.29Å; F196-L200 HydrophobicContact CZ-CG 4.24Å; F196-L200 WeakPolarHBondContact O-CG 3.25Å; F196-L200 PolarHBondContact O-N 3.15Å
197C94Very high93.2Very high0 Ų042.2 Ų42.20%024%0.238CC..Hα-helixtrans-61.8-42177-68.10000112.4F193 Y194 L199 L200 G201 A205 M208 L212F193-C197 VanDerWaalsContact CE2-SG 3.59Å; F193-C197 PolarHBondContact O-N 3.22Å; F193-C197 PolarHBondContact O-SG 3.42Å; Y194-C197 PolarHBondContact O-N 2.98Å; Y194-C197 VanDerWaalsContact O-N 3.14Å; C197-L199 VanDerWaalsContact C-N 3.33Å; C197-L199 PolarHBondContact O-N 2.99Å; C197-L200 PolarHBondContact O-N 3.16Å; C197-G201 PolarHBondContact O-N 3.5Å; C197-G201 VanDerWaalsContact O-N 3.13Å; C197-A205 WeakPolarHBondContact O-CB 3.36Å; C197-M208 HydrophobicContact CB-CB 4.2Å; C197-L212 HydrophobicContact CB-CD1 4.45Å
198T93.7Very high93.2Very high74 Ų7440.9 Ų40.945%0.45423%0.232SC..Hα-helixtrans-62.9-39.6175.5-51.60000111.7Y194 K195 F196 G201Y194-T198 PolarHBondContact O-N 3.29Å; Y194-T198 PolarHBondContact O-OG1 3.02Å; K195-T198 PolarHBondContact O-N 3.45Å; F196-T198 PolarHBondContact O-N 3.4Å; T198-G201 PolarHBondContact O-N 2.85Å
199L93.2Very high93.4Very high151 Ų15140.3 Ų40.379%0.79123%0.227SC*.Hα-helixtrans-67-38178.2-177.866.5000112.3K195 F196 C197 G201K195-L199 WeakPolarHBondContact O-CB 3.49Å; K195-L199 PolarHBondContact O-N 3.35Å; F196-L199 PolarHBondContact O-N 3.23Å; C197-L199 VanDerWaalsContact C-N 3.33Å; C197-L199 PolarHBondContact O-N 2.99Å; L199-G201 VanDerWaalsContact C-N 3.28Å
200L90.9Very high93.4Very high56 Ų5641.8 Ų41.829%0.29324%0.237SC..Hα-helixtrans-61.9-39.7172.8-68.7178.6000111.6P92 F96 F196 C197 T204 F312P92-L200 HydrophobicContact CB-CD2 3.65Å; P92-L200 HydrophobicContact CG-CD2 3.82Å; F96-L200 HydrophobicContact CD2-CD1 4.5Å; F196-L200 HydrophobicContact CD1-CD1 4.01Å; F196-L200 HydrophobicContact CE1-CD1 3.48Å; F196-L200 VanDerWaalsContact CE1-CD1 3.48Å; F196-L200 HydrophobicContact CE1-CG 4.18Å; F196-L200 HydrophobicContact CZ-CD1 3.87Å; F196-L200 HydrophobicContact CZ-CD2 4.29Å; F196-L200 HydrophobicContact CZ-CG 4.24Å; F196-L200 WeakPolarHBondContact O-CG 3.25Å; F196-L200 PolarHBondContact O-N 3.15Å; C197-L200 PolarHBondContact O-N 3.16Å; L200-T204 HydrophobicContact CD1-CG2 4.11Å; L200-F312 HydrophobicContact CD1-CD2 3.82Å; L200-F312 HydrophobicContact CD1-CE2 4.05Å
201G89.8Confident93.4Very high23 Ų2342.1 Ų42.124%0.23724%0.238CC..  trans66.5-166.5177.700000113.8C197 T198 L199 A205C197-G201 PolarHBondContact O-N 3.5Å; C197-G201 VanDerWaalsContact O-N 3.13Å; T198-G201 PolarHBondContact O-N 2.85Å; L199-G201 VanDerWaalsContact C-N 3.28Å; G201-A205 PolarHBondContact O-N 3.24Å
202G88.8Confident93.5Very high37 Ų3740.4 Ų40.438%0.38123%0.23SC..Hα-helixtrans58.8-154.6-179.800000113.5T204 A205 D206G202-T204 PolarHBondContact O-N 3.41Å; G202-T204 VanDerWaalsContact O-N 3.08Å; G202-A205 PolarHBondContact O-N 2.88Å; G202-D206 PolarHBondContact O-N 3.12Å; G202-D206 VanDerWaalsContact O-N 3.12Å
203T91.4Very high93.6Very high29 Ų2939.9 Ų39.918%0.17822%0.224CC..Hα-helixtrans-57.8-26.3-179.3-49.50000113.2A207 N308 H311T203-A207 WeakPolarHBondContact O-CB 3.36Å; T203-A207 PolarHBondContact O-N 3.48Å; T203-N308 HydrophobicContact CG2-CB 3.67Å; T203-H311 HydrophobicContact CG2-CB 3.81Å
204T92.2Very high93.6Very high11 Ų1140.1 Ų40.17%0.06723%0.225CC..Hα-helixtrans-65-47.4174.1-61.50000111.2F96 L200 G202 A207 M208 H311 F312F96-T204 HydrophobicContact CE2-CG2 4.49Å; L200-T204 HydrophobicContact CD1-CG2 4.11Å; G202-T204 PolarHBondContact O-N 3.41Å; G202-T204 VanDerWaalsContact O-N 3.08Å; T204-A207 PolarHBondContact O-N 3.47Å; T204-M208 HydrophobicContact CG2-CG 4.45Å; T204-M208 VanDerWaalsContact O-CB 3.25Å; T204-M208 WeakPolarHBondContact O-CB 3.44Å; T204-M208 PolarHBondContact O-N 2.93Å; T204-H311 WeakPolarHBondContact OG1-CA 3.45Å; T204-H311 WeakPolarHBondContact OG1-CB 3.49Å; T204-F312 HydrophobicContact CG2-CB 3.98Å; T204-F312 HydrophobicContact CG2-CD2 4.06Å; T204-F312 HydrophobicContact CG2-CG 4.38Å; T204-F312 PolarHBondContact OG1-N 3.37Å
205A92.8Very high93.6Very high13 Ų1338.4 Ų38.411%0.10722%0.219CC..Hα-helixtrans-63.7-44.7176.200000111.2C197 G201 G202 A207 M208 C209C197-A205 WeakPolarHBondContact O-CB 3.36Å; G201-A205 PolarHBondContact O-N 3.24Å; G202-A205 PolarHBondContact O-N 2.88Å; A205-A207 VanDerWaalsContact C-N 3.27Å; A205-A207 PolarHBondContact O-N 3.26Å; A205-M208 PolarHBondContact O-N 3.44Å; A205-C209 WeakPolarHBondContact O-CB 3.04Å; A205-C209 PolarHBondContact O-N 2.92Å; A205-C209 PolarHBondContact O-SG 2.94Å
206D93.1Very high93.6Very high117 Ų11731.8 Ų31.863%0.62619%0.19SC*.Hα-helixtrans-62.5-33.1-178.8-64.5-24000112.8G202 P210G202-D206 PolarHBondContact O-N 3.12Å; G202-D206 VanDerWaalsContact O-N 3.12Å; D206-P210 VanDerWaalsContact O-CD 3.22Å; D206-P210 WeakPolarHBondContact O-CD 3.34Å; D206-P210 VanDerWaalsContact O-CG 3.3Å; D206-P210 WeakPolarHBondContact O-CG 3.38Å
207A93.4Very high93.7Very high12 Ų1230 Ų3010%0.09918%0.182CC..Hα-helixtrans-84.1-42.9176.900000112.9T203 T204 A205 I211T203-A207 WeakPolarHBondContact O-CB 3.36Å; T203-A207 PolarHBondContact O-N 3.48Å; T204-A207 PolarHBondContact O-N 3.47Å; A205-A207 VanDerWaalsContact C-N 3.27Å; A205-A207 PolarHBondContact O-N 3.26Å; A207-I211 VanDerWaalsContact O-CD1 3.3Å; A207-I211 WeakPolarHBondContact O-CD1 3.29Å; A207-I211 WeakPolarHBondContact O-CG1 3.12Å
208M94.7Very high93.7Very high0 Ų031.7 Ų31.70%019%0.189CC..Hα-helixtrans-85.5-37.3-172.1-77-61.1-68.800114.3F96 F193 C197 T204 A205 I211 L212 G313 Y316F96-M208 HydrophobicContact CE2-CE 3.96Å; F96-M208 HydrophobicContact CE2-CG 3.91Å; F96-M208 HydrophobicContact CE2-SD 4.36Å; F96-M208 HydrophobicContact CZ-CE 3.68Å; F96-M208 HydrophobicContact CZ-CG 3.91Å; F96-M208 HydrophobicContact CZ-SD 3.87Å; F193-M208 HydrophobicContact CE1-CE 3.79Å; F193-M208 HydrophobicContact CZ-CE 3.62Å; C197-M208 HydrophobicContact CB-CB 4.2Å; T204-M208 HydrophobicContact CG2-CG 4.45Å; T204-M208 VanDerWaalsContact O-CB 3.25Å; T204-M208 WeakPolarHBondContact O-CB 3.44Å; T204-M208 PolarHBondContact O-N 2.93Å; A205-M208 PolarHBondContact O-N 3.44Å; M208-I211 PolarHBondContact O-N 3.41Å; M208-I211 VanDerWaalsContact O-N 3.1Å; M208-I211 HydrophobicContact SD-CD1 4.26Å; M208-L212 HydrophobicContact CE-CD1 4.46Å; M208-L212 HydrophobicContact CE-CD2 4.38Å; M208-L212 HydrophobicContact CE-CG 4.31Å; M208-L212 WeakPolarHBondContact O-CG 3.32Å; M208-L212 PolarHBondContact O-N 3.35Å; M208-G313 VanDerWaalsContact SD-CA 3.56Å; M208-Y316 HydrophobicContact CE-CD1 3.92Å; M208-Y316 HydrophobicContact CE-CD2 3.48Å; M208-Y316 VanDerWaalsContact CE-CD2 3.48Å; M208-Y316 HydrophobicContact CE-CE2 4.15Å; M208-Y316 HydrophobicContact CE-CG 3.35Å; M208-Y316 VanDerWaalsContact SD-CB 3.53Å; M208-Y316 HydrophobicContact SD-CD1 4.06Å; M208-Y316 HydrophobicContact SD-CG 3.79Å
209C95.1Very high93.7Very high11 Ų1129.4 Ų29.47%0.07417%0.172CC..Hα-helixtrans-59.4-44.6-177.6-62.60000111.7Y194 A205 I211 L212 E213Y194-C209 HydrophobicContact CD2-CB 4.27Å; Y194-C209 HydrophobicContact CE2-CB 3.56Å; A205-C209 WeakPolarHBondContact O-CB 3.04Å; A205-C209 PolarHBondContact O-N 2.92Å; A205-C209 PolarHBondContact O-SG 2.94Å; C209-I211 VanDerWaalsContact C-N 3.29Å; C209-I211 PolarHBondContact O-N 3.29Å; C209-L212 PolarHBondContact O-N 2.89Å; C209-E213 VanDerWaalsContact O-CB 3.29Å; C209-E213 WeakPolarHBondContact O-CB 3.46Å; C209-E213 VanDerWaalsContact O-CG 3.31Å; C209-E213 WeakPolarHBondContact O-CG 3.37Å; C209-E213 PolarHBondContact O-N 3.23Å
210P94.6Very high93.8Very high37 Ų3722.2 Ų22.224%0.2413%0.134CC..Hα-helixtrans-61.9-33.6174.9-25.236.4000114.1D206 F214D206-P210 VanDerWaalsContact O-CD 3.22Å; D206-P210 WeakPolarHBondContact O-CD 3.34Å; D206-P210 VanDerWaalsContact O-CG 3.3Å; D206-P210 WeakPolarHBondContact O-CG 3.38Å; P210-F214 WeakPolarHBondContact O-CB 3.29Å; P210-F214 PolarHBondContact O-N 2.96Å; P210-F214 VanDerWaalsContact O-N 3.09Å
211I95.4Very high94Very high7 Ų719.6 Ų19.64%0.03612%0.12CC..Hα-helixtrans-69.6-44.8177.5-64.4169.5000110.3A207 M208 C209 F214 E215 L301 A305 Y316A207-I211 VanDerWaalsContact O-CD1 3.3Å; A207-I211 WeakPolarHBondContact O-CD1 3.29Å; A207-I211 WeakPolarHBondContact O-CG1 3.12Å; M208-I211 PolarHBondContact O-N 3.41Å; M208-I211 VanDerWaalsContact O-N 3.1Å; M208-I211 HydrophobicContact SD-CD1 4.26Å; C209-I211 VanDerWaalsContact C-N 3.29Å; C209-I211 PolarHBondContact O-N 3.29Å; I211-F214 PolarHBondContact O-N 3.44Å; I211-E215 PolarHBondContact O-N 3.36Å; I211-L301 HydrophobicContact CG1-CB 4.08Å; I211-A305 HydrophobicContact CD1-CB 4.31Å; I211-Y316 HydrophobicContact CG2-CD1 3.98Å; I211-Y316 HydrophobicContact CG2-CE1 3.38Å
212L95.9Very high94.1Very high0 Ų021.3 Ų21.30%012%0.124CC..Hα-helixtrans-70.8-35178.5-64.8177.7000112.4L190 F193 Y194 C197 M208 C209 E215 A216L190-L212 HydrophobicContact CD2-CD2 4.26Å; F193-L212 HydrophobicContact CB-CD1 4.31Å; F193-L212 HydrophobicContact CD1-CD1 3.82Å; F193-L212 HydrophobicContact CD1-CD2 3.49Å; F193-L212 VanDerWaalsContact CD1-CD2 3.49Å; F193-L212 HydrophobicContact CD1-CG 4.31Å; F193-L212 HydrophobicContact CD2-CD1 4.44Å; F193-L212 HydrophobicContact CE1-CD1 4.26Å; F193-L212 HydrophobicContact CE1-CD2 3.79Å; F193-L212 HydrophobicContact CG-CD1 3.92Å; F193-L212 HydrophobicContact CG-CD2 4.36Å; Y194-L212 HydrophobicContact CD2-CB 4.1Å; C197-L212 HydrophobicContact CB-CD1 4.45Å; M208-L212 HydrophobicContact CE-CD1 4.46Å; M208-L212 HydrophobicContact CE-CD2 4.38Å; M208-L212 HydrophobicContact CE-CG 4.31Å; M208-L212 WeakPolarHBondContact O-CG 3.32Å; M208-L212 PolarHBondContact O-N 3.35Å; C209-L212 PolarHBondContact O-N 2.89Å; L212-E215 PolarHBondContact O-N 2.77Å; L212-A216 WeakPolarHBondContact O-CB 3.09Å; L212-A216 PolarHBondContact O-N 3.2Å
213E96.1Very high94.3Very high28 Ų2820.1 Ų20.113%0.13111%0.108CC..Hα-helixtrans-57.8-49.3170.9-86.4159.9-151.400111Y194 C209 E215 A216 D217 C244 R246Y194-E213 HydrophobicContact CE2-CG 3.81Å; Y194-E213 WeakPolarHBondContact CE2-OE1 3.32Å; Y194-E213 PolarHBondContact OH-OE1 3.44Å; C209-E213 VanDerWaalsContact O-CB 3.29Å; C209-E213 WeakPolarHBondContact O-CB 3.46Å; C209-E213 VanDerWaalsContact O-CG 3.31Å; C209-E213 WeakPolarHBondContact O-CG 3.37Å; C209-E213 PolarHBondContact O-N 3.23Å; E213-E215 VanDerWaalsContact C-N 3.33Å; E213-E215 PolarHBondContact O-N 3.11Å; E213-A216 PolarHBondContact O-N 2.86Å; E213-D217 WeakPolarHBondContact O-CB 3.33Å; E213-D217 PolarHBondContact O-N 3.32Å; E213-C244 WeakPolarHBondContact CG-O 3.5Å; E213-R246 HydrophobicContact CB-CG 4.38Å; E213-R246 HydrophobicContact CG-CG 4.43Å; E213-R246 IonicContact OE2-NE 3.86Å; E213-R246 PolarHBondContact OE2-NE 3.01Å; E213-R246 IonicContact OE2-NH2 2.75Å
214F95.6Very high94.3Very high5 Ų518.7 Ų18.72%0.02210%0.1CC..Hα-helixtrans-61.2-42.2176.7176-99.2000111.7P210 I211 A216 D217 R218 Y274 L277 F294 H297 E298 L301P210-F214 WeakPolarHBondContact O-CB 3.29Å; P210-F214 PolarHBondContact O-N 2.96Å; P210-F214 VanDerWaalsContact O-N 3.09Å; I211-F214 PolarHBondContact O-N 3.44Å; F214-A216 PolarHBondContact O-N 3.07Å; F214-D217 PolarHBondContact O-N 3.3Å; F214-R218 WeakPolarHBondContact O-CB 3.46Å; F214-R218 PolarHBondContact O-N 2.98Å; F214-Y274 AromaticContact CD2-CE1 3.88Å; F214-Y274 HydrophobicContact CD2-CE1 3.88Å; F214-Y274 HydrophobicContact CE2-CE1 4.1Å; F214-L277 HydrophobicContact CE2-CD1 3.98Å; F214-F294 HydrophobicContact CE2-CD1 4.07Å; F214-F294 HydrophobicContact CZ-CB 4.24Å; F214-F294 AromaticContact CZ-CD1 3.78Å; F214-F294 HydrophobicContact CZ-CD1 3.78Å; F214-F294 HydrophobicContact CZ-CG 4.44Å; F214-H297 AromaticContact CD2-CD2 3.46Å; F214-H297 VanDerWaalsContact CD2-CD2 3.46Å; F214-H297 WeakPolarHBondContact CD2-CD2 3.5Å; F214-H297 HydrophobicContact CE2-CB 4.05Å; F214-H297 AromaticContact CE2-CD2 3.25Å; F214-H297 WeakPolarHBondContact CE2-CD2 3.29Å; F214-H297 AromaticContact CE2-CG 3.82Å; F214-H297 HydrophobicContact CZ-CB 3.82Å; F214-H297 AromaticContact CZ-CD2 3.69Å; F214-E298 HydrophobicContact CE1-CB 3.99Å; F214-L301 HydrophobicContact CB-CD1 3.63Å; F214-L301 HydrophobicContact CD1-CD1 4.01Å; F214-L301 HydrophobicContact CD2-CD1 4.24Å; F214-L301 HydrophobicContact CG-CD1 3.68Å
215E94.9Very high94.3Very high20 Ų2020.2 Ų20.29%0.09311%0.107CC..Hα-helixtrans-62.3-42.9177.2-173.758.4-151.400112L190 I211 L212 E213 R218 R219L190-E215 HydrophobicContact CD1-CG 4.13Å; L190-E215 HydrophobicContact CD2-CB 4.18Å; L190-E215 HydrophobicContact CD2-CG 3.7Å; I211-E215 PolarHBondContact O-N 3.36Å; L212-E215 PolarHBondContact O-N 2.77Å; E213-E215 VanDerWaalsContact C-N 3.33Å; E213-E215 PolarHBondContact O-N 3.11Å; E215-R218 IonicContact OE1-CZ 3.09Å; E215-R218 IonicContact OE1-NE 3.99Å; E215-R218 IonicContact OE1-NH2 3.99Å; E215-R218 PolarHBondContact OE1-NH2 3.17Å; E215-R218 IonicContact OE2-CZ 3.46Å; E215-R218 IonicContact OE2-NE 3.65Å; E215-R218 PolarHBondContact OE2-NE 3.23Å; E215-R218 IonicContact OE2-NH1 3.36Å; E215-R218 IonicContact OE2-NH2 3.93Å; E215-R218 PolarHBondContact OE2-NH2 3.25Å; E215-R219 WeakPolarHBondContact O-CB 3.33Å; E215-R219 WeakPolarHBondContact O-CG 3.45Å; E215-R219 PolarHBondContact O-N 2.8Å
216A95.8Very high94.2Very high0 Ų024.8 Ų24.80%013%0.129CC..Hα-helixtrans-62.3-47.4175.800000112.2L190 L212 E213 F214 R219 A220 P242L190-A216 HydrophobicContact CD1-CB 4.41Å; L212-A216 WeakPolarHBondContact O-CB 3.09Å; L212-A216 PolarHBondContact O-N 3.2Å; E213-A216 PolarHBondContact O-N 2.86Å; F214-A216 PolarHBondContact O-N 3.07Å; A216-R219 PolarHBondContact O-N 3.18Å; A216-A220 PolarHBondContact O-N 3.01Å; A216-P242 HydrophobicContact CB-CB 3.79Å; A216-P242 HydrophobicContact CB-CG 4.1Å
217D95.4Very high94Very high0 Ų019.8 Ų19.80%010%0.104CC..Hα-helixtrans-67.1-42-179.9-70.6-24.3000111.5E213 F214 R219 A220 F221 G245 R246 L247 Y274E213-D217 WeakPolarHBondContact O-CB 3.33Å; E213-D217 PolarHBondContact O-N 3.32Å; F214-D217 PolarHBondContact O-N 3.3Å; D217-R219 VanDerWaalsContact C-N 3.33Å; D217-R219 PolarHBondContact O-N 2.54Å; D217-A220 WeakPolarHBondContact O-CB 3.16Å; D217-A220 PolarHBondContact O-N 2.89Å; D217-A220 VanDerWaalsContact O-N 3.16Å; D217-F221 WeakPolarHBondContact O-CD2 3.32Å; D217-F221 PolarHBondContact O-N 3Å; D217-G245 VanDerWaalsContact OD1-CA 3.25Å; D217-G245 WeakPolarHBondContact OD1-CA 3.18Å; D217-R246 PolarHBondContact OD1-N 2.75Å; D217-R246 WeakPolarHBondContact OD2-CA 3.39Å; D217-R246 WeakPolarHBondContact OD2-CB 3.43Å; D217-R246 PolarHBondContact OD2-N 3.2Å; D217-L247 HydrophobicContact CB-CD1 3.78Å; D217-L247 HydrophobicContact CB-CG 4Å; D217-L247 VanDerWaalsContact OD1-CB 3.28Å; D217-L247 WeakPolarHBondContact OD1-CB 3.34Å; D217-L247 VanDerWaalsContact OD1-CG 3.23Å; D217-L247 WeakPolarHBondContact OD1-CG 3.37Å; D217-L247 PolarHBondContact OD1-N 2.91Å; D217-L247 VanDerWaalsContact OD1-N 3.07Å; D217-L247 PolarHBondContact OD2-N 3.41Å; D217-Y274 HydrophobicContact CB-CE1 4.31Å; D217-Y274 HydrophobicContact CB-CE2 4.07Å; D217-Y274 WeakPolarHBondContact CB-OH 3.44Å; D217-Y274 VanDerWaalsContact CG-OH 3.27Å; D217-Y274 WeakPolarHBondContact OD2-CE2 3.45Å; D217-Y274 VanDerWaalsContact OD2-CZ 3.31Å; D217-Y274 PolarHBondContact OD2-OH 3.39Å
218R94.8Very high93.8Very high34 Ų3422.2 Ų22.213%0.12811%0.112CC..Hα-helixtrans-55-49.1172.5179.3179.479.1174.51.6110.8F214 E215 A220 F221 I222 F294 E298F214-R218 WeakPolarHBondContact O-CB 3.46Å; F214-R218 PolarHBondContact O-N 2.98Å; E215-R218 IonicContact OE1-CZ 3.09Å; E215-R218 IonicContact OE1-NE 3.99Å; E215-R218 IonicContact OE1-NH2 3.99Å; E215-R218 PolarHBondContact OE1-NH2 3.17Å; E215-R218 IonicContact OE2-CZ 3.46Å; E215-R218 IonicContact OE2-NE 3.65Å; E215-R218 PolarHBondContact OE2-NE 3.23Å; E215-R218 IonicContact OE2-NH1 3.36Å; E215-R218 IonicContact OE2-NH2 3.93Å; E215-R218 PolarHBondContact OE2-NH2 3.25Å; R218-A220 VanDerWaalsContact C-N 3.34Å; R218-A220 PolarHBondContact O-N 2.99Å; R218-F221 PolarHBondContact O-N 3.01Å; R218-I222 HydrophobicContact CG-CD1 3.75Å; R218-I222 HydrophobicContact CG-CG1 4.49Å; R218-I222 VanDerWaalsContact O-CG1 3.32Å; R218-I222 WeakPolarHBondContact O-CG1 3.35Å; R218-I222 PolarHBondContact O-N 3.05Å; R218-F294 HydrophobicContact CG-CB 4.27Å; R218-F294 HydrophobicContact CG-CD1 4.3Å; R218-F294 HydrophobicContact CG-CD2 3.92Å; R218-F294 HydrophobicContact CG-CE2 4.27Å; R218-F294 HydrophobicContact CG-CG 3.94Å; R218-E298 IonicContact CZ-OE2 2.63Å; R218-E298 IonicContact NH1-OE2 2.66Å; R218-E298 PolarHBondContact NH1-OE2 3.28Å; R218-E298 IonicContact NH2-OE2 2.56Å
219R94.2Very high93.2Very high27 Ų2726.5 Ų26.510%0.10216%0.157CC..Hα-helixtrans-62.5-40.5177.5-73.6-174.3108.7-77.5-9.6111.6N183 Y186 E215 A216 D217 F221 I222 I223N183-R219 PolarHBondContact OD1-NH1 3.3Å; N183-R219 PolarHBondContact OD1-NH2 3.46Å; N183-R219 VanDerWaalsContact OD1-NH2 3.09Å; Y186-R219 VanDerWaalsContact CG-CZ 3.42Å; Y186-R219 VanDerWaalsContact CG-NH2 3.33Å; E215-R219 WeakPolarHBondContact O-CB 3.33Å; E215-R219 WeakPolarHBondContact O-CG 3.45Å; E215-R219 PolarHBondContact O-N 2.8Å; A216-R219 PolarHBondContact O-N 3.18Å; D217-R219 VanDerWaalsContact C-N 3.33Å; D217-R219 PolarHBondContact O-N 2.54Å; R219-F221 PolarHBondContact O-N 3.04Å; R219-I222 PolarHBondContact O-N 3.42Å; R219-I223 WeakPolarHBondContact O-CB 3.48Å; R219-I223 WeakPolarHBondContact O-CD1 3.5Å; R219-I223 WeakPolarHBondContact O-CG1 3.38Å; R219-I223 PolarHBondContact O-N 2.86Å
220A95Very high92.8Very high0 Ų029.4 Ų29.40%017%0.174CC..Hα-helixtrans-61.3-42.8176.100000112.4A216 D217 R218 T224 F241 L247 L252 L255A216-A220 PolarHBondContact O-N 3.01Å; D217-A220 WeakPolarHBondContact O-CB 3.16Å; D217-A220 PolarHBondContact O-N 2.89Å; D217-A220 VanDerWaalsContact O-N 3.16Å; R218-A220 VanDerWaalsContact C-N 3.34Å; R218-A220 PolarHBondContact O-N 2.99Å; A220-T224 WeakPolarHBondContact O-CB 3.46Å; A220-T224 PolarHBondContact O-N 3.28Å; A220-T224 VanDerWaalsContact O-N 3.07Å; A220-T224 PolarHBondContact O-OG1 3.42Å; A220-F241 HydrophobicContact CB-CB 4.5Å; A220-F241 HydrophobicContact CB-CD1 3.87Å; A220-F241 HydrophobicContact CB-CE1 4.32Å; A220-F241 HydrophobicContact CB-CG 4.25Å; A220-L247 HydrophobicContact CB-CD1 4.34Å; A220-L252 HydrophobicContact CB-CD2 3.54Å; A220-L255 HydrophobicContact CB-CD1 4.07Å
221F94.2Very high92.1Very high0 Ų036.3 Ų36.30%020%0.203CC..Hα-helixtrans-61.3-49.7173.6-75.9-58.9000112D217 R218 R219 T224 I225 L247 L255 V264 A268 Y274 F278 F294D217-F221 WeakPolarHBondContact O-CD2 3.32Å; D217-F221 PolarHBondContact O-N 3Å; R218-F221 PolarHBondContact O-N 3.01Å; R219-F221 PolarHBondContact O-N 3.04Å; F221-T224 PolarHBondContact O-N 3.31Å; F221-I225 WeakPolarHBondContact O-CG1 3.45Å; F221-I225 PolarHBondContact O-N 3.09Å; F221-L247 HydrophobicContact CD2-CD1 4.19Å; F221-L247 HydrophobicContact CE1-CD1 4.35Å; F221-L247 HydrophobicContact CE2-CD1 3.73Å; F221-L247 HydrophobicContact CE2-CD2 4.45Å; F221-L247 HydrophobicContact CZ-CD1 3.81Å; F221-L247 HydrophobicContact CZ-CD2 4.04Å; F221-L255 HydrophobicContact CD1-CD1 4.02Å; F221-L255 HydrophobicContact CD1-CD2 3.98Å; F221-L255 HydrophobicContact CE1-CD1 4.15Å; F221-L255 HydrophobicContact CE1-CD2 3.99Å; F221-V264 HydrophobicContact CD1-CG1 3.63Å; F221-V264 HydrophobicContact CE1-CG1 4.1Å; F221-A268 HydrophobicContact CE1-CB 4.07Å; F221-A268 HydrophobicContact CZ-CB 3.93Å; F221-Y274 HydrophobicContact CE2-CD1 4.04Å; F221-Y274 AromaticContact CE2-CD2 3.93Å; F221-Y274 HydrophobicContact CE2-CD2 3.93Å; F221-Y274 HydrophobicContact CE2-CE1 4.47Å; F221-Y274 HydrophobicContact CE2-CE2 4.37Å; F221-Y274 AromaticContact CE2-CG 3.79Å; F221-Y274 HydrophobicContact CE2-CG 3.79Å; F221-Y274 HydrophobicContact CZ-CD2 4.18Å; F221-Y274 HydrophobicContact CZ-CG 4.18Å; F221-F278 HydrophobicContact CD1-CE2 4.03Å; F221-F278 AromaticContact CD1-CZ 3.76Å; F221-F278 HydrophobicContact CD1-CZ 3.76Å; F221-F278 HydrophobicContact CD2-CE2 4.32Å; F221-F278 AromaticContact CE1-CE2 3.95Å; F221-F278 HydrophobicContact CE1-CE2 3.95Å; F221-F278 AromaticContact CE1-CZ 3.99Å; F221-F278 HydrophobicContact CE1-CZ 3.99Å; F221-F278 HydrophobicContact CE2-CE2 4.25Å; F221-F278 HydrophobicContact CG-CE2 4.23Å; F221-F278 HydrophobicContact CG-CZ 4.13Å; F221-F278 HydrophobicContact CZ-CE2 4.06Å; F221-F294 HydrophobicContact CB-CZ 4.19Å; F221-F294 HydrophobicContact CD2-CE1 4.45Å; F221-F294 HydrophobicContact CD2-CZ 4.02Å; F221-F294 HydrophobicContact CG-CZ 4.35Å
222I92.6Very high91.6Very high60 Ų6037.8 Ų37.831%0.30821%0.211SC..Hα-helixtrans-63.2-45.3-178.3-67.6170.1000111.3R218 R219 T224 I225 N226R218-I222 HydrophobicContact CG-CD1 3.75Å; R218-I222 HydrophobicContact CG-CG1 4.49Å; R218-I222 VanDerWaalsContact O-CG1 3.32Å; R218-I222 WeakPolarHBondContact O-CG1 3.35Å; R218-I222 PolarHBondContact O-N 3.05Å; R219-I222 PolarHBondContact O-N 3.42Å; I222-T224 VanDerWaalsContact C-N 3.26Å; I222-T224 PolarHBondContact O-N 2.96Å; I222-I225 PolarHBondContact O-N 2.81Å; I222-N226 WeakPolarHBondContact CG2-ND2 3.41Å; I222-N226 VanDerWaalsContact O-CB 3.32Å; I222-N226 WeakPolarHBondContact O-CB 3.47Å; I222-N226 VanDerWaalsContact O-CG 3.32Å; I222-N226 PolarHBondContact O-N 2.89Å
223I92.1Very high91.1Very high11 Ų1139.9 Ų39.96%0.05623%0.226CC..Hα-helixtrans-58.1-43175.9-69.2163.8000110.1N183 R219 S227 R237 L240 F241N183-I223 HydrophobicContact CB-CD1 4.01Å; N183-I223 WeakPolarHBondContact OD1-CD1 3.4Å; N183-I223 WeakPolarHBondContact OD1-CG1 2.84Å; R219-I223 WeakPolarHBondContact O-CB 3.48Å; R219-I223 WeakPolarHBondContact O-CD1 3.5Å; R219-I223 WeakPolarHBondContact O-CG1 3.38Å; R219-I223 PolarHBondContact O-N 2.86Å; I223-S227 VanDerWaalsContact O-CB 3.22Å; I223-S227 WeakPolarHBondContact O-CB 3.02Å; I223-S227 PolarHBondContact O-N 3.13Å; I223-S227 PolarHBondContact O-OG 2.82Å; I223-R237 HydrophobicContact CG2-CG 4.41Å; I223-L240 HydrophobicContact CD1-CB 4.21Å; I223-L240 HydrophobicContact CG2-CB 4.32Å; I223-L240 HydrophobicContact CG2-CD1 4.21Å; I223-F241 HydrophobicContact CB-CD1 4.5Å; I223-F241 HydrophobicContact CB-CE1 4.08Å; I223-F241 HydrophobicContact CD1-CD1 4.43Å; I223-F241 HydrophobicContact CG2-CD1 4.36Å; I223-F241 HydrophobicContact CG2-CE1 3.83Å
224T92.8Very high90.8Very high0 Ų042.8 Ų42.80%024%0.238CC..Hα-helixtrans-65.1-46.4180-540000111.4A220 F221 I222 S227 F228 F241 L255 A258 V264A220-T224 WeakPolarHBondContact O-CB 3.46Å; A220-T224 PolarHBondContact O-N 3.28Å; A220-T224 VanDerWaalsContact O-N 3.07Å; A220-T224 PolarHBondContact O-OG1 3.42Å; F221-T224 PolarHBondContact O-N 3.31Å; I222-T224 VanDerWaalsContact C-N 3.26Å; I222-T224 PolarHBondContact O-N 2.96Å; T224-S227 PolarHBondContact O-N 2.85Å; T224-S227 PolarHBondContact O-OG 2.93Å; T224-F228 HydrophobicContact CG2-CE1 4.45Å; T224-F228 HydrophobicContact CG2-CZ 4.07Å; T224-F241 VanDerWaalsContact OG1-CZ 3.28Å; T224-F241 WeakPolarHBondContact OG1-CZ 3.41Å; T224-L255 HydrophobicContact CG2-CB 4.41Å; T224-L255 HydrophobicContact CG2-CD2 4.27Å; T224-A258 HydrophobicContact CG2-CB 4.15Å; T224-V264 HydrophobicContact CG2-CG2 3.61Å
225I91.7Very high90.4Very high43 Ų4349.7 Ų49.722%0.22127%0.27CS..Hα-helixtrans-63.9-44.5179.2-66.5164.4000111F221 I222 S227 F228 Y261 V264 L290F221-I225 WeakPolarHBondContact O-CG1 3.45Å; F221-I225 PolarHBondContact O-N 3.09Å; I222-I225 PolarHBondContact O-N 2.81Å; I225-S227 VanDerWaalsContact C-N 3.29Å; I225-S227 PolarHBondContact O-N 3.09Å; I225-F228 WeakPolarHBondContact O-CD2 3.31Å; I225-F228 PolarHBondContact O-N 3.21Å; I225-Y261 HydrophobicContact CD1-CD2 4.26Å; I225-Y261 HydrophobicContact CD1-CE2 3.9Å; I225-Y261 HydrophobicContact CG1-CD2 4.15Å; I225-Y261 HydrophobicContact CG1-CE2 4.31Å; I225-V264 HydrophobicContact CD1-CG1 4.45Å; I225-V264 HydrophobicContact CG1-CG1 4.27Å; I225-L290 HydrophobicContact CD1-CD2 3.78Å
226N89.9Confident90.1Very high109 Ų10951.8 Ų51.858%0.58328%0.282SS*.Hα-helixtrans-74.7-19-179.6-67.9-9.2000113I222 F228 T230I222-N226 WeakPolarHBondContact CG2-ND2 3.41Å; I222-N226 VanDerWaalsContact O-CB 3.32Å; I222-N226 WeakPolarHBondContact O-CB 3.47Å; I222-N226 VanDerWaalsContact O-CG 3.32Å; I222-N226 PolarHBondContact O-N 2.89Å; N226-F228 VanDerWaalsContact C-N 3.25Å; N226-F228 PolarHBondContact O-N 3.48Å; N226-T230 WeakPolarHBondContact O-CG2 3.29Å
227S89.6Confident89.8Confident12 Ų1252.2 Ų52.28%0.08428%0.284CS..Hα-helixtrans-71.2-20174.6720000113.2I223 T224 I225 G229 T230 R237I223-S227 VanDerWaalsContact O-CB 3.22Å; I223-S227 WeakPolarHBondContact O-CB 3.02Å; I223-S227 PolarHBondContact O-N 3.13Å; I223-S227 PolarHBondContact O-OG 2.82Å; T224-S227 PolarHBondContact O-N 2.85Å; T224-S227 PolarHBondContact O-OG 2.93Å; I225-S227 VanDerWaalsContact C-N 3.29Å; I225-S227 PolarHBondContact O-N 3.09Å; S227-G229 PolarHBondContact O-N 3.46Å; S227-T230 PolarHBondContact O-N 2.85Å; S227-T230 VanDerWaalsContact O-N 3.1Å; S227-T230 PolarHBondContact O-OG1 3.46Å; S227-R237 VanDerWaalsContact OG-CD 3.31Å; S227-R237 WeakPolarHBondContact OG-CD 3.48Å; S227-R237 PolarHBondContact OG-NH1 2.89Å
228F88.8Confident89.5Confident62 Ų6254 Ų5427%0.27230%0.299SS..THydrogen-bonded Turntrans-65.3123.9-179.4-60.9-41000111.3T224 I225 N226 T230 D259 D260 V264T224-F228 HydrophobicContact CG2-CE1 4.45Å; T224-F228 HydrophobicContact CG2-CZ 4.07Å; I225-F228 WeakPolarHBondContact O-CD2 3.31Å; I225-F228 PolarHBondContact O-N 3.21Å; N226-F228 VanDerWaalsContact C-N 3.25Å; N226-F228 PolarHBondContact O-N 3.48Å; F228-T230 VanDerWaalsContact C-N 3.33Å; F228-D259 VanDerWaalsContact CE1-C 3.43Å; F228-D260 VanDerWaalsContact CZ-O 3.29Å; F228-D260 WeakPolarHBondContact CZ-O 3.12Å; F228-V264 HydrophobicContact CE2-CG2 3.98Å; F228-V264 HydrophobicContact CZ-CG2 3.65Å
229G82.9Confident89.3Confident91 Ų9158.4 Ų58.494%0.93832%0.318SS*.THydrogen-bonded Turntrans84.23.7-177.300000114.7S227S227-G229 PolarHBondContact O-N 3.46Å
230T85.8Confident89.1Confident71 Ų7157.4 Ų57.444%0.43632%0.315SS..SBendtrans-96.1166.1171.271.40000111.5N226 S227 F228 L232N226-T230 WeakPolarHBondContact O-CG2 3.29Å; S227-T230 PolarHBondContact O-N 2.85Å; S227-T230 VanDerWaalsContact O-N 3.1Å; S227-T230 PolarHBondContact O-OG1 3.46Å; F228-T230 VanDerWaalsContact C-N 3.33Å; T230-L232 PolarHBondContact O-N 3.14Å; T230-L232 WeakPolarHBondContact OG1-CB 3.25Å
231E81.5Confident89Confident182 Ų18257.5 Ų57.585%0.8532%0.316SS*.SBendtrans-78.84.2177.5-60.2-172.4170.200113.4S233E231-S233 PolarHBondContact O-N 2.92Å
232L84Confident89Confident38 Ų3857.5 Ų57.520%0.19932%0.316CS..  trans-68.1121.8-176.3-170.169.1000111.4I180 T230 D236 R237 L240I180-L232 HydrophobicContact CD1-CD1 4.05Å; I180-L232 HydrophobicContact CG1-CD1 4.42Å; T230-L232 PolarHBondContact O-N 3.14Å; T230-L232 WeakPolarHBondContact OG1-CB 3.25Å; L232-D236 HydrophobicContact CD1-CB 3.66Å; L232-D236 HydrophobicContact CG-CB 4.36Å; L232-R237 HydrophobicContact CD2-CB 3.93Å; L232-R237 HydrophobicContact CG-CB 4.35Å; L232-L240 HydrophobicContact CD2-CD1 3.87Å
233S86.4Confident89Confident45 Ų4558.2 Ų58.232%0.31532%0.317SS..  trans-67.1154.8177.584.80000111.6E231 E235 D236 R237E231-S233 PolarHBondContact O-N 2.92Å; S233-E235 PolarHBondContact O-N 3.31Å; S233-E235 PolarHBondContact OG-N 3.24Å; S233-D236 PolarHBondContact O-N 3.44Å; S233-D236 PolarHBondContact OG-N 3.27Å; S233-D236 PolarHBondContact OG-OD2 3.33Å; S233-R237 WeakPolarHBondContact O-CB 3.46Å; S233-R237 PolarHBondContact O-N 2.86Å
234K88.7Confident89.1Confident89 Ų8958.2 Ų58.239%0.38732%0.318SS..Hα-helixtrans-57.8-33.5174.9-67.9-171.9179.4-163.20112.3A238 A256 R257 D259K234-A238 PolarHBondContact O-N 2.93Å; K234-A256 WeakPolarHBondContact CB-O 3.46Å; K234-R257 PolarHBondContact NZ-O 3.1Å; K234-D259 WeakPolarHBondContact CE-OD1 3.34Å; K234-D259 IonicContact NZ-OD1 2.79Å; K234-D259 PolarHBondContact NZ-OD1 2.85Å; K234-D259 IonicContact NZ-OD2 3.14Å; K234-D259 PolarHBondContact NZ-OD2 3.3Å
235E88Confident89Confident149 Ų14958.7 Ų58.770%0.69632%0.323SS*.Hα-helixtrans-72.5-43.4178.7-65.1-175.9-178.500111.9S233 A238 K239S233-E235 PolarHBondContact O-N 3.31Å; S233-E235 PolarHBondContact OG-N 3.24Å; E235-A238 WeakPolarHBondContact O-CB 3.47Å; E235-A238 PolarHBondContact O-N 3.03Å; E235-K239 PolarHBondContact O-N 3.38Å
236D87Confident89.1Confident64 Ų6461.4 Ų61.434%0.34233%0.33SS..Hα-helixtrans-69.5-37.9178.7-61.7-43.5000111.1L232 S233 A238 K239 L240L232-D236 HydrophobicContact CD1-CB 3.66Å; L232-D236 HydrophobicContact CG-CB 4.36Å; S233-D236 PolarHBondContact O-N 3.44Å; S233-D236 PolarHBondContact OG-N 3.27Å; S233-D236 PolarHBondContact OG-OD2 3.33Å; D236-A238 VanDerWaalsContact C-N 3.29Å; D236-A238 PolarHBondContact O-N 2.89Å; D236-K239 WeakPolarHBondContact O-CB 3.34Å; D236-K239 PolarHBondContact O-N 3.31Å; D236-K239 VanDerWaalsContact O-N 3.08Å; D236-K239 IonicContact OD1-NZ 3.08Å; D236-K239 PolarHBondContact OD1-NZ 2.91Å; D236-L240 PolarHBondContact O-N 2.56Å
237R89.7Confident89.1Confident10 Ų1056.2 Ų56.24%0.03830%0.303CS..Hα-helixtrans-54.3-45.1169.9178.4171.564.3178.72112.2I223 S227 L232 S233 K239 L240 F241 L255 A256 A258I223-R237 HydrophobicContact CG2-CG 4.41Å; S227-R237 VanDerWaalsContact OG-CD 3.31Å; S227-R237 WeakPolarHBondContact OG-CD 3.48Å; S227-R237 PolarHBondContact OG-NH1 2.89Å; L232-R237 HydrophobicContact CD2-CB 3.93Å; L232-R237 HydrophobicContact CG-CB 4.35Å; S233-R237 WeakPolarHBondContact O-CB 3.46Å; S233-R237 PolarHBondContact O-N 2.86Å; R237-K239 VanDerWaalsContact C-N 3.26Å; R237-K239 PolarHBondContact O-N 3.31Å; R237-L240 PolarHBondContact O-N 3.24Å; R237-L240 VanDerWaalsContact O-N 3.1Å; R237-F241 HydrophobicContact CG-CE1 3.9Å; R237-F241 HydrophobicContact CG-CE2 4.23Å; R237-F241 HydrophobicContact CG-CZ 3.47Å; R237-F241 VanDerWaalsContact CG-CZ 3.47Å; R237-L255 VanDerWaalsContact CZ-O 3.24Å; R237-L255 PolarHBondContact NH2-O 3.06Å; R237-A256 PolarHBondContact NH2-O 3.14Å; R237-A258 PolarHBondContact NH1-O 3.43Å; R237-A258 PolarHBondContact NH2-O 3.47Å
238A90.6Very high89.2Confident38 Ų3861.7 Ų61.731%0.31432%0.322SS..Hα-helixtrans-62-34.1178.600000112.7K234 E235 D236 L240 F241 A256K234-A238 PolarHBondContact O-N 2.93Å; E235-A238 WeakPolarHBondContact O-CB 3.47Å; E235-A238 PolarHBondContact O-N 3.03Å; D236-A238 VanDerWaalsContact C-N 3.29Å; D236-A238 PolarHBondContact O-N 2.89Å; A238-L240 PolarHBondContact O-N 3.21Å; A238-F241 PolarHBondContact O-N 3.09Å; A238-A256 HydrophobicContact CB-CB 3.79Å
239K89.5Confident89.4Confident125 Ų12562.5 Ų62.554%0.54333%0.334SS..Hα-helixtrans-67.5-21.5177.2-64171.1-165.8157.90112.7K187 E235 D236 R237K187-K239 VanDerWaalsContact CD-O 3.27Å; K187-K239 WeakPolarHBondContact CD-O 3.42Å; K187-K239 PolarHBondContact NZ-O 3.33Å; E235-K239 PolarHBondContact O-N 3.38Å; D236-K239 WeakPolarHBondContact O-CB 3.34Å; D236-K239 PolarHBondContact O-N 3.31Å; D236-K239 VanDerWaalsContact O-N 3.08Å; D236-K239 IonicContact OD1-NZ 3.08Å; D236-K239 PolarHBondContact OD1-NZ 2.91Å; R237-K239 VanDerWaalsContact C-N 3.26Å; R237-K239 PolarHBondContact O-N 3.31Å
240L90.7Very high89.9Confident7 Ų764.9 Ų64.94%0.03732%0.321CS..Hα-helixtrans-84.3-14.7-179.1-60173.5000113.9I180 N183 T184 I223 L232 D236 R237 A238I180-L240 HydrophobicContact CG2-CD2 3.83Å; N183-L240 HydrophobicContact CB-CB 4.21Å; N183-L240 HydrophobicContact CB-CD1 4.4Å; N183-L240 HydrophobicContact CB-CD2 4Å; N183-L240 HydrophobicContact CB-CG 4.42Å; T184-L240 WeakPolarHBondContact OG1-CD2 3.42Å; I223-L240 HydrophobicContact CD1-CB 4.21Å; I223-L240 HydrophobicContact CG2-CB 4.32Å; I223-L240 HydrophobicContact CG2-CD1 4.21Å; L232-L240 HydrophobicContact CD2-CD1 3.87Å; D236-L240 PolarHBondContact O-N 2.56Å; R237-L240 PolarHBondContact O-N 3.24Å; R237-L240 VanDerWaalsContact O-N 3.1Å; A238-L240 PolarHBondContact O-N 3.21Å
241F92.7Very high90.2Very high2 Ų261.5 Ų61.51%0.00930%0.3CS..SBendtrans-76.6132.1-176.9-57.3-33.6000112.1K187 A220 I223 T224 R237 A238 L252 L255 A256K187-F241 VanDerWaalsContact CD-O 3.28Å; K187-F241 WeakPolarHBondContact CD-O 3.21Å; K187-F241 WeakPolarHBondContact CE-O 3.46Å; K187-F241 PolarHBondContact NZ-O 2.88Å; A220-F241 HydrophobicContact CB-CB 4.5Å; A220-F241 HydrophobicContact CB-CD1 3.87Å; A220-F241 HydrophobicContact CB-CE1 4.32Å; A220-F241 HydrophobicContact CB-CG 4.25Å; I223-F241 HydrophobicContact CB-CD1 4.5Å; I223-F241 HydrophobicContact CB-CE1 4.08Å; I223-F241 HydrophobicContact CD1-CD1 4.43Å; I223-F241 HydrophobicContact CG2-CD1 4.36Å; I223-F241 HydrophobicContact CG2-CE1 3.83Å; T224-F241 VanDerWaalsContact OG1-CZ 3.28Å; T224-F241 WeakPolarHBondContact OG1-CZ 3.41Å; R237-F241 HydrophobicContact CG-CE1 3.9Å; R237-F241 HydrophobicContact CG-CE2 4.23Å; R237-F241 HydrophobicContact CG-CZ 3.47Å; R237-F241 VanDerWaalsContact CG-CZ 3.47Å; A238-F241 PolarHBondContact O-N 3.09Å; F241-L252 HydrophobicContact CB-CD1 3.89Å; F241-L252 HydrophobicContact CB-CD2 4.02Å; F241-L252 HydrophobicContact CB-CG 4.46Å; F241-L252 HydrophobicContact CD2-CB 4.16Å; F241-L252 HydrophobicContact CD2-CD2 4.1Å; F241-L252 HydrophobicContact CG-CD2 4.13Å; F241-L255 HydrophobicContact CE2-CB 4.13Å; F241-L255 HydrophobicContact CZ-CB 4.15Å; F241-A256 HydrophobicContact CE2-CB 3.95Å
242P93.7Very high90.8Very high0 Ų053.3 Ų53.30%026%0.262CS..  trans-70.7137.8169.7-924.3000111.1K187 L190 A216 L252K187-P242 HydrophobicContact CB-CB 4.49Å; K187-P242 HydrophobicContact CB-CG 4.3Å; K187-P242 HydrophobicContact CG-CB 4.47Å; L190-P242 HydrophobicContact CB-CB 4.4Å; L190-P242 HydrophobicContact CD1-CB 4.35Å; L190-P242 HydrophobicContact CD1-CG 3.91Å; A216-P242 HydrophobicContact CB-CB 3.79Å; A216-P242 HydrophobicContact CB-CG 4.1Å; P242-L252 WeakPolarHBondContact O-CD1 3.29Å
243H93.5Very high91.2Very high74 Ų7453.5 Ų53.534%0.34327%0.269SS..THydrogen-bonded Turntrans-94.510-175.6-51.8106.7000114.8K187 E191 Y248K187-H243 PolarHBondContact NZ-CE1 3.4Å; E191-H243 IonicContact OE1-CE1 2.67Å; E191-H243 IonicContact OE1-CG 2.82Å; E191-H243 PolarHBondContact OE1-N 2.98Å; E191-H243 IonicContact OE1-ND1 3.63Å; E191-H243 PolarHBondContact OE1-ND1 3.4Å; H243-Y248 HydrophobicContact CB-CD1 4.43Å; H243-Y248 HydrophobicContact CB-CD2 3.86Å; H243-Y248 HydrophobicContact CB-CE2 4.03Å; H243-Y248 HydrophobicContact CB-CG 4.06Å; H243-Y248 AromaticContact CD2-CD2 3.52Å; H243-Y248 AromaticContact CD2-CE2 3.42Å; H243-Y248 VanDerWaalsContact CD2-CE2 3.42Å; H243-Y248 WeakPolarHBondContact CD2-CE2 3.43Å
244C92.9Very high91.5Very high12 Ų1254.8 Ų54.88%0.08127%0.27CS..THydrogen-bonded Turntrans-92.9-2.1-179.8540000114.3Y194 E213Y194-C244 HydrophobicContact CD1-CB 3.87Å; Y194-C244 HydrophobicContact CD2-CB 3.78Å; Y194-C244 HydrophobicContact CE1-CB 4.41Å; Y194-C244 HydrophobicContact CE2-CB 4.34Å; Y194-C244 HydrophobicContact CG-CB 3.51Å; E213-C244 WeakPolarHBondContact CG-O 3.5Å
245G92.3Very high91.7Very high9 Ų950.6 Ų50.69%0.09325%0.252CS..SBendtrans-87.1173.6179.400000114.6D217 L247 Y248D217-G245 VanDerWaalsContact OD1-CA 3.25Å; D217-G245 WeakPolarHBondContact OD1-CA 3.18Å; G245-L247 VanDerWaalsContact C-N 3.28Å; G245-L247 PolarHBondContact O-N 3.41Å; G245-Y248 PolarHBondContact O-N 3.37Å
246R92.2Very high92Very high100 Ų10044 Ų4438%0.37722%0.223SC..THydrogen-bonded Turntrans-75.5-18.8-180-61.7-179.7177.1-172.9-0.1112.7E213 D217 Y248 Y271 E273E213-R246 HydrophobicContact CB-CG 4.38Å; E213-R246 HydrophobicContact CG-CG 4.43Å; E213-R246 IonicContact OE2-NE 3.86Å; E213-R246 PolarHBondContact OE2-NE 3.01Å; E213-R246 IonicContact OE2-NH2 2.75Å; D217-R246 PolarHBondContact OD1-N 2.75Å; D217-R246 WeakPolarHBondContact OD2-CA 3.39Å; D217-R246 WeakPolarHBondContact OD2-CB 3.43Å; D217-R246 PolarHBondContact OD2-N 3.2Å; R246-Y248 PolarHBondContact O-N 3.35Å; R246-Y271 VanDerWaalsContact O-CE1 3.32Å; R246-Y271 WeakPolarHBondContact O-CE1 3.32Å; R246-E273 IonicContact CZ-OE1 3.57Å; R246-E273 IonicContact CZ-OE2 3.51Å; R246-E273 IonicContact NH1-OE1 3.71Å; R246-E273 PolarHBondContact NH1-OE1 3.46Å; R246-E273 IonicContact NH1-OE2 3.07Å; R246-E273 PolarHBondContact NH1-OE2 3.16Å
247L91.8Very high92.2Very high0 Ų049.4 Ų49.40%024%0.238CC..THydrogen-bonded Turntrans-70.6-19.6173.8-62.8175.8000112D217 A220 F221 G245 P249 E250 G251 L252 L255 V267 Y271 Y274D217-L247 HydrophobicContact CB-CD1 3.78Å; D217-L247 HydrophobicContact CB-CG 4Å; D217-L247 VanDerWaalsContact OD1-CB 3.28Å; D217-L247 WeakPolarHBondContact OD1-CB 3.34Å; D217-L247 VanDerWaalsContact OD1-CG 3.23Å; D217-L247 WeakPolarHBondContact OD1-CG 3.37Å; D217-L247 PolarHBondContact OD1-N 2.91Å; D217-L247 VanDerWaalsContact OD1-N 3.07Å; D217-L247 PolarHBondContact OD2-N 3.41Å; A220-L247 HydrophobicContact CB-CD1 4.34Å; F221-L247 HydrophobicContact CD2-CD1 4.19Å; F221-L247 HydrophobicContact CE1-CD1 4.35Å; F221-L247 HydrophobicContact CE2-CD1 3.73Å; F221-L247 HydrophobicContact CE2-CD2 4.45Å; F221-L247 HydrophobicContact CZ-CD1 3.81Å; F221-L247 HydrophobicContact CZ-CD2 4.04Å; G245-L247 VanDerWaalsContact C-N 3.28Å; G245-L247 PolarHBondContact O-N 3.41Å; L247-P249 CarbonylContact O-C 3.59Å; L247-E250 PolarHBondContact O-N 3.09Å; L247-G251 CarbonylContact O-C 3.59Å; L247-G251 WeakPolarHBondContact O-CA 3.32Å; L247-G251 PolarHBondContact O-N 3.44Å; L247-L252 HydrophobicContact CB-CD2 3.71Å; L247-L252 HydrophobicContact CB-CG 3.92Å; L247-L252 HydrophobicContact CD1-CD2 4.2Å; L247-L252 PolarHBondContact O-N 3.34Å; L247-L255 HydrophobicContact CD1-CD1 3.71Å; L247-V267 HydrophobicContact CD2-CG1 4.39Å; L247-Y271 HydrophobicContact CD2-CD2 3.67Å; L247-Y271 HydrophobicContact CD2-CE1 4.31Å; L247-Y271 HydrophobicContact CD2-CE2 3.43Å; L247-Y271 VanDerWaalsContact CD2-CE2 3.43Å; L247-Y271 HydrophobicContact CD2-CG 4.23Å; L247-Y274 HydrophobicContact CD2-CD2 4.13Å; L247-Y274 HydrophobicContact CD2-CE2 4.13Å; L247-Y274 HydrophobicContact CG-CE2 4.26Å
248Y91.4Very high92.4Very high128 Ų12849 Ų4950%0.50224%0.237SC..THydrogen-bonded Turntrans-77.5134.1178.2-178.6-103.1000111.1H243 G245 R246 L252H243-Y248 HydrophobicContact CB-CD1 4.43Å; H243-Y248 HydrophobicContact CB-CD2 3.86Å; H243-Y248 HydrophobicContact CB-CE2 4.03Å; H243-Y248 HydrophobicContact CB-CG 4.06Å; H243-Y248 AromaticContact CD2-CD2 3.52Å; H243-Y248 AromaticContact CD2-CE2 3.42Å; H243-Y248 VanDerWaalsContact CD2-CE2 3.42Å; H243-Y248 WeakPolarHBondContact CD2-CE2 3.43Å; G245-Y248 PolarHBondContact O-N 3.37Å; R246-Y248 PolarHBondContact O-N 3.35Å; Y248-L252 HydrophobicContact CD2-CD1 4.02Å; Y248-L252 HydrophobicContact CG-CD1 4.46Å
249P92.6Very high92.4Very high79 Ų7951.9 Ų51.951%0.51325%0.247SC..THydrogen-bonded Turncis-93.5-27.1-0.933.8-33000115L247 A253L247-P249 CarbonylContact O-C 3.59Å; P249-A253 PolarHBondContact O-N 3.46Å
250E92.5Very high92.5Very high141 Ų14149 Ų4966%0.65924%0.238SC*.Hα-helixtrans-74.1-43.8-166.3-64.5-173.5176.400113.7L247 L252 A253 Q254L247-E250 PolarHBondContact O-N 3.09Å; E250-L252 PolarHBondContact O-N 2.92Å; E250-A253 PolarHBondContact O-N 3.37Å; E250-Q254 WeakPolarHBondContact O-CG 3.5Å; E250-Q254 PolarHBondContact O-N 2.94Å
251G92.1Very high92.5Very high0 Ų053 Ų530%025%0.253CS..Hα-helixtrans-61.6-42.6177.300000112.1L247 A253 Q254 L255 Y271L247-G251 CarbonylContact O-C 3.59Å; L247-G251 WeakPolarHBondContact O-CA 3.32Å; L247-G251 PolarHBondContact O-N 3.44Å; G251-A253 PolarHBondContact O-N 3.3Å; G251-Q254 PolarHBondContact O-N 2.77Å; G251-L255 WeakPolarHBondContact O-CG 3.36Å; G251-L255 PolarHBondContact O-N 3.48Å; G251-Y271 PolarHBondContact N-OH 3.46Å
252L93.8Very high92.4Very high9 Ų958.3 Ų58.35%0.04728%0.278CS..Hα-helixtrans-64.7-38.7175.8-65.7-171.6000112.3A220 F241 P242 L247 Y248 E250 Q254 L255 A256A220-L252 HydrophobicContact CB-CD2 3.54Å; F241-L252 HydrophobicContact CB-CD1 3.89Å; F241-L252 HydrophobicContact CB-CD2 4.02Å; F241-L252 HydrophobicContact CB-CG 4.46Å; F241-L252 HydrophobicContact CD2-CB 4.16Å; F241-L252 HydrophobicContact CD2-CD2 4.1Å; F241-L252 HydrophobicContact CG-CD2 4.13Å; P242-L252 WeakPolarHBondContact O-CD1 3.29Å; L247-L252 HydrophobicContact CB-CD2 3.71Å; L247-L252 HydrophobicContact CB-CG 3.92Å; L247-L252 HydrophobicContact CD1-CD2 4.2Å; L247-L252 PolarHBondContact O-N 3.34Å; Y248-L252 HydrophobicContact CD2-CD1 4.02Å; Y248-L252 HydrophobicContact CG-CD1 4.46Å; E250-L252 PolarHBondContact O-N 2.92Å; L252-Q254 VanDerWaalsContact C-N 3.28Å; L252-Q254 PolarHBondContact O-N 3.43Å; L252-L255 HydrophobicContact CD2-CD1 4.35Å; L252-L255 PolarHBondContact O-N 3.47Å; L252-A256 VanDerWaalsContact O-CB 3.28Å; L252-A256 WeakPolarHBondContact O-CB 3.43Å; L252-A256 PolarHBondContact O-N 3.06Å
253A93.4Very high92.4Very high42 Ų4261.4 Ų61.435%0.34729%0.292SS..Hα-helixtrans-64.8-33.5175.500000112.4P249 E250 G251 R257P249-A253 PolarHBondContact O-N 3.46Å; E250-A253 PolarHBondContact O-N 3.37Å; G251-A253 PolarHBondContact O-N 3.3Å; A253-R257 WeakPolarHBondContact O-CG 3.39Å
254Q92.8Very high92.3Very high73 Ų7357.9 Ų57.934%0.34128%0.276SS..Hα-helixtrans-73.9-44.6174.2-66.4179.844.600111.7E250 G251 L252 A256 R257 A258 V267E250-Q254 WeakPolarHBondContact O-CG 3.5Å; E250-Q254 PolarHBondContact O-N 2.94Å; G251-Q254 PolarHBondContact O-N 2.77Å; L252-Q254 VanDerWaalsContact C-N 3.28Å; L252-Q254 PolarHBondContact O-N 3.43Å; Q254-A256 VanDerWaalsContact C-N 3.29Å; Q254-A256 PolarHBondContact O-N 3.02Å; Q254-R257 CarbonylContact O-C 3.46Å; Q254-R257 WeakPolarHBondContact O-CA 3.19Å; Q254-R257 PolarHBondContact O-N 3.35Å; Q254-A258 PolarHBondContact O-N 3.03Å; Q254-V267 HydrophobicContact CB-CG1 4.44Å; Q254-V267 HydrophobicContact CB-CG2 3.49Å; Q254-V267 VanDerWaalsContact CB-CG2 3.49Å
255L93.5Very high92.2Very high0 Ų060.2 Ų60.20%029%0.285CS..Hα-helixtrans-58.6-41174-74-176.9000111.9A220 F221 T224 R237 F241 L247 G251 L252 R257 A258 V264 V267A220-L255 HydrophobicContact CB-CD1 4.07Å; F221-L255 HydrophobicContact CD1-CD1 4.02Å; F221-L255 HydrophobicContact CD1-CD2 3.98Å; F221-L255 HydrophobicContact CE1-CD1 4.15Å; F221-L255 HydrophobicContact CE1-CD2 3.99Å; T224-L255 HydrophobicContact CG2-CB 4.41Å; T224-L255 HydrophobicContact CG2-CD2 4.27Å; R237-L255 VanDerWaalsContact CZ-O 3.24Å; R237-L255 PolarHBondContact NH2-O 3.06Å; F241-L255 HydrophobicContact CE2-CB 4.13Å; F241-L255 HydrophobicContact CZ-CB 4.15Å; L247-L255 HydrophobicContact CD1-CD1 3.71Å; G251-L255 WeakPolarHBondContact O-CG 3.36Å; G251-L255 PolarHBondContact O-N 3.48Å; L252-L255 HydrophobicContact CD2-CD1 4.35Å; L252-L255 PolarHBondContact O-N 3.47Å; L255-R257 PolarHBondContact O-N 3.49Å; L255-R257 VanDerWaalsContact O-N 3.12Å; L255-A258 WeakPolarHBondContact O-CB 3.44Å; L255-A258 PolarHBondContact O-N 2.89Å; L255-A258 VanDerWaalsContact O-N 3.14Å; L255-V264 HydrophobicContact CD2-CB 4.33Å; L255-V264 HydrophobicContact CD2-CG1 3.9Å; L255-V264 HydrophobicContact CD2-CG2 4.19Å; L255-V267 HydrophobicContact CD2-CB 4.03Å; L255-V267 HydrophobicContact CD2-CG1 4.17Å; L255-V267 HydrophobicContact CD2-CG2 4.11Å; L255-V267 HydrophobicContact CG-CB 4.46Å; L255-V267 HydrophobicContact CG-CG1 4.09Å; L255-V267 HydrophobicContact CG-CG2 4.49Å
256A93.2Very high92.2Very high11 Ų1163.7 Ų63.79%0.09130%0.301CS..THydrogen-bonded Turntrans-60.9-21174.900000113.2K234 R237 A238 F241 L252 Q254K234-A256 WeakPolarHBondContact CB-O 3.46Å; R237-A256 PolarHBondContact NH2-O 3.14Å; A238-A256 HydrophobicContact CB-CB 3.79Å; F241-A256 HydrophobicContact CE2-CB 3.95Å; L252-A256 VanDerWaalsContact O-CB 3.28Å; L252-A256 WeakPolarHBondContact O-CB 3.43Å; L252-A256 PolarHBondContact O-N 3.06Å; Q254-A256 VanDerWaalsContact C-N 3.29Å; Q254-A256 PolarHBondContact O-N 3.02Å
257R92.2Very high92.2Very high177 Ų17759.1 Ų59.167%0.66828%0.284SS*.THydrogen-bonded Turntrans-99.8-15.7177.7-68.3174.8-172.9161.64.6113.8K234 A253 Q254 L255K234-R257 PolarHBondContact NZ-O 3.1Å; A253-R257 WeakPolarHBondContact O-CG 3.39Å; Q254-R257 CarbonylContact O-C 3.46Å; Q254-R257 WeakPolarHBondContact O-CA 3.19Å; Q254-R257 PolarHBondContact O-N 3.35Å; L255-R257 PolarHBondContact O-N 3.49Å; L255-R257 VanDerWaalsContact O-N 3.12Å
258A92.6Very high92.2Very high2 Ų259.1 Ų59.12%0.01728%0.284CS..  trans-59133.2-175.300000112.1T224 R237 Q254 L255 Q263 V264T224-A258 HydrophobicContact CG2-CB 4.15Å; R237-A258 PolarHBondContact NH1-O 3.43Å; R237-A258 PolarHBondContact NH2-O 3.47Å; Q254-A258 PolarHBondContact O-N 3.03Å; L255-A258 WeakPolarHBondContact O-CB 3.44Å; L255-A258 PolarHBondContact O-N 2.89Å; L255-A258 VanDerWaalsContact O-N 3.14Å; A258-Q263 VanDerWaalsContact CA-OE1 3.29Å; A258-Q263 HydrophobicContact CB-CB 3.93Å; A258-V264 HydrophobicContact CB-CG2 4.01Å
259D90.5Very high92.2Very high98 Ų9855.7 Ų55.752%0.52428%0.275SS..  trans-105.7-15.2179.6-70-53.2000113.4F228 K234F228-D259 VanDerWaalsContact CE1-C 3.43Å; K234-D259 WeakPolarHBondContact CE-OD1 3.34Å; K234-D259 IonicContact NZ-OD1 2.79Å; K234-D259 PolarHBondContact NZ-OD1 2.85Å; K234-D259 IonicContact NZ-OD2 3.14Å; K234-D259 PolarHBondContact NZ-OD2 3.3Å
260D91.9Very high92.1Very high65 Ų6559.8 Ų59.835%0.34828%0.281SS..SBendtrans-150.5170.6-176.461.254.8000112F228 E262 Q263 V264F228-D260 VanDerWaalsContact CZ-O 3.29Å; F228-D260 WeakPolarHBondContact CZ-O 3.12Å; D260-E262 VanDerWaalsContact C-N 3.32Å; D260-E262 PolarHBondContact O-N 3.2Å; D260-E262 WeakPolarHBondContact OD1-CA 3.45Å; D260-E262 WeakPolarHBondContact OD1-CB 3.38Å; D260-E262 PolarHBondContact OD1-N 2.64Å; D260-Q263 PolarHBondContact O-N 2.89Å; D260-Q263 WeakPolarHBondContact OD1-CG 3.44Å; D260-Q263 PolarHBondContact OD1-N 2.7Å; D260-Q263 PolarHBondContact OD2-NE2 2.95Å; D260-V264 PolarHBondContact O-N 2.93Å
261Y90.9Very high92Very high90 Ų9055.5 Ų55.535%0.35326%0.26SS..Hα-helixtrans-64.4-32.5-179.4-173.8-94.8000113.3I225 V264 K265 F278 L290I225-Y261 HydrophobicContact CD1-CD2 4.26Å; I225-Y261 HydrophobicContact CD1-CE2 3.9Å; I225-Y261 HydrophobicContact CG1-CD2 4.15Å; I225-Y261 HydrophobicContact CG1-CE2 4.31Å; Y261-V264 WeakPolarHBondContact O-CB 3.5Å; Y261-V264 PolarHBondContact O-N 3.32Å; Y261-K265 PolarHBondContact O-N 3.43Å; Y261-F278 HydrophobicContact CE2-CE1 4.34Å; Y261-L290 HydrophobicContact CE2-CD2 4.47Å
262E91.1Very high91.9Very high114 Ų11460.4 Ų60.453%0.53329%0.291SS..Hα-helixtrans-67.3-38.5178.8-71.2-65.4158.200111D260 V264 K265 N266D260-E262 VanDerWaalsContact C-N 3.32Å; D260-E262 PolarHBondContact O-N 3.2Å; D260-E262 WeakPolarHBondContact OD1-CA 3.45Å; D260-E262 WeakPolarHBondContact OD1-CB 3.38Å; D260-E262 PolarHBondContact OD1-N 2.64Å; E262-V264 VanDerWaalsContact C-N 3.33Å; E262-V264 PolarHBondContact O-N 3.07Å; E262-K265 WeakPolarHBondContact O-CB 3.36Å; E262-K265 PolarHBondContact O-N 3.29Å; E262-N266 PolarHBondContact O-N 3.31Å; E262-N266 PolarHBondContact O-ND2 2.9Å
263Q92.7Very high91.6Very high65 Ų6563.7 Ų63.730%0.30431%0.306SS..Hα-helixtrans-64.2-38.7173.6-68.9174.735.600111.7A258 D260 K265 N266 V267A258-Q263 VanDerWaalsContact CA-OE1 3.29Å; A258-Q263 HydrophobicContact CB-CB 3.93Å; D260-Q263 PolarHBondContact O-N 2.89Å; D260-Q263 WeakPolarHBondContact OD1-CG 3.44Å; D260-Q263 PolarHBondContact OD1-N 2.7Å; D260-Q263 PolarHBondContact OD2-NE2 2.95Å; Q263-K265 VanDerWaalsContact C-N 3.35Å; Q263-N266 PolarHBondContact O-N 2.94Å; Q263-V267 WeakPolarHBondContact O-CG2 3.46Å; Q263-V267 PolarHBondContact O-N 3.45Å; Q263-V267 VanDerWaalsContact O-N 3.1Å
264V92.3Very high91.5Very high0 Ų061.8 Ų61.80%029%0.29CS..Hα-helixtrans-62.4-43.7173.9177.50000111F221 T224 I225 F228 L255 A258 D260 Y261 E262 V267 A268 F278F221-V264 HydrophobicContact CD1-CG1 3.63Å; F221-V264 HydrophobicContact CE1-CG1 4.1Å; T224-V264 HydrophobicContact CG2-CG2 3.61Å; I225-V264 HydrophobicContact CD1-CG1 4.45Å; I225-V264 HydrophobicContact CG1-CG1 4.27Å; F228-V264 HydrophobicContact CE2-CG2 3.98Å; F228-V264 HydrophobicContact CZ-CG2 3.65Å; L255-V264 HydrophobicContact CD2-CB 4.33Å; L255-V264 HydrophobicContact CD2-CG1 3.9Å; L255-V264 HydrophobicContact CD2-CG2 4.19Å; A258-V264 HydrophobicContact CB-CG2 4.01Å; D260-V264 PolarHBondContact O-N 2.93Å; Y261-V264 WeakPolarHBondContact O-CB 3.5Å; Y261-V264 PolarHBondContact O-N 3.32Å; E262-V264 VanDerWaalsContact C-N 3.33Å; E262-V264 PolarHBondContact O-N 3.07Å; V264-V267 WeakPolarHBondContact O-CB 3.44Å; V264-V267 PolarHBondContact O-N 3.36Å; V264-A268 PolarHBondContact O-N 3.45Å; V264-A268 VanDerWaalsContact O-N 3.08Å; V264-F278 HydrophobicContact CG1-CE1 4.09Å; V264-F278 HydrophobicContact CG1-CZ 3.97Å
265K91.2Very high91.3Very high62 Ų6262 Ų6227%0.2729%0.29SS..Hα-helixtrans-62.1-41.9175.6-175.1178.7177.5-1770112.1Y261 E262 Q263 V267 A268 D269 F278Y261-K265 PolarHBondContact O-N 3.43Å; E262-K265 WeakPolarHBondContact O-CB 3.36Å; E262-K265 PolarHBondContact O-N 3.29Å; Q263-K265 VanDerWaalsContact C-N 3.35Å; K265-V267 VanDerWaalsContact C-N 3.26Å; K265-V267 PolarHBondContact O-N 2.88Å; K265-A268 CarbonylContact O-C 3.52Å; K265-A268 WeakPolarHBondContact O-CA 3.29Å; K265-A268 WeakPolarHBondContact O-CB 3.05Å; K265-A268 PolarHBondContact O-N 3.3Å; K265-D269 PolarHBondContact O-N 3.41Å; K265-F278 HydrophobicContact CB-CD1 4.18Å; K265-F278 HydrophobicContact CG-CB 4.28Å; K265-F278 HydrophobicContact CG-CD1 4.22Å
266N92Very high91.1Very high81 Ų8167.7 Ų67.743%0.43332%0.32SS..Hα-helixtrans-59.8-36.8175-68.2-32.4000111.9E262 Q263 D269 Y270E262-N266 PolarHBondContact O-N 3.31Å; E262-N266 PolarHBondContact O-ND2 2.9Å; Q263-N266 PolarHBondContact O-N 2.94Å; N266-D269 PolarHBondContact O-N 3.42Å; N266-Y270 WeakPolarHBondContact O-CD2 3.46Å; N266-Y270 WeakPolarHBondContact O-CE2 3.34Å
267V92.5Very high90.9Very high4 Ų467.9 Ų67.92%0.02432%0.319CS..Hα-helixtrans-64.2-45.4173-179.60000110.6L247 Q254 L255 Q263 V264 K265 D269 Y270 Y271L247-V267 HydrophobicContact CD2-CG1 4.39Å; Q254-V267 HydrophobicContact CB-CG1 4.44Å; Q254-V267 HydrophobicContact CB-CG2 3.49Å; Q254-V267 VanDerWaalsContact CB-CG2 3.49Å; L255-V267 HydrophobicContact CD2-CB 4.03Å; L255-V267 HydrophobicContact CD2-CG1 4.17Å; L255-V267 HydrophobicContact CD2-CG2 4.11Å; L255-V267 HydrophobicContact CG-CB 4.46Å; L255-V267 HydrophobicContact CG-CG1 4.09Å; L255-V267 HydrophobicContact CG-CG2 4.49Å; Q263-V267 WeakPolarHBondContact O-CG2 3.46Å; Q263-V267 PolarHBondContact O-N 3.45Å; Q263-V267 VanDerWaalsContact O-N 3.1Å; V264-V267 WeakPolarHBondContact O-CB 3.44Å; V264-V267 PolarHBondContact O-N 3.36Å; K265-V267 VanDerWaalsContact C-N 3.26Å; K265-V267 PolarHBondContact O-N 2.88Å; V267-D269 VanDerWaalsContact C-N 3.27Å; V267-D269 PolarHBondContact O-N 3.15Å; V267-Y270 PolarHBondContact O-N 3.12Å; V267-Y271 HydrophobicContact CG1-CE2 4.48Å; V267-Y271 WeakPolarHBondContact O-CD2 3.46Å
268A91.6Very high90.7Very high0 Ų059.7 Ų59.70%029%0.288CS..Hα-helixtrans-61.6-33.5177.900000113F221 V264 K265 Y270 Y271 K275 F278F221-A268 HydrophobicContact CE1-CB 4.07Å; F221-A268 HydrophobicContact CZ-CB 3.93Å; V264-A268 PolarHBondContact O-N 3.45Å; V264-A268 VanDerWaalsContact O-N 3.08Å; K265-A268 CarbonylContact O-C 3.52Å; K265-A268 WeakPolarHBondContact O-CA 3.29Å; K265-A268 WeakPolarHBondContact O-CB 3.05Å; K265-A268 PolarHBondContact O-N 3.3Å; A268-Y270 PolarHBondContact O-N 3.39Å; A268-Y271 CarbonylContact O-C 3.57Å; A268-Y271 PolarHBondContact O-N 2.94Å; A268-K275 PolarHBondContact O-N 3.37Å; A268-F278 HydrophobicContact CB-CB 4.46Å; A268-F278 HydrophobicContact CB-CD2 3.35Å; A268-F278 HydrophobicContact CB-CE2 3.55Å; A268-F278 HydrophobicContact CB-CG 3.87Å; A268-F278 HydrophobicContact CB-CZ 4.23Å
269D90.9Very high90.4Very high57 Ų5764.7 Ų64.731%0.30531%0.312SS..Hα-helixtrans-62.6-25.3180-79.8-14.6000113.9K265 N266 V267 Y271K265-D269 PolarHBondContact O-N 3.41Å; N266-D269 PolarHBondContact O-N 3.42Å; V267-D269 VanDerWaalsContact C-N 3.27Å; V267-D269 PolarHBondContact O-N 3.15Å; D269-Y271 PolarHBondContact O-N 3.44Å
270Y90.5Very high89.8Confident164 Ų16461 Ų6164%0.64330%0.296SS*.THydrogen-bonded Turntrans-70.5-17.6173.9-67.4-69.2000113.2N266 V267 A268N266-Y270 WeakPolarHBondContact O-CD2 3.46Å; N266-Y270 WeakPolarHBondContact O-CE2 3.34Å; V267-Y270 PolarHBondContact O-N 3.12Å; A268-Y270 PolarHBondContact O-N 3.39Å
271Y91.3Very high89.2Confident52 Ų5258.8 Ų58.820%0.20429%0.287CS..SBendtrans-115.5109.1-176.4-62.6-91.4000109.3R246 L247 G251 V267 A268 D269 E273 Y274 K275R246-Y271 VanDerWaalsContact O-CE1 3.32Å; R246-Y271 WeakPolarHBondContact O-CE1 3.32Å; L247-Y271 HydrophobicContact CD2-CD2 3.67Å; L247-Y271 HydrophobicContact CD2-CE1 4.31Å; L247-Y271 HydrophobicContact CD2-CE2 3.43Å; L247-Y271 VanDerWaalsContact CD2-CE2 3.43Å; L247-Y271 HydrophobicContact CD2-CG 4.23Å; G251-Y271 PolarHBondContact N-OH 3.46Å; V267-Y271 HydrophobicContact CG1-CE2 4.48Å; V267-Y271 WeakPolarHBondContact O-CD2 3.46Å; A268-Y271 CarbonylContact O-C 3.57Å; A268-Y271 PolarHBondContact O-N 2.94Å; D269-Y271 PolarHBondContact O-N 3.44Å; Y271-E273 PolarHBondContact O-N 3.38Å; Y271-Y274 HydrophobicContact CD2-CD2 4.46Å; Y271-Y274 AromaticContact CG-CD2 3.96Å; Y271-Y274 HydrophobicContact CG-CD2 3.96Å; Y271-Y274 HydrophobicContact CG-CE2 4.47Å; Y271-Y274 PolarHBondContact O-N 3.38Å; Y271-K275 WeakPolarHBondContact O-CB 3.43Å; Y271-K275 PolarHBondContact O-N 3.29Å
272P89.4Confident88.3Confident102 Ų10255.9 Ų55.966%0.66229%0.285SS*.Hα-helixtrans-54.6-34.5-171.4-2934.8000114.9L276P272-L276 WeakPolarHBondContact O-CG 3.29Å; P272-L276 PolarHBondContact O-N 2.85Å
273E87.4Confident87.1Confident78 Ų7856.4 Ų56.436%0.36430%0.301SS..Hα-helixtrans-68.4-45.1178.4-67.6176-176.400111.9R246 Y271 L277R246-E273 IonicContact CZ-OE1 3.57Å; R246-E273 IonicContact CZ-OE2 3.51Å; R246-E273 IonicContact NH1-OE1 3.71Å; R246-E273 PolarHBondContact NH1-OE1 3.46Å; R246-E273 IonicContact NH1-OE2 3.07Å; R246-E273 PolarHBondContact NH1-OE2 3.16Å; Y271-E273 PolarHBondContact O-N 3.38Å; E273-L277 WeakPolarHBondContact O-CG 3.38Å
274Y90.9Very high85.7Confident3 Ų358.6 Ų58.61%0.01232%0.315CS..Hα-helixtrans-74.5-36.5179.9-58.5-46.2000112.1F214 D217 F221 L247 Y271 L276 L277 F278F214-Y274 AromaticContact CD2-CE1 3.88Å; F214-Y274 HydrophobicContact CD2-CE1 3.88Å; F214-Y274 HydrophobicContact CE2-CE1 4.1Å; D217-Y274 HydrophobicContact CB-CE1 4.31Å; D217-Y274 HydrophobicContact CB-CE2 4.07Å; D217-Y274 WeakPolarHBondContact CB-OH 3.44Å; D217-Y274 VanDerWaalsContact CG-OH 3.27Å; D217-Y274 WeakPolarHBondContact OD2-CE2 3.45Å; D217-Y274 VanDerWaalsContact OD2-CZ 3.31Å; D217-Y274 PolarHBondContact OD2-OH 3.39Å; F221-Y274 HydrophobicContact CE2-CD1 4.04Å; F221-Y274 AromaticContact CE2-CD2 3.93Å; F221-Y274 HydrophobicContact CE2-CD2 3.93Å; F221-Y274 HydrophobicContact CE2-CE1 4.47Å; F221-Y274 HydrophobicContact CE2-CE2 4.37Å; F221-Y274 AromaticContact CE2-CG 3.79Å; F221-Y274 HydrophobicContact CE2-CG 3.79Å; F221-Y274 HydrophobicContact CZ-CD2 4.18Å; F221-Y274 HydrophobicContact CZ-CG 4.18Å; L247-Y274 HydrophobicContact CD2-CD2 4.13Å; L247-Y274 HydrophobicContact CD2-CE2 4.13Å; L247-Y274 HydrophobicContact CG-CE2 4.26Å; Y271-Y274 HydrophobicContact CD2-CD2 4.46Å; Y271-Y274 AromaticContact CG-CD2 3.96Å; Y271-Y274 HydrophobicContact CG-CD2 3.96Å; Y271-Y274 HydrophobicContact CG-CE2 4.47Å; Y271-Y274 PolarHBondContact O-N 3.38Å; Y274-L276 VanDerWaalsContact C-N 3.29Å; Y274-L276 PolarHBondContact O-N 2.96Å; Y274-L277 HydrophobicContact CD1-CD1 4.22Å; Y274-L277 WeakPolarHBondContact O-CB 3.49Å; Y274-L277 PolarHBondContact O-N 2.75Å; Y274-F278 WeakPolarHBondContact O-CD2 3.26Å; Y274-F278 PolarHBondContact O-N 3.2Å
275K89.5Confident84Confident77 Ų7765.1 Ų65.134%0.33536%0.357SS..Hα-helixtrans-49.1-50.4172.8178.8167.4-179.5171.70112.2A268 Y271 L277 F278 E279A268-K275 PolarHBondContact O-N 3.37Å; Y271-K275 WeakPolarHBondContact O-CB 3.43Å; Y271-K275 PolarHBondContact O-N 3.29Å; K275-L277 VanDerWaalsContact C-N 3.26Å; K275-L277 PolarHBondContact O-N 3.09Å; K275-F278 PolarHBondContact O-N 3.32Å; K275-E279 WeakPolarHBondContact CE-OE1 3.49Å; K275-E279 HydrophobicContact CG-CG 4.27Å; K275-E279 IonicContact NZ-OE1 2.7Å; K275-E279 WeakPolarHBondContact O-CB 3.37Å; K275-E279 WeakPolarHBondContact O-CG 3.35Å; K275-E279 PolarHBondContact O-N 3.3Å
276L88.9Confident82.7Confident119 Ų11964.5 Ų64.562%0.62337%0.369SS*.Hα-helixtrans-63.1-32.1180-69.2171.9000112.9P272 Y274 G280P272-L276 WeakPolarHBondContact O-CG 3.29Å; P272-L276 PolarHBondContact O-N 2.85Å; Y274-L276 VanDerWaalsContact C-N 3.29Å; Y274-L276 PolarHBondContact O-N 2.96Å; L276-G280 PolarHBondContact O-N 3.35Å
277L88.8Confident81.8Confident16 Ų1664 Ų648%0.08437%0.366CS..Hα-helixtrans-72-43.4177.5-58.5178.5000111.3F214 E273 Y274 K275 G280 A281 R293 F294 H297F214-L277 HydrophobicContact CE2-CD1 3.98Å; E273-L277 WeakPolarHBondContact O-CG 3.38Å; Y274-L277 HydrophobicContact CD1-CD1 4.22Å; Y274-L277 WeakPolarHBondContact O-CB 3.49Å; Y274-L277 PolarHBondContact O-N 2.75Å; K275-L277 VanDerWaalsContact C-N 3.26Å; K275-L277 PolarHBondContact O-N 3.09Å; L277-G280 PolarHBondContact O-N 2.95Å; L277-A281 PolarHBondContact O-N 2.79Å; L277-A281 VanDerWaalsContact O-N 3.13Å; L277-R293 HydrophobicContact CB-CB 4.38Å; L277-R293 HydrophobicContact CD2-CB 4.24Å; L277-F294 HydrophobicContact CD1-CD1 3.79Å; L277-F294 HydrophobicContact CD1-CE1 3.93Å; L277-H297 HydrophobicContact CD1-CB 4.09Å; L277-H297 HydrophobicContact CD2-CB 3.91Å
278F88.2Confident81.2Confident4 Ų467.8 Ų67.82%0.01838%0.382CS..Hα-helixtrans-71.6-37.8178.1-85.1-97.3000112.9F221 Y261 V264 K265 A268 Y274 K275 G280 A281 L290 F294F221-F278 HydrophobicContact CD1-CE2 4.03Å; F221-F278 AromaticContact CD1-CZ 3.76Å; F221-F278 HydrophobicContact CD1-CZ 3.76Å; F221-F278 HydrophobicContact CD2-CE2 4.32Å; F221-F278 AromaticContact CE1-CE2 3.95Å; F221-F278 HydrophobicContact CE1-CE2 3.95Å; F221-F278 AromaticContact CE1-CZ 3.99Å; F221-F278 HydrophobicContact CE1-CZ 3.99Å; F221-F278 HydrophobicContact CE2-CE2 4.25Å; F221-F278 HydrophobicContact CG-CE2 4.23Å; F221-F278 HydrophobicContact CG-CZ 4.13Å; F221-F278 HydrophobicContact CZ-CE2 4.06Å; Y261-F278 HydrophobicContact CE2-CE1 4.34Å; V264-F278 HydrophobicContact CG1-CE1 4.09Å; V264-F278 HydrophobicContact CG1-CZ 3.97Å; K265-F278 HydrophobicContact CB-CD1 4.18Å; K265-F278 HydrophobicContact CG-CB 4.28Å; K265-F278 HydrophobicContact CG-CD1 4.22Å; A268-F278 HydrophobicContact CB-CB 4.46Å; A268-F278 HydrophobicContact CB-CD2 3.35Å; A268-F278 HydrophobicContact CB-CE2 3.55Å; A268-F278 HydrophobicContact CB-CG 3.87Å; A268-F278 HydrophobicContact CB-CZ 4.23Å; Y274-F278 WeakPolarHBondContact O-CD2 3.26Å; Y274-F278 PolarHBondContact O-N 3.2Å; K275-F278 PolarHBondContact O-N 3.32Å; F278-G280 VanDerWaalsContact C-N 3.3Å; F278-A281 PolarHBondContact O-N 3.42Å; F278-L290 HydrophobicContact CD1-CD1 4.23Å; F278-L290 HydrophobicContact CD1-CD2 4.3Å; F278-L290 HydrophobicContact CD2-CD1 4.01Å; F278-L290 HydrophobicContact CE1-CD1 4.29Å; F278-L290 HydrophobicContact CE1-CD2 3.67Å; F278-L290 HydrophobicContact CE2-CD1 4.08Å; F278-L290 HydrophobicContact CE2-CD2 4.34Å; F278-L290 HydrophobicContact CG-CD1 4.1Å; F278-L290 HydrophobicContact CZ-CD1 4.23Å; F278-L290 HydrophobicContact CZ-CD2 3.7Å; F278-F294 HydrophobicContact CE2-CZ 4.21Å
279E85.3Confident80.9Confident108 Ų10871 Ų7151%0.50540%0.402SS..Hα-helixtrans-67.6-33.1173.1-73.3-179.1159.300112K275 A281K275-E279 WeakPolarHBondContact CE-OE1 3.49Å; K275-E279 HydrophobicContact CG-CG 4.27Å; K275-E279 IonicContact NZ-OE1 2.7Å; K275-E279 WeakPolarHBondContact O-CB 3.37Å; K275-E279 WeakPolarHBondContact O-CG 3.35Å; K275-E279 PolarHBondContact O-N 3.3Å; E279-A281 VanDerWaalsContact C-N 3.33Å
280G77.9Confident80.8Confident20 Ų2069.4 Ų69.421%0.20639%0.393CS..Hα-helixtrans-78.2-14.1177.800000114.4L276 L277 F278 R293L276-G280 PolarHBondContact O-N 3.35Å; L277-G280 PolarHBondContact O-N 2.95Å; F278-G280 VanDerWaalsContact C-N 3.3Å; G280-R293 VanDerWaalsContact O-CZ 3.28Å; G280-R293 PolarHBondContact O-NE 3Å; G280-R293 PolarHBondContact O-NH2 2.88Å
281A79Confident80.6Confident19 Ų1967.1 Ų67.116%0.15739%0.388CS..  trans-83.9114.9175.900000109.2L277 F278 E279 K288 L290 R293L277-A281 PolarHBondContact O-N 2.79Å; L277-A281 VanDerWaalsContact O-N 3.13Å; F278-A281 PolarHBondContact O-N 3.42Å; E279-A281 VanDerWaalsContact C-N 3.33Å; A281-K288 WeakPolarHBondContact CA-O 3.4Å; A281-L290 HydrophobicContact CB-CB 4.01Å; A281-L290 HydrophobicContact CB-CD1 4.23Å; A281-R293 HydrophobicContact CB-CG 4.47Å
282G72.7Confident80.5Confident29 Ų2967.2 Ų67.230%0.29939%0.392SS..  trans-98.5157.4178.700000112D287 K288G282-D287 VanDerWaalsContact CA-CB 3.42Å; G282-D287 VanDerWaalsContact CA-OD2 3.31Å; G282-D287 WeakPolarHBondContact CA-OD2 3.37Å; G282-K288 PolarHBondContact N-O 3Å
283S66.3Low80.5Confident125 Ų12565.7 Ų65.787%0.87437%0.373SS*.  trans-97-3.9178.5-51.20000113
284N62.2Low80.8Confident111 Ų11162.1 Ų62.159%0.59436%0.357SS*.SBendtrans-83.7149.5-177.5-55.4-64.8000111.6G286 D287N284-G286 PolarHBondContact O-N 3.28Å; N284-D287 WeakPolarHBondContact CB-OD2 3.4Å; N284-D287 PolarHBondContact N-OD2 3.2Å; N284-D287 PolarHBondContact ND2-OD2 3.24Å; N284-D287 WeakPolarHBondContact O-CB 3.27Å; N284-D287 PolarHBondContact O-N 2.98Å
285P58.4Low80.8Confident136 Ų13663.5 Ų63.588%0.88336%0.362SS*.THydrogen-bonded Turntrans-59.9101.9171.9-19.831.4000110.9
286G63Low80.9Confident50 Ų5062 Ų6252%0.51536%0.357SS..THydrogen-bonded Turntrans125-18.5-176.100000113.5N284N284-G286 PolarHBondContact O-N 3.28Å
287D73.2Confident81.1Confident69 Ų6957.5 Ų57.537%0.36933%0.332SS..SBendtrans-70.8149.4170.7-65.4-22.9000110.2G282 N284 T289G282-D287 VanDerWaalsContact CA-CB 3.42Å; G282-D287 VanDerWaalsContact CA-OD2 3.31Å; G282-D287 WeakPolarHBondContact CA-OD2 3.37Å; N284-D287 WeakPolarHBondContact CB-OD2 3.4Å; N284-D287 PolarHBondContact N-OD2 3.2Å; N284-D287 PolarHBondContact ND2-OD2 3.24Å; N284-D287 WeakPolarHBondContact O-CB 3.27Å; N284-D287 PolarHBondContact O-N 2.98Å; D287-T289 PolarHBondContact O-N 2.97Å
288K79.4Confident81.3Confident84 Ų8457.7 Ų57.737%0.36533%0.333SS..PPolyproline II helixtrans-66.4133.1173.6-68.9-173.4177.4-178.30109.3A281 G282 D292 E296A281-K288 WeakPolarHBondContact CA-O 3.4Å; G282-K288 PolarHBondContact N-O 3Å; K288-D292 HydrophobicContact CB-CB 4.13Å; K288-E296 WeakPolarHBondContact CD-OE1 3.46Å; K288-E296 WeakPolarHBondContact CE-OE1 3.38Å; K288-E296 IonicContact NZ-OE1 3.19Å; K288-E296 PolarHBondContact NZ-OE1 3.15Å
289T86.1Confident81.6Confident69 Ų6958 Ų5842%0.42334%0.335SS..PPolyproline II helixtrans-69.7162.3175.5670000110.1D287 E291 D292 R293D287-T289 PolarHBondContact O-N 2.97Å; T289-E291 PolarHBondContact O-N 2.75Å; T289-D292 WeakPolarHBondContact CB-OD2 3.46Å; T289-D292 PolarHBondContact N-OD2 3.37Å; T289-D292 WeakPolarHBondContact O-CB 3.38Å; T289-D292 PolarHBondContact O-N 3.13Å; T289-D292 PolarHBondContact OG1-N 3.01Å; T289-D292 VanDerWaalsContact OG1-N 3.1Å; T289-D292 PolarHBondContact OG1-OD2 2.7Å; T289-R293 WeakPolarHBondContact O-CG 3.3Å; T289-R293 PolarHBondContact O-N 3.16Å; T289-R293 VanDerWaalsContact O-N 3.1Å
290L88.1Confident82Confident22 Ų2258.6 Ų58.612%0.11534%0.336CS..Hα-helixtrans-58.7-34.9173-18063.7000111.5I225 Y261 F278 A281 R293 F294I225-L290 HydrophobicContact CD1-CD2 3.78Å; Y261-L290 HydrophobicContact CE2-CD2 4.47Å; F278-L290 HydrophobicContact CD1-CD1 4.23Å; F278-L290 HydrophobicContact CD1-CD2 4.3Å; F278-L290 HydrophobicContact CD2-CD1 4.01Å; F278-L290 HydrophobicContact CE1-CD1 4.29Å; F278-L290 HydrophobicContact CE1-CD2 3.67Å; F278-L290 HydrophobicContact CE2-CD1 4.08Å; F278-L290 HydrophobicContact CE2-CD2 4.34Å; F278-L290 HydrophobicContact CG-CD1 4.1Å; F278-L290 HydrophobicContact CZ-CD1 4.23Å; F278-L290 HydrophobicContact CZ-CD2 3.7Å; A281-L290 HydrophobicContact CB-CB 4.01Å; A281-L290 HydrophobicContact CB-CD1 4.23Å; L290-R293 WeakPolarHBondContact O-CB 3.44Å; L290-R293 PolarHBondContact O-N 3.12Å; L290-F294 HydrophobicContact CD1-CD2 4.49Å; L290-F294 HydrophobicContact CD1-CE1 4.48Å; L290-F294 HydrophobicContact CD1-CE2 3.98Å; L290-F294 HydrophobicContact CD1-CZ 3.96Å; L290-F294 HydrophobicContact CD2-CE2 3.81Å; L290-F294 HydrophobicContact CD2-CZ 4.2Å; L290-F294 HydrophobicContact CG-CD2 4.01Å; L290-F294 HydrophobicContact CG-CE2 3.53Å; L290-F294 HydrophobicContact CG-CZ 4.01Å; L290-F294 WeakPolarHBondContact O-CD2 3.17Å; L290-F294 PolarHBondContact O-N 3.4Å
291E87.6Confident82.7Confident117 Ų11759.2 Ų59.255%0.54733%0.334SS..Hα-helixtrans-64.9-45176.4-166.9178.1-179.700111.7T289 R293 F294 F295T289-E291 PolarHBondContact O-N 2.75Å; E291-R293 VanDerWaalsContact C-N 3.25Å; E291-R293 PolarHBondContact O-N 3.19Å; E291-F294 PolarHBondContact O-N 2.9Å; E291-F294 VanDerWaalsContact O-N 3.09Å; E291-F295 HydrophobicContact CG-CD2 4.1Å; E291-F295 HydrophobicContact CG-CE2 3.51Å; E291-F295 HydrophobicContact CG-CZ 3.97Å; E291-F295 WeakPolarHBondContact O-CD2 3.32Å; E291-F295 PolarHBondContact O-N 3.25Å
292D87.9Confident83.5Confident53 Ų5358.3 Ų58.328%0.28333%0.327SS..Hα-helixtrans-57.4-41.3173.7-60.8-43000111.2K288 T289 F295 E296K288-D292 HydrophobicContact CB-CB 4.13Å; T289-D292 WeakPolarHBondContact CB-OD2 3.46Å; T289-D292 PolarHBondContact N-OD2 3.37Å; T289-D292 WeakPolarHBondContact O-CB 3.38Å; T289-D292 PolarHBondContact O-N 3.13Å; T289-D292 PolarHBondContact OG1-N 3.01Å; T289-D292 VanDerWaalsContact OG1-N 3.1Å; T289-D292 PolarHBondContact OG1-OD2 2.7Å; D292-F295 PolarHBondContact O-N 3.3Å; D292-E296 WeakPolarHBondContact O-CG 3.41Å; D292-E296 PolarHBondContact O-N 2.92Å
293R90Very high84.5Confident71 Ų7160.4 Ų60.427%0.26833%0.328SS..Hα-helixtrans-65.2-39.4176.6-66.4-56.4-163.9159.58.5112.3L277 G280 A281 T289 L290 E291 E296 H297L277-R293 HydrophobicContact CB-CB 4.38Å; L277-R293 HydrophobicContact CD2-CB 4.24Å; G280-R293 VanDerWaalsContact O-CZ 3.28Å; G280-R293 PolarHBondContact O-NE 3Å; G280-R293 PolarHBondContact O-NH2 2.88Å; A281-R293 HydrophobicContact CB-CG 4.47Å; T289-R293 WeakPolarHBondContact O-CG 3.3Å; T289-R293 PolarHBondContact O-N 3.16Å; T289-R293 VanDerWaalsContact O-N 3.1Å; L290-R293 WeakPolarHBondContact O-CB 3.44Å; L290-R293 PolarHBondContact O-N 3.12Å; E291-R293 VanDerWaalsContact C-N 3.25Å; E291-R293 PolarHBondContact O-N 3.19Å; R293-E296 WeakPolarHBondContact CD-OE2 3.47Å; R293-E296 IonicContact CZ-OE2 2.74Å; R293-E296 IonicContact NE-OE2 2.73Å; R293-E296 IonicContact NH1-OE2 2.65Å; R293-E296 PolarHBondContact NH1-OE2 3.33Å; R293-E296 VanDerWaalsContact NH1-OE2 3.09Å; R293-E296 PolarHBondContact O-N 3.48Å; R293-H297 WeakPolarHBondContact O-CB 3.49Å; R293-H297 PolarHBondContact O-N 3.47Å
294F92.8Very high85.8Confident3 Ų358.4 Ų58.41%0.01331%0.307CS..Hα-helixtrans-64.2-41.8174.1-73.6-45.4000111.7F214 R218 F221 L277 F278 L290 E291 H297 E298F214-F294 HydrophobicContact CE2-CD1 4.07Å; F214-F294 HydrophobicContact CZ-CB 4.24Å; F214-F294 AromaticContact CZ-CD1 3.78Å; F214-F294 HydrophobicContact CZ-CD1 3.78Å; F214-F294 HydrophobicContact CZ-CG 4.44Å; R218-F294 HydrophobicContact CG-CB 4.27Å; R218-F294 HydrophobicContact CG-CD1 4.3Å; R218-F294 HydrophobicContact CG-CD2 3.92Å; R218-F294 HydrophobicContact CG-CE2 4.27Å; R218-F294 HydrophobicContact CG-CG 3.94Å; F221-F294 HydrophobicContact CB-CZ 4.19Å; F221-F294 HydrophobicContact CD2-CE1 4.45Å; F221-F294 HydrophobicContact CD2-CZ 4.02Å; F221-F294 HydrophobicContact CG-CZ 4.35Å; L277-F294 HydrophobicContact CD1-CD1 3.79Å; L277-F294 HydrophobicContact CD1-CE1 3.93Å; F278-F294 HydrophobicContact CE2-CZ 4.21Å; L290-F294 HydrophobicContact CD1-CD2 4.49Å; L290-F294 HydrophobicContact CD1-CE1 4.48Å; L290-F294 HydrophobicContact CD1-CE2 3.98Å; L290-F294 HydrophobicContact CD1-CZ 3.96Å; L290-F294 HydrophobicContact CD2-CE2 3.81Å; L290-F294 HydrophobicContact CD2-CZ 4.2Å; L290-F294 HydrophobicContact CG-CD2 4.01Å; L290-F294 HydrophobicContact CG-CE2 3.53Å; L290-F294 HydrophobicContact CG-CZ 4.01Å; L290-F294 WeakPolarHBondContact O-CD2 3.17Å; L290-F294 PolarHBondContact O-N 3.4Å; E291-F294 PolarHBondContact O-N 2.9Å; E291-F294 VanDerWaalsContact O-N 3.09Å; F294-H297 PolarHBondContact O-N 3Å; F294-E298 WeakPolarHBondContact O-CB 3.22Å; F294-E298 PolarHBondContact O-N 2.88Å
295F91.6Very high87.2Confident31 Ų3153.4 Ų53.414%0.13628%0.281CS..Hα-helixtrans-65.3-40.7175.3-69.1-44.9000112.5E291 D292 H297 E298 V299 I348E291-F295 HydrophobicContact CG-CD2 4.1Å; E291-F295 HydrophobicContact CG-CE2 3.51Å; E291-F295 HydrophobicContact CG-CZ 3.97Å; E291-F295 WeakPolarHBondContact O-CD2 3.32Å; E291-F295 PolarHBondContact O-N 3.25Å; D292-F295 PolarHBondContact O-N 3.3Å; F295-H297 VanDerWaalsContact C-N 3.29Å; F295-H297 PolarHBondContact O-N 3.04Å; F295-E298 PolarHBondContact O-N 3.38Å; F295-V299 WeakPolarHBondContact O-CB 3.3Å; F295-V299 VanDerWaalsContact O-CG2 3.29Å; F295-V299 WeakPolarHBondContact O-CG2 3.43Å; F295-V299 PolarHBondContact O-N 2.96Å; F295-I348 HydrophobicContact CB-CD1 3.37Å; F295-I348 HydrophobicContact CD2-CD1 4.46Å; F295-I348 HydrophobicContact CG-CD1 4.36Å
296E91.8Very high88.9Confident47 Ų4747.9 Ų47.922%0.2224%0.243CC..Hα-helixtrans-57.7-43.4173.3-76.5-177.7161.500112K288 D292 R293 K300 I348K288-E296 WeakPolarHBondContact CD-OE1 3.46Å; K288-E296 WeakPolarHBondContact CE-OE1 3.38Å; K288-E296 IonicContact NZ-OE1 3.19Å; K288-E296 PolarHBondContact NZ-OE1 3.15Å; D292-E296 WeakPolarHBondContact O-CG 3.41Å; D292-E296 PolarHBondContact O-N 2.92Å; R293-E296 WeakPolarHBondContact CD-OE2 3.47Å; R293-E296 IonicContact CZ-OE2 2.74Å; R293-E296 IonicContact NE-OE2 2.73Å; R293-E296 IonicContact NH1-OE2 2.65Å; R293-E296 PolarHBondContact NH1-OE2 3.33Å; R293-E296 VanDerWaalsContact NH1-OE2 3.09Å; R293-E296 PolarHBondContact O-N 3.48Å; E296-K300 WeakPolarHBondContact O-CB 3.37Å; E296-K300 PolarHBondContact O-N 3.26Å; E296-I348 HydrophobicContact CG-CD1 4.35Å; E296-I348 HydrophobicContact CG-CG1 4.42Å; E296-I348 HydrophobicContact CG-CG2 4.02Å
297H92.6Very high90.3Very high23 Ų2351.7 Ų51.711%0.10625%0.251CS..Hα-helixtrans-69.5-41.8178.7-164.588.5000111.9F214 L277 R293 F294 F295 V299 K300 L301F214-H297 AromaticContact CD2-CD2 3.46Å; F214-H297 VanDerWaalsContact CD2-CD2 3.46Å; F214-H297 WeakPolarHBondContact CD2-CD2 3.5Å; F214-H297 HydrophobicContact CE2-CB 4.05Å; F214-H297 AromaticContact CE2-CD2 3.25Å; F214-H297 WeakPolarHBondContact CE2-CD2 3.29Å; F214-H297 AromaticContact CE2-CG 3.82Å; F214-H297 HydrophobicContact CZ-CB 3.82Å; F214-H297 AromaticContact CZ-CD2 3.69Å; L277-H297 HydrophobicContact CD1-CB 4.09Å; L277-H297 HydrophobicContact CD2-CB 3.91Å; R293-H297 WeakPolarHBondContact O-CB 3.49Å; R293-H297 PolarHBondContact O-N 3.47Å; F294-H297 PolarHBondContact O-N 3Å; F295-H297 VanDerWaalsContact C-N 3.29Å; F295-H297 PolarHBondContact O-N 3.04Å; H297-V299 PolarHBondContact O-N 3.4Å; H297-K300 WeakPolarHBondContact O-CB 3.45Å; H297-K300 PolarHBondContact O-N 3.34Å; H297-K300 VanDerWaalsContact O-N 3.15Å; H297-L301 WeakPolarHBondContact O-CG 3.41Å; H297-L301 PolarHBondContact O-N 3.14Å
298E93.7Very high91Very high20 Ų2052.1 Ų52.19%0.09325%0.253CS..Hα-helixtrans-57.1-48173.6-179.4175.6-174.200111F214 R218 F294 F295 K300 L301 N302F214-E298 HydrophobicContact CE1-CB 3.99Å; R218-E298 IonicContact CZ-OE2 2.63Å; R218-E298 IonicContact NH1-OE2 2.66Å; R218-E298 PolarHBondContact NH1-OE2 3.28Å; R218-E298 IonicContact NH2-OE2 2.56Å; F294-E298 WeakPolarHBondContact O-CB 3.22Å; F294-E298 PolarHBondContact O-N 2.88Å; F295-E298 PolarHBondContact O-N 3.38Å; E298-K300 VanDerWaalsContact C-N 3.31Å; E298-K300 PolarHBondContact O-N 3.4Å; E298-L301 PolarHBondContact O-N 3.07Å; E298-N302 WeakPolarHBondContact CG-ND2 3.45Å; E298-N302 WeakPolarHBondContact O-CB 3.32Å; E298-N302 PolarHBondContact O-N 2.95Å; E298-N302 PolarHBondContact O-ND2 2.88Å
299V93.8Very high91.5Very high10 Ų1053.6 Ų53.66%0.06126%0.261CS..Hα-helixtrans-58.6-44.6175.5169.50000110.4F295 H297 L301 N302 K303 L321 Q324 I348 I350F295-V299 WeakPolarHBondContact O-CB 3.3Å; F295-V299 VanDerWaalsContact O-CG2 3.29Å; F295-V299 WeakPolarHBondContact O-CG2 3.43Å; F295-V299 PolarHBondContact O-N 2.96Å; H297-V299 PolarHBondContact O-N 3.4Å; V299-L301 PolarHBondContact O-N 3.41Å; V299-N302 PolarHBondContact O-N 3.06Å; V299-K303 HydrophobicContact CG1-CD 3.94Å; V299-K303 HydrophobicContact CG1-CG 4.31Å; V299-K303 WeakPolarHBondContact O-CB 3.41Å; V299-K303 WeakPolarHBondContact O-CG 3.25Å; V299-K303 PolarHBondContact O-N 3.5Å; V299-L321 HydrophobicContact CB-CD2 4.35Å; V299-L321 HydrophobicContact CG1-CD2 3.96Å; V299-L321 HydrophobicContact CG2-CD2 4.39Å; V299-Q324 HydrophobicContact CG2-CB 4.2Å; V299-Q324 HydrophobicContact CG2-CG 3.76Å; V299-I348 HydrophobicContact CG2-CG2 4.1Å; V299-I350 HydrophobicContact CG1-CB 4.49Å; V299-I350 HydrophobicContact CG1-CG1 4.35Å; V299-I350 HydrophobicContact CG1-CG2 4.29Å
300K93.7Very high91.8Very high122 Ų12253.5 Ų53.553%0.5326%0.255SS..Hα-helixtrans-58.6-48.1177-179-175.2174.4-172.70111.8E296 H297 E298 K303 L304E296-K300 WeakPolarHBondContact O-CB 3.37Å; E296-K300 PolarHBondContact O-N 3.26Å; H297-K300 WeakPolarHBondContact O-CB 3.45Å; H297-K300 PolarHBondContact O-N 3.34Å; H297-K300 VanDerWaalsContact O-N 3.15Å; E298-K300 VanDerWaalsContact C-N 3.31Å; E298-K300 PolarHBondContact O-N 3.4Å; K300-K303 PolarHBondContact O-N 2.68Å; K300-L304 HydrophobicContact CG-CD1 4.4Å; K300-L304 VanDerWaalsContact O-CG 3.32Å; K300-L304 WeakPolarHBondContact O-CG 3.17Å; K300-L304 PolarHBondContact O-N 3.15Å
301L93.7Very high92Very high32 Ų3252.4 Ų52.417%0.16825%0.25CC..Hα-helixtrans-62.8-45.8179.5-67.5177.4000111.6I211 F214 H297 E298 V299 K303 L304 A305I211-L301 HydrophobicContact CG1-CB 4.08Å; F214-L301 HydrophobicContact CB-CD1 3.63Å; F214-L301 HydrophobicContact CD1-CD1 4.01Å; F214-L301 HydrophobicContact CD2-CD1 4.24Å; F214-L301 HydrophobicContact CG-CD1 3.68Å; H297-L301 WeakPolarHBondContact O-CG 3.41Å; H297-L301 PolarHBondContact O-N 3.14Å; E298-L301 PolarHBondContact O-N 3.07Å; V299-L301 PolarHBondContact O-N 3.41Å; L301-K303 VanDerWaalsContact C-N 3.32Å; L301-K303 PolarHBondContact O-N 3.09Å; L301-L304 PolarHBondContact O-N 2.93Å; L301-L304 VanDerWaalsContact O-N 3.15Å; L301-A305 PolarHBondContact O-N 3.36Å; L301-A305 VanDerWaalsContact O-N 3.14Å
302N94.3Very high92.3Very high1 Ų147.4 Ų47.41%0.00523%0.226CC..Hα-helixtrans-64.5-35.3177.8-73-59000112.3E298 V299 A305 F306 A317 L321E298-N302 WeakPolarHBondContact CG-ND2 3.45Å; E298-N302 WeakPolarHBondContact O-CB 3.32Å; E298-N302 PolarHBondContact O-N 2.95Å; E298-N302 PolarHBondContact O-ND2 2.88Å; V299-N302 PolarHBondContact O-N 3.06Å; N302-A305 WeakPolarHBondContact O-CB 3.34Å; N302-A305 PolarHBondContact O-N 2.93Å; N302-F306 WeakPolarHBondContact O-CD2 3.48Å; N302-A317 HydrophobicContact CB-CB 3.88Å; N302-A317 VanDerWaalsContact O-CB 3.32Å; N302-A317 WeakPolarHBondContact O-CB 3.21Å; N302-A317 WeakPolarHBondContact OD1-CA 3.24Å; N302-L321 HydrophobicContact CB-CD1 4.43Å; N302-L321 HydrophobicContact CB-CD2 3.83Å; N302-L321 HydrophobicContact CB-CG 3.91Å
303K93.5Very high92.6Very high72 Ų7244.9 Ų44.931%0.31321%0.213SC..Hα-helixtrans-62.9-43.4171.9-73.8172.874.8169.20112.2V299 K300 L301 A305 F306 L321 I350 F351V299-K303 HydrophobicContact CG1-CD 3.94Å; V299-K303 HydrophobicContact CG1-CG 4.31Å; V299-K303 WeakPolarHBondContact O-CB 3.41Å; V299-K303 WeakPolarHBondContact O-CG 3.25Å; V299-K303 PolarHBondContact O-N 3.5Å; K300-K303 PolarHBondContact O-N 2.68Å; L301-K303 VanDerWaalsContact C-N 3.32Å; L301-K303 PolarHBondContact O-N 3.09Å; K303-A305 PolarHBondContact O-N 3.15Å; K303-F306 PolarHBondContact O-N 3.45Å; K303-F306 VanDerWaalsContact O-N 3.17Å; K303-L321 HydrophobicContact CG-CD1 4.33Å; K303-L321 HydrophobicContact CG-CD2 4.36Å; K303-I350 WeakPolarHBondContact CD-O 3.5Å; K303-I350 WeakPolarHBondContact CE-O 3.28Å; K303-I350 HydrophobicContact CG-CG2 4.42Å; K303-I350 PolarHBondContact NZ-O 3.35Å; K303-F351 HydrophobicContact CD-CE1 4.47Å; K303-F351 HydrophobicContact CG-CE1 3.93Å; K303-F351 HydrophobicContact CG-CZ 4.26Å
304L93.6Very high92.9Very high84 Ų8441.5 Ų41.544%0.4420%0.2SC..Hα-helixtrans-63.4-31.3-179.9-69.4173.6000111.8K300 L301 F306 L307K300-L304 HydrophobicContact CG-CD1 4.4Å; K300-L304 VanDerWaalsContact O-CG 3.32Å; K300-L304 WeakPolarHBondContact O-CG 3.17Å; K300-L304 PolarHBondContact O-N 3.15Å; L301-L304 PolarHBondContact O-N 2.93Å; L301-L304 VanDerWaalsContact O-N 3.15Å; L304-F306 PolarHBondContact O-N 3.15Å; L304-F306 VanDerWaalsContact O-N 3.16Å; L304-L307 HydrophobicContact CD2-CD1 3.6Å; L304-L307 WeakPolarHBondContact O-CB 3.37Å; L304-L307 WeakPolarHBondContact O-CG 3.23Å; L304-L307 PolarHBondContact O-N 3.38Å
305A93.1Very high93.1Very high5 Ų541.4 Ų41.44%0.04120%0.199CC..Hα-helixtrans-55.6-32.4175.100000112.5I211 L301 N302 K303 L307 H311 A317I211-A305 HydrophobicContact CD1-CB 4.31Å; L301-A305 PolarHBondContact O-N 3.36Å; L301-A305 VanDerWaalsContact O-N 3.14Å; N302-A305 WeakPolarHBondContact O-CB 3.34Å; N302-A305 PolarHBondContact O-N 2.93Å; K303-A305 PolarHBondContact O-N 3.15Å; A305-L307 VanDerWaalsContact C-N 3.27Å; A305-L307 PolarHBondContact O-N 3.35Å; A305-H311 PolarHBondContact O-CE1 3.11Å; A305-H311 PolarHBondContact O-NE2 3.19Å; A305-A317 HydrophobicContact CB-CB 3.82Å
306F93.1Very high93.3Very high20 Ų2040.2 Ų40.29%0.08819%0.194CC..THydrogen-bonded Turntrans-74.2-10.7179.2-75.9-84.3000115.2R21 K24 N302 K303 L304 N308 V314 A317 F318 L321R21-F306 PolarHBondContact NH1-O 3.41Å; R21-F306 VanDerWaalsContact NH1-O 3.11Å; K24-F306 HydrophobicContact CB-CD1 4.44Å; K24-F306 HydrophobicContact CB-CE1 3.79Å; K24-F306 HydrophobicContact CB-CZ 4.05Å; K24-F306 HydrophobicContact CD-CD1 4.1Å; K24-F306 HydrophobicContact CD-CE1 4.28Å; K24-F306 HydrophobicContact CD-CG 4.41Å; K24-F306 HydrophobicContact CG-CD1 3.95Å; K24-F306 HydrophobicContact CG-CD2 4.44Å; K24-F306 HydrophobicContact CG-CE1 3.65Å; K24-F306 HydrophobicContact CG-CE2 4.18Å; K24-F306 HydrophobicContact CG-CG 4.33Å; K24-F306 HydrophobicContact CG-CZ 3.78Å; N302-F306 WeakPolarHBondContact O-CD2 3.48Å; K303-F306 PolarHBondContact O-N 3.45Å; K303-F306 VanDerWaalsContact O-N 3.17Å; L304-F306 PolarHBondContact O-N 3.15Å; L304-F306 VanDerWaalsContact O-N 3.16Å; F306-N308 VanDerWaalsContact C-N 3.32Å; F306-V314 HydrophobicContact CD1-CB 4.34Å; F306-V314 HydrophobicContact CD1-CG1 4.08Å; F306-V314 HydrophobicContact CE1-CB 4Å; F306-V314 HydrophobicContact CE1-CG1 4.25Å; F306-V314 HydrophobicContact CZ-CB 4.45Å; F306-A317 HydrophobicContact CD2-CB 4.22Å; F306-A317 HydrophobicContact CE2-CB 3.63Å; F306-A317 HydrophobicContact CZ-CB 4.32Å; F306-F318 HydrophobicContact CZ-CB 3.99Å; F306-L321 HydrophobicContact CD2-CD1 4.26Å; F306-L321 HydrophobicContact CE2-CD1 3.79Å
307L91.9Very high93.4Very high130 Ų13038 Ų3868%0.68118%0.184SC*.THydrogen-bonded Turntrans-72-28.8178.7-64.1178.9000112.5L304 A305L304-L307 HydrophobicContact CD2-CD1 3.6Å; L304-L307 WeakPolarHBondContact O-CB 3.37Å; L304-L307 WeakPolarHBondContact O-CG 3.23Å; L304-L307 PolarHBondContact O-N 3.38Å; A305-L307 VanDerWaalsContact C-N 3.27Å; A305-L307 PolarHBondContact O-N 3.35Å
308N89.2Confident93.6Very high78 Ų7837.1 Ų37.142%0.41718%0.179SC..SBendtrans-89.4166.3176.3-65.3-31000110.8R21 T203 F306 H311R21-N308 PolarHBondContact NH2-O 3.5Å; T203-N308 HydrophobicContact CG2-CB 3.67Å; F306-N308 VanDerWaalsContact C-N 3.32Å; N308-H311 PolarHBondContact O-NE2 3.35Å
309Q90.3Very high93.6Very high116 Ų11636.2 Ų36.254%0.54218%0.175SC..  trans-124.9160.6178.2-65.9-172.3-3.400111.1
310F91.5Very high93.7Very high66 Ų6637.3 Ų37.329%0.28918%0.179SC..SBendtrans61.749.3173.7-44.8-60.4000114E6 F9 E17E6-F310 HydrophobicContact CB-CB 4.12Å; E6-F310 HydrophobicContact CB-CD2 4.04Å; E6-F310 HydrophobicContact CB-CG 4.26Å; E6-F310 HydrophobicContact CG-CB 4.12Å; E6-F310 HydrophobicContact CG-CD2 4.3Å; F9-F310 HydrophobicContact CB-CB 4.07Å; F9-F310 HydrophobicContact CB-CD1 4.44Å; F9-F310 HydrophobicContact CD1-CB 4.05Å; F9-F310 AromaticContact CD1-CD1 3.86Å; F9-F310 HydrophobicContact CD1-CD1 3.86Å; F9-F310 HydrophobicContact CD1-CG 4.47Å; F9-F310 HydrophobicContact CD2-CB 4.23Å; F9-F310 VanDerWaalsContact CE2-C 3.44Å; F9-F310 HydrophobicContact CG-CB 3.84Å; F9-F310 HydrophobicContact CG-CD1 4.34Å; E17-F310 PolarHBondContact OE1-N 3Å; E17-F310 PolarHBondContact OE2-N 3.02Å
311H93.1Very high93.7Very high0 Ų031.5 Ų31.50%015%0.154CC..SBendtrans-147.8160.6177.669.1105.7000112.1T203 T204 A305 N308 G313 V314T203-H311 HydrophobicContact CG2-CB 3.81Å; T204-H311 WeakPolarHBondContact OG1-CA 3.45Å; T204-H311 WeakPolarHBondContact OG1-CB 3.49Å; A305-H311 PolarHBondContact O-CE1 3.11Å; A305-H311 PolarHBondContact O-NE2 3.19Å; N308-H311 PolarHBondContact O-NE2 3.35Å; H311-G313 WeakPolarHBondContact ND1-CA 3.4Å; H311-G313 PolarHBondContact ND1-N 2.96Å; H311-G313 VanDerWaalsContact ND1-N 3.17Å; H311-V314 PolarHBondContact CE1-N 3.15Å; H311-V314 WeakPolarHBondContact NE2-CG1 3.46Å; H311-V314 WeakPolarHBondContact O-CG2 3.28Å
312F94.1Very high93.7Very high12 Ų1230.5 Ų30.55%0.05315%0.148CC..THydrogen-bonded Turntrans-85.2-13.4-179.2-52.3-38.9000114F9 N13 P92 L93 F96 L200 T204 V314 F315F9-F312 HydrophobicContact CD2-CE1 4.16Å; F9-F312 AromaticContact CE2-CD1 3.66Å; F9-F312 HydrophobicContact CE2-CD1 3.66Å; F9-F312 AromaticContact CE2-CE1 3.34Å; F9-F312 HydrophobicContact CE2-CE1 3.34Å; F9-F312 HydrophobicContact CE2-CZ 4.2Å; F9-F312 HydrophobicContact CZ-CD1 4.05Å; F9-F312 AromaticContact CZ-CE1 3.94Å; F9-F312 HydrophobicContact CZ-CE1 3.94Å; N13-F312 HydrophobicContact CB-CE1 4.35Å; P92-F312 HydrophobicContact CB-CE2 4.41Å; P92-F312 HydrophobicContact CG-CE2 3.62Å; P92-F312 HydrophobicContact CG-CZ 3.84Å; L93-F312 HydrophobicContact CB-CD1 4.27Å; L93-F312 HydrophobicContact CB-CE1 3.98Å; L93-F312 HydrophobicContact CB-CZ 4.24Å; L93-F312 HydrophobicContact CD1-CB 4.23Å; L93-F312 HydrophobicContact CD1-CD1 3.74Å; L93-F312 HydrophobicContact CD1-CE1 4.31Å; L93-F312 HydrophobicContact CD1-CG 4Å; L93-F312 HydrophobicContact CG-CD1 4.43Å; F96-F312 HydrophobicContact CB-CD2 4.5Å; F96-F312 HydrophobicContact CD1-CB 3.85Å; F96-F312 HydrophobicContact CD2-CB 4.02Å; F96-F312 HydrophobicContact CE1-CB 3.9Å; F96-F312 WeakPolarHBondContact CE1-O 3.42Å; F96-F312 HydrophobicContact CE2-CB 4.08Å; F96-F312 HydrophobicContact CG-CB 3.91Å; F96-F312 HydrophobicContact CG-CD2 4.49Å; F96-F312 HydrophobicContact CZ-CB 4.01Å; F96-F312 WeakPolarHBondContact CZ-O 3.48Å; L200-F312 HydrophobicContact CD1-CD2 3.82Å; L200-F312 HydrophobicContact CD1-CE2 4.05Å; T204-F312 HydrophobicContact CG2-CB 3.98Å; T204-F312 HydrophobicContact CG2-CD2 4.06Å; T204-F312 HydrophobicContact CG2-CG 4.38Å; T204-F312 PolarHBondContact OG1-N 3.37Å; F312-V314 PolarHBondContact O-N 3.49Å; F312-F315 HydrophobicContact CB-CD2 4.27Å; F312-F315 HydrophobicContact CD1-CE2 4.23Å; F312-F315 WeakPolarHBondContact O-CB 3.46Å; F312-F315 WeakPolarHBondContact O-CD2 3.29Å; F312-F315 PolarHBondContact O-N 2.92Å
313G94.2Very high93.7Very high0 Ų031.7 Ų31.70%015%0.154CC..Hα-helixtrans-57.4-24.8178.700000114.3M208 H311 F315 Y316 A317M208-G313 VanDerWaalsContact SD-CA 3.56Å; H311-G313 WeakPolarHBondContact ND1-CA 3.4Å; H311-G313 PolarHBondContact ND1-N 2.96Å; H311-G313 VanDerWaalsContact ND1-N 3.17Å; G313-F315 VanDerWaalsContact C-N 3.27Å; G313-F315 PolarHBondContact O-N 3Å; G313-Y316 PolarHBondContact O-N 3.03Å; G313-A317 VanDerWaalsContact O-CB 3.28Å; G313-A317 WeakPolarHBondContact O-CB 3.5Å; G313-A317 PolarHBondContact O-N 3.47Å
314V95.3Very high93.7Very high0 Ų028.9 Ų28.90%014%0.142CC..Hα-helixtrans-62.3-31.4173.6-63.20000113.5V20 F306 H311 F312 F318V20-V314 HydrophobicContact CG1-CB 4.33Å; V20-V314 HydrophobicContact CG1-CG2 3.75Å; F306-V314 HydrophobicContact CD1-CB 4.34Å; F306-V314 HydrophobicContact CD1-CG1 4.08Å; F306-V314 HydrophobicContact CE1-CB 4Å; F306-V314 HydrophobicContact CE1-CG1 4.25Å; F306-V314 HydrophobicContact CZ-CB 4.45Å; H311-V314 PolarHBondContact CE1-N 3.15Å; H311-V314 WeakPolarHBondContact NE2-CG1 3.46Å; H311-V314 WeakPolarHBondContact O-CG2 3.28Å; F312-V314 PolarHBondContact O-N 3.49Å; V314-F318 VanDerWaalsContact O-CB 3.23Å; V314-F318 WeakPolarHBondContact O-CB 3.25Å; V314-F318 PolarHBondContact O-N 3.28Å
315F96.1Very high93.7Very high0 Ų024.9 Ų24.90%012%0.121CC..Hα-helixtrans-72-44.7179.3-62.9-83000110.8L16 V20 M85 L93 F96 L97 F312 G313 F318 V319L16-F315 HydrophobicContact CB-CE1 3.92Å; L16-F315 HydrophobicContact CB-CZ 3.72Å; V20-F315 HydrophobicContact CB-CD1 4.12Å; V20-F315 HydrophobicContact CB-CE1 4.03Å; V20-F315 HydrophobicContact CG1-CD1 4.12Å; V20-F315 HydrophobicContact CG1-CE1 3.84Å; V20-F315 HydrophobicContact CG1-CZ 4.17Å; V20-F315 HydrophobicContact CG2-CD1 4.27Å; M85-F315 HydrophobicContact SD-CD1 3.78Å; M85-F315 HydrophobicContact SD-CE1 4.02Å; L93-F315 HydrophobicContact CD1-CD2 3.52Å; L93-F315 HydrophobicContact CD1-CE2 3.6Å; L93-F315 HydrophobicContact CD1-CG 4.06Å; L93-F315 HydrophobicContact CD1-CZ 4.18Å; L93-F315 HydrophobicContact CD2-CE1 4.32Å; L93-F315 HydrophobicContact CD2-CE2 3.85Å; L93-F315 HydrophobicContact CD2-CZ 3.72Å; L93-F315 HydrophobicContact CG-CE2 4.41Å; F96-F315 HydrophobicContact CE1-CB 4.2Å; L97-F315 HydrophobicContact CD2-CB 3.83Å; L97-F315 HydrophobicContact CD2-CD1 4.37Å; L97-F315 HydrophobicContact CD2-CG 4.23Å; F312-F315 HydrophobicContact CB-CD2 4.27Å; F312-F315 HydrophobicContact CD1-CE2 4.23Å; F312-F315 WeakPolarHBondContact O-CB 3.46Å; F312-F315 WeakPolarHBondContact O-CD2 3.29Å; F312-F315 PolarHBondContact O-N 2.92Å; G313-F315 VanDerWaalsContact C-N 3.27Å; G313-F315 PolarHBondContact O-N 3Å; F315-F318 PolarHBondContact O-N 3.35Å; F315-V319 WeakPolarHBondContact O-CG2 3.5Å; F315-V319 PolarHBondContact O-N 2.65Å; F315-V319 VanDerWaalsContact O-N 3.16Å
316Y96Very high93.8Very high7 Ų725.1 Ų25.13%0.02712%0.122CC..Hα-helixtrans-61.1-49.4173.4-177.6-84.4000111I100 F193 M208 I211 G313 F318 V319 K320I100-Y316 HydrophobicContact CD1-CD2 4.27Å; I100-Y316 HydrophobicContact CG1-CD2 3.99Å; F193-Y316 AromaticContact CE1-CD2 3.93Å; F193-Y316 HydrophobicContact CE1-CD2 3.93Å; F193-Y316 AromaticContact CE1-CE2 4Å; F193-Y316 HydrophobicContact CE1-CE2 4Å; F193-Y316 HydrophobicContact CZ-CD2 4.29Å; M208-Y316 HydrophobicContact CE-CD1 3.92Å; M208-Y316 HydrophobicContact CE-CD2 3.48Å; M208-Y316 VanDerWaalsContact CE-CD2 3.48Å; M208-Y316 HydrophobicContact CE-CE2 4.15Å; M208-Y316 HydrophobicContact CE-CG 3.35Å; M208-Y316 VanDerWaalsContact SD-CB 3.53Å; M208-Y316 HydrophobicContact SD-CD1 4.06Å; M208-Y316 HydrophobicContact SD-CG 3.79Å; I211-Y316 HydrophobicContact CG2-CD1 3.98Å; I211-Y316 HydrophobicContact CG2-CE1 3.38Å; G313-Y316 PolarHBondContact O-N 3.03Å; Y316-F318 VanDerWaalsContact C-N 3.31Å; Y316-F318 PolarHBondContact O-N 2.63Å; Y316-V319 PolarHBondContact O-N 3.27Å; Y316-K320 HydrophobicContact CD1-CG 3.89Å; Y316-K320 HydrophobicContact CE1-CB 4.48Å; Y316-K320 HydrophobicContact CE1-CD 4.38Å; Y316-K320 HydrophobicContact CE1-CG 3.39Å; Y316-K320 HydrophobicContact CE2-CG 4.48Å; Y316-K320 PolarHBondContact O-N 3.03Å; Y316-K320 WeakPolarHBondContact OH-CE 3.27Å
317A95.3Very high93.8Very high0 Ų029.8 Ų29.80%014%0.139CC..Hα-helixtrans-60.2-42.1-179.900000112.1N302 A305 F306 G313 V319 K320 L321N302-A317 HydrophobicContact CB-CB 3.88Å; N302-A317 VanDerWaalsContact O-CB 3.32Å; N302-A317 WeakPolarHBondContact O-CB 3.21Å; N302-A317 WeakPolarHBondContact OD1-CA 3.24Å; A305-A317 HydrophobicContact CB-CB 3.82Å; F306-A317 HydrophobicContact CD2-CB 4.22Å; F306-A317 HydrophobicContact CE2-CB 3.63Å; F306-A317 HydrophobicContact CZ-CB 4.32Å; G313-A317 VanDerWaalsContact O-CB 3.28Å; G313-A317 WeakPolarHBondContact O-CB 3.5Å; G313-A317 PolarHBondContact O-N 3.47Å; A317-V319 PolarHBondContact O-N 3.43Å; A317-K320 PolarHBondContact O-N 2.97Å; A317-L321 WeakPolarHBondContact O-CB 3.45Å; A317-L321 WeakPolarHBondContact O-CG 3.36Å; A317-L321 PolarHBondContact O-N 3.02Å
318F95.4Very high93.9Very high4 Ų423.8 Ų23.82%0.01811%0.108CC..Hα-helixtrans-57.9-49.8175.2175.7-106.7000112.2V20 L23 K24 M85 F306 V314 F315 Y316 K320 L321 K322V20-F318 HydrophobicContact CG2-CB 3.38Å; V20-F318 HydrophobicContact CG2-CD1 3.9Å; V20-F318 HydrophobicContact CG2-CD2 4.08Å; V20-F318 HydrophobicContact CG2-CG 3.51Å; L23-F318 HydrophobicContact CB-CD2 4.31Å; L23-F318 HydrophobicContact CB-CE1 4.35Å; L23-F318 HydrophobicContact CB-CE2 3.46Å; L23-F318 VanDerWaalsContact CB-CE2 3.46Å; L23-F318 HydrophobicContact CB-CZ 3.48Å; L23-F318 VanDerWaalsContact CB-CZ 3.48Å; L23-F318 HydrophobicContact CD1-CE1 4.05Å; L23-F318 HydrophobicContact CD1-CZ 3.88Å; L23-F318 HydrophobicContact CG-CZ 4.25Å; K24-F318 HydrophobicContact CB-CD2 4.35Å; M85-F318 HydrophobicContact CE-CD1 3.95Å; M85-F318 HydrophobicContact CE-CE1 4.03Å; F306-F318 HydrophobicContact CZ-CB 3.99Å; V314-F318 VanDerWaalsContact O-CB 3.23Å; V314-F318 WeakPolarHBondContact O-CB 3.25Å; V314-F318 PolarHBondContact O-N 3.28Å; F315-F318 PolarHBondContact O-N 3.35Å; Y316-F318 VanDerWaalsContact C-N 3.31Å; Y316-F318 PolarHBondContact O-N 2.63Å; F318-K320 PolarHBondContact O-N 3.37Å; F318-L321 PolarHBondContact O-N 3.46Å; F318-K322 HydrophobicContact CD2-CG 4.11Å; F318-K322 HydrophobicContact CE1-CG 4.05Å; F318-K322 HydrophobicContact CE2-CD 4.2Å; F318-K322 HydrophobicContact CE2-CG 3.54Å; F318-K322 HydrophobicContact CZ-CD 4.27Å; F318-K322 HydrophobicContact CZ-CG 3.51Å; F318-K322 WeakPolarHBondContact O-CB 3.44Å; F318-K322 PolarHBondContact O-N 3.5Å
319V95.1Very high94.1Very high2 Ų220 Ų201%0.0129%0.088CC..Hα-helixtrans-58.4-50.8179.6173.70000110.2F82 I100 Y104 F315 Y316 A317 L321 K322 E323F82-V319 HydrophobicContact CD2-CG2 3.61Å; F82-V319 HydrophobicContact CE2-CG2 3.92Å; I100-V319 HydrophobicContact CG2-CG1 4.24Å; Y104-V319 VanDerWaalsContact OH-CG1 3.29Å; Y104-V319 WeakPolarHBondContact OH-CG1 3.32Å; F315-V319 WeakPolarHBondContact O-CG2 3.5Å; F315-V319 PolarHBondContact O-N 2.65Å; F315-V319 VanDerWaalsContact O-N 3.16Å; Y316-V319 PolarHBondContact O-N 3.27Å; A317-V319 PolarHBondContact O-N 3.43Å; V319-L321 PolarHBondContact O-N 3.47Å; V319-K322 PolarHBondContact O-N 3.08Å; V319-E323 WeakPolarHBondContact O-CG 3.32Å; V319-E323 PolarHBondContact O-N 3.16Å
320K94.8Very high94.2Very high32 Ų3215.5 Ų15.514%0.1397%0.068CC..Hα-helixtrans-63.3-38.6-179.9-66.2-49.2-176.6-177.40113.9Y316 A317 F318 E323 Q324Y316-K320 HydrophobicContact CD1-CG 3.89Å; Y316-K320 HydrophobicContact CE1-CB 4.48Å; Y316-K320 HydrophobicContact CE1-CD 4.38Å; Y316-K320 HydrophobicContact CE1-CG 3.39Å; Y316-K320 HydrophobicContact CE2-CG 4.48Å; Y316-K320 PolarHBondContact O-N 3.03Å; Y316-K320 WeakPolarHBondContact OH-CE 3.27Å; A317-K320 PolarHBondContact O-N 2.97Å; F318-K320 PolarHBondContact O-N 3.37Å; K320-E323 WeakPolarHBondContact CD-OE2 3.32Å; K320-E323 IonicContact NZ-OE2 3.9Å; K320-E323 PolarHBondContact NZ-OE2 3.08Å; K320-E323 PolarHBondContact O-N 3.37Å; K320-Q324 PolarHBondContact O-N 3.49Å; K320-Q324 VanDerWaalsContact O-N 3.09Å
321L94.9Very high94.3Very high1 Ų116.9 Ų16.91%0.0057%0.071CC..Hα-helixtrans-67.6-40.5175.1-68-178000111.6V299 N302 K303 F306 A317 F318 V319 Q324 E325 I350 F351V299-L321 HydrophobicContact CB-CD2 4.35Å; V299-L321 HydrophobicContact CG1-CD2 3.96Å; V299-L321 HydrophobicContact CG2-CD2 4.39Å; N302-L321 HydrophobicContact CB-CD1 4.43Å; N302-L321 HydrophobicContact CB-CD2 3.83Å; N302-L321 HydrophobicContact CB-CG 3.91Å; K303-L321 HydrophobicContact CG-CD1 4.33Å; K303-L321 HydrophobicContact CG-CD2 4.36Å; F306-L321 HydrophobicContact CD2-CD1 4.26Å; F306-L321 HydrophobicContact CE2-CD1 3.79Å; A317-L321 WeakPolarHBondContact O-CB 3.45Å; A317-L321 WeakPolarHBondContact O-CG 3.36Å; A317-L321 PolarHBondContact O-N 3.02Å; F318-L321 PolarHBondContact O-N 3.46Å; V319-L321 PolarHBondContact O-N 3.47Å; L321-Q324 PolarHBondContact O-N 3.36Å; L321-E325 PolarHBondContact O-N 2.94Å; L321-I350 HydrophobicContact CB-CG2 4.39Å; L321-I350 HydrophobicContact CD1-CG2 4.16Å; L321-I350 HydrophobicContact CD2-CG2 3.75Å; L321-I350 HydrophobicContact CG-CG2 4.31Å; L321-I350 WeakPolarHBondContact O-CD1 3.49Å; L321-F351 HydrophobicContact CD1-CE2 4.18Å; L321-F351 HydrophobicContact CD1-CZ 3.82Å
322K94.1Very high94.3Very high10 Ų1016.9 Ų16.94%0.0437%0.071CC..Hα-helixtrans-66.1-36.6175.4-79.6-62.2-174.6-178.60112.7G26 V27 M78 F318 V319 E325 C326G26-K322 PolarHBondContact O-NZ 3.17Å; V27-K322 HydrophobicContact CG2-CD 4.2Å; M78-K322 HydrophobicContact CG-CB 4.44Å; M78-K322 HydrophobicContact SD-CB 4.24Å; F318-K322 HydrophobicContact CD2-CG 4.11Å; F318-K322 HydrophobicContact CE1-CG 4.05Å; F318-K322 HydrophobicContact CE2-CD 4.2Å; F318-K322 HydrophobicContact CE2-CG 3.54Å; F318-K322 HydrophobicContact CZ-CD 4.27Å; F318-K322 HydrophobicContact CZ-CG 3.51Å; F318-K322 WeakPolarHBondContact O-CB 3.44Å; F318-K322 PolarHBondContact O-N 3.5Å; V319-K322 PolarHBondContact O-N 3.08Å; K322-E325 WeakPolarHBondContact CD-OE2 3.49Å; K322-E325 WeakPolarHBondContact CE-OE2 2.96Å; K322-E325 IonicContact NZ-OE1 2.73Å; K322-E325 IonicContact NZ-OE2 3.52Å; K322-E325 PolarHBondContact NZ-OE2 3.14Å; K322-E325 WeakPolarHBondContact O-CB 3.32Å; K322-E325 PolarHBondContact O-N 2.98Å; K322-C326 PolarHBondContact O-N 3.38Å; K322-C326 PolarHBondContact O-SG 3.39Å
323E92.6Very high94.2Very high26 Ų2616.3 Ų16.312%0.1217%0.069CC..Hα-helixtrans-60.1-46.4171.5-72-172.1132.700111.9M78 Y104 V319 K320 E325 C326 R327M78-E323 HydrophobicContact CE-CG 4.1Å; M78-E323 HydrophobicContact SD-CG 3.81Å; Y104-E323 WeakPolarHBondContact CE1-OE1 3.42Å; Y104-E323 PolarHBondContact OH-OE1 2.97Å; Y104-E323 PolarHBondContact OH-OE2 3.13Å; V319-E323 WeakPolarHBondContact O-CG 3.32Å; V319-E323 PolarHBondContact O-N 3.16Å; K320-E323 WeakPolarHBondContact CD-OE2 3.32Å; K320-E323 IonicContact NZ-OE2 3.9Å; K320-E323 PolarHBondContact NZ-OE2 3.08Å; K320-E323 PolarHBondContact O-N 3.37Å; E323-E325 VanDerWaalsContact C-N 3.3Å; E323-E325 PolarHBondContact O-N 3.17Å; E323-C326 PolarHBondContact O-N 3.32Å; E323-R327 WeakPolarHBondContact O-CG 3.43Å; E323-R327 PolarHBondContact O-N 3.05Å
324Q94.1Very high94.1Very high14 Ų1419.9 Ų19.97%0.0659%0.085CC..Hα-helixtrans-64.7-37.5178.3-17358.842.200111.8V299 K320 L321 R327 N328 I348 I350V299-Q324 HydrophobicContact CG2-CB 4.2Å; V299-Q324 HydrophobicContact CG2-CG 3.76Å; K320-Q324 PolarHBondContact O-N 3.49Å; K320-Q324 VanDerWaalsContact O-N 3.09Å; L321-Q324 PolarHBondContact O-N 3.36Å; Q324-R327 PolarHBondContact O-N 3.03Å; Q324-N328 PolarHBondContact NE2-OD1 3.39Å; Q324-N328 PolarHBondContact O-N 2.65Å; Q324-N328 PolarHBondContact O-ND2 3.27Å; Q324-N328 PolarHBondContact O-OD1 3.35Å; Q324-I348 HydrophobicContact CG-CB 4.45Å; Q324-I350 HydrophobicContact CB-CD1 4.31Å
325E94.2Very high94Very high0 Ų020.2 Ų20.20%09%0.088CC..Hα-helixtrans-60.5-47173.5179.6-177.1-112.600111.3V27 L28 Y54 L321 K322 E323 R327 N328 I329 I350V27-E325 VanDerWaalsContact CA-OE1 3.25Å; V27-E325 WeakPolarHBondContact CA-OE1 3.5Å; L28-E325 HydrophobicContact CB-CG 4.46Å; L28-E325 WeakPolarHBondContact CB-OE1 2.97Å; L28-E325 HydrophobicContact CD1-CG 4.13Å; L28-E325 HydrophobicContact CG-CG 4.16Å; L28-E325 VanDerWaalsContact CG-OE1 3.28Å; L28-E325 WeakPolarHBondContact CG-OE1 3.09Å; L28-E325 PolarHBondContact N-OE1 3.25Å; Y54-E325 PolarHBondContact OH-OE2 3.42Å; L321-E325 PolarHBondContact O-N 2.94Å; K322-E325 WeakPolarHBondContact CD-OE2 3.49Å; K322-E325 WeakPolarHBondContact CE-OE2 2.96Å; K322-E325 IonicContact NZ-OE1 2.73Å; K322-E325 IonicContact NZ-OE2 3.52Å; K322-E325 PolarHBondContact NZ-OE2 3.14Å; K322-E325 WeakPolarHBondContact O-CB 3.32Å; K322-E325 PolarHBondContact O-N 2.98Å; E323-E325 VanDerWaalsContact C-N 3.3Å; E323-E325 PolarHBondContact O-N 3.17Å; E325-R327 VanDerWaalsContact C-N 3.33Å; E325-R327 PolarHBondContact O-N 3.47Å; E325-N328 WeakPolarHBondContact O-CB 3.36Å; E325-N328 PolarHBondContact O-N 3.05Å; E325-I329 HydrophobicContact CG-CD1 4.03Å; E325-I329 WeakPolarHBondContact O-CG1 3.32Å; E325-I329 PolarHBondContact O-N 2.9Å; E325-I350 HydrophobicContact CB-CD1 3.73Å
326C93.6Very high93.8Very high9 Ų920.6 Ų20.66%0.0619%0.09CC..Hα-helixtrans-58.8-45.5176.6-64.90000111L74 K322 E323 N328 I329 V330L74-C326 HydrophobicContact CB-CB 4.4Å; L74-C326 HydrophobicContact CD1-CB 4.41Å; K322-C326 PolarHBondContact O-N 3.38Å; K322-C326 PolarHBondContact O-SG 3.39Å; E323-C326 PolarHBondContact O-N 3.32Å; C326-N328 VanDerWaalsContact C-N 3.33Å; C326-N328 PolarHBondContact O-N 3.39Å; C326-I329 PolarHBondContact O-N 2.85Å; C326-V330 VanDerWaalsContact O-CG2 3.32Å; C326-V330 WeakPolarHBondContact O-CG2 3.37Å; C326-V330 PolarHBondContact O-N 3.33Å
327R93.2Very high93.5Very high118 Ų11822.9 Ų22.945%0.44511%0.11SC..Hα-helixtrans-58.9-42.6175.7-70.7175.4-173.6-179.90112.3E323 Q324 E325 V330 W331E323-R327 WeakPolarHBondContact O-CG 3.43Å; E323-R327 PolarHBondContact O-N 3.05Å; Q324-R327 PolarHBondContact O-N 3.03Å; E325-R327 VanDerWaalsContact C-N 3.33Å; E325-R327 PolarHBondContact O-N 3.47Å; R327-V330 PolarHBondContact O-N 3.46Å; R327-W331 WeakPolarHBondContact O-CB 3.35Å; R327-W331 PolarHBondContact O-N 3.3Å
328N93.8Very high93.3Very high4 Ų429.6 Ų29.62%0.02114%0.141CC..Hα-helixtrans-63.5-44.1177-67.3-23000111.6Y33 Q324 E325 C326 W331 I332 I348Y33-N328 HydrophobicContact CD1-CB 4.45Å; Y33-N328 HydrophobicContact CE1-CB 3.48Å; Y33-N328 VanDerWaalsContact CE1-CB 3.48Å; Y33-N328 PolarHBondContact OH-ND2 3.36Å; Q324-N328 PolarHBondContact NE2-OD1 3.39Å; Q324-N328 PolarHBondContact O-N 2.65Å; Q324-N328 PolarHBondContact O-ND2 3.27Å; Q324-N328 PolarHBondContact O-OD1 3.35Å; E325-N328 WeakPolarHBondContact O-CB 3.36Å; E325-N328 PolarHBondContact O-N 3.05Å; C326-N328 VanDerWaalsContact C-N 3.33Å; C326-N328 PolarHBondContact O-N 3.39Å; N328-W331 PolarHBondContact O-N 3.33Å; N328-I332 VanDerWaalsContact O-CG1 3.29Å; N328-I332 WeakPolarHBondContact O-CG1 3.32Å; N328-I332 PolarHBondContact O-N 3.04Å; N328-I348 PolarHBondContact ND2-O 3.11Å; N328-I348 PolarHBondContact OD1-N 2.98Å
329I93.6Very high92.9Very high0 Ų040.2 Ų40.20%018%0.181CC..Hα-helixtrans-62.7-45.9178-64.8165.7000110.3L28 L36 L45 L49 Y54 I70 L74 E325 C326 I332 A333L28-I329 HydrophobicContact CD1-CD1 3.77Å; L28-I329 HydrophobicContact CD1-CG1 3.83Å; L36-I329 HydrophobicContact CD1-CG1 4.47Å; L45-I329 HydrophobicContact CD2-CG2 4.48Å; L49-I329 HydrophobicContact CD1-CG2 3.92Å; L49-I329 HydrophobicContact CD2-CD1 4.07Å; L49-I329 HydrophobicContact CD2-CG1 4.44Å; Y54-I329 HydrophobicContact CE2-CD1 3.72Å; I70-I329 HydrophobicContact CG2-CG2 4.22Å; L74-I329 HydrophobicContact CD1-CB 3.97Å; L74-I329 HydrophobicContact CD1-CD1 4.31Å; L74-I329 HydrophobicContact CD1-CG2 3.78Å; L74-I329 HydrophobicContact CD2-CD1 3.93Å; E325-I329 HydrophobicContact CG-CD1 4.03Å; E325-I329 WeakPolarHBondContact O-CG1 3.32Å; E325-I329 PolarHBondContact O-N 2.9Å; C326-I329 PolarHBondContact O-N 2.85Å; I329-I332 PolarHBondContact O-N 3.17Å; I329-A333 WeakPolarHBondContact O-CB 3.44Å; I329-A333 PolarHBondContact O-N 2.95Å
330V93.6Very high92.5Very high20 Ų2045 Ų4512%0.12120%0.203CC..Hα-helixtrans-61.8-45.5177.8171.90000110.7V67 D71 L74 C326 R327 I332 A333 E334V67-V330 HydrophobicContact CG1-CG1 3.91Å; D71-V330 HydrophobicContact CB-CG2 3.76Å; L74-V330 HydrophobicContact CD1-CG2 4.11Å; C326-V330 VanDerWaalsContact O-CG2 3.32Å; C326-V330 WeakPolarHBondContact O-CG2 3.37Å; C326-V330 PolarHBondContact O-N 3.33Å; R327-V330 PolarHBondContact O-N 3.46Å; V330-I332 PolarHBondContact O-N 2.81Å; V330-A333 CarbonylContact O-C 3.6Å; V330-A333 WeakPolarHBondContact O-CB 3.24Å; V330-A333 PolarHBondContact O-N 3.39Å; V330-A333 VanDerWaalsContact O-N 3.15Å; V330-E334 HydrophobicContact CG1-CG 4.38Å; V330-E334 WeakPolarHBondContact O-CG 3.33Å; V330-E334 PolarHBondContact O-N 2.87Å
331W92.5Very high92Very high96 Ų9648.5 Ų48.536%0.36422%0.216SC..Hα-helixtrans-57-46.6176178.3-102.9000112.6R327 N328 A333 E334 C335 K343R327-W331 WeakPolarHBondContact O-CB 3.35Å; R327-W331 PolarHBondContact O-N 3.3Å; N328-W331 PolarHBondContact O-N 3.33Å; W331-A333 VanDerWaalsContact C-N 3.35Å; W331-E334 PolarHBondContact O-N 3.06Å; W331-C335 PolarHBondContact O-N 2.64Å; W331-C335 PolarHBondContact O-SG 3.31Å; W331-K343 HydrophobicContact CZ2-CB 4.11Å; W331-K343 PolarHBondContact NE1-O 3.36Å
332I92.9Very high91.4Very high0 Ų052.4 Ų52.40%025%0.248CC..Hα-helixtrans-63.6-43.6177.1-67.2167.6000110.2Y33 L36 V37 L45 N328 I329 V330 E334 C335 I336 I344 Y347Y33-I332 HydrophobicContact CD1-CD1 3.87Å; Y33-I332 HydrophobicContact CE1-CD1 4.5Å; L36-I332 HydrophobicContact CB-CD1 4.18Å; L36-I332 HydrophobicContact CB-CG2 4.22Å; V37-I332 HydrophobicContact CG2-CD1 4.23Å; L45-I332 HydrophobicContact CD1-CG2 4.07Å; N328-I332 VanDerWaalsContact O-CG1 3.29Å; N328-I332 WeakPolarHBondContact O-CG1 3.32Å; N328-I332 PolarHBondContact O-N 3.04Å; I329-I332 PolarHBondContact O-N 3.17Å; V330-I332 PolarHBondContact O-N 2.81Å; I332-E334 PolarHBondContact O-N 3.49Å; I332-C335 PolarHBondContact O-N 2.93Å; I332-I336 HydrophobicContact CG2-CD1 3.78Å; I332-I336 HydrophobicContact CG2-CG1 4.48Å; I332-I336 VanDerWaalsContact O-CG1 3.29Å; I332-I336 WeakPolarHBondContact O-CG1 3.48Å; I332-I336 PolarHBondContact O-N 3.3Å; I332-I344 HydrophobicContact CG1-CG1 4.49Å; I332-I344 HydrophobicContact CG2-CD1 4.32Å; I332-I344 HydrophobicContact CG2-CG1 4.43Å; I332-Y347 HydrophobicContact CD1-CD1 4.32Å; I332-Y347 HydrophobicContact CD1-CG 4.5Å
333A93.3Very high90.8Very high0 Ų056.4 Ų56.40%027%0.265CS..Hα-helixtrans-61.4-40.717700000112.3L42 L45 V67 I70 I329 V330 W331 I336 A337L42-A333 HydrophobicContact CD2-CB 3.84Å; L45-A333 HydrophobicContact CD1-CB 4.03Å; V67-A333 HydrophobicContact CG1-CB 4.06Å; V67-A333 HydrophobicContact CG2-CB 4.21Å; I70-A333 HydrophobicContact CD1-CB 4.14Å; I329-A333 WeakPolarHBondContact O-CB 3.44Å; I329-A333 PolarHBondContact O-N 2.95Å; V330-A333 CarbonylContact O-C 3.6Å; V330-A333 WeakPolarHBondContact O-CB 3.24Å; V330-A333 PolarHBondContact O-N 3.39Å; V330-A333 VanDerWaalsContact O-N 3.15Å; W331-A333 VanDerWaalsContact C-N 3.35Å; A333-I336 PolarHBondContact O-N 2.9Å; A333-A337 VanDerWaalsContact O-CB 3.28Å; A333-A337 WeakPolarHBondContact O-CB 3.35Å; A333-A337 PolarHBondContact O-N 2.98Å
334E92.7Very high90.4Very high74 Ų7455.4 Ų55.435%0.34626%0.261SS..Hα-helixtrans-63.3-45.8174.3-71.8-177160.700111.9V67 V330 W331 I332 I336 A337 Q338V67-E334 HydrophobicContact CB-CG 4.45Å; V67-E334 HydrophobicContact CG1-CG 3.64Å; V67-E334 HydrophobicContact CG2-CG 4.4Å; V330-E334 HydrophobicContact CG1-CG 4.38Å; V330-E334 WeakPolarHBondContact O-CG 3.33Å; V330-E334 PolarHBondContact O-N 2.87Å; W331-E334 PolarHBondContact O-N 3.06Å; I332-E334 PolarHBondContact O-N 3.49Å; E334-I336 VanDerWaalsContact C-N 3.29Å; E334-I336 PolarHBondContact O-N 3.48Å; E334-A337 PolarHBondContact O-N 3.21Å; E334-Q338 WeakPolarHBondContact O-CB 3.41Å; E334-Q338 WeakPolarHBondContact O-CG 3.42Å; E334-Q338 PolarHBondContact O-N 3.29Å
335C92.2Very high89.9Confident8 Ų859.7 Ų59.75%0.05428%0.284CS..Hα-helixtrans-59.2-41.2176.9-69.30000111.9W331 I332 R339 H340 I344W331-C335 PolarHBondContact O-N 2.64Å; W331-C335 PolarHBondContact O-SG 3.31Å; I332-C335 PolarHBondContact O-N 2.93Å; C335-R339 PolarHBondContact O-N 3.17Å; C335-R339 VanDerWaalsContact O-N 3.16Å; C335-H340 WeakPolarHBondContact CB-O 2.87Å; C335-H340 PolarHBondContact O-N 3.13Å; C335-I344 HydrophobicContact CB-CB 4.11Å; C335-I344 HydrophobicContact CB-CD1 3.95Å; C335-I344 HydrophobicContact CB-CG1 3.78Å
336I91.5Very high89.4Confident8 Ų863.6 Ų63.64%0.04131%0.305CS..Hα-helixtrans-66.9-49.7176.4-68.3165.5000110.5C39 L42 L45 I332 A333 E334 Q338 R339 I344C39-I336 HydrophobicContact CB-CD1 3.75Å; L42-I336 HydrophobicContact CD2-CB 4.43Å; L42-I336 HydrophobicContact CD2-CG2 4.26Å; L45-I336 HydrophobicContact CB-CD1 4.48Å; L45-I336 HydrophobicContact CD1-CD1 3.79Å; I332-I336 HydrophobicContact CG2-CD1 3.78Å; I332-I336 HydrophobicContact CG2-CG1 4.48Å; I332-I336 VanDerWaalsContact O-CG1 3.29Å; I332-I336 WeakPolarHBondContact O-CG1 3.48Å; I332-I336 PolarHBondContact O-N 3.3Å; A333-I336 PolarHBondContact O-N 2.9Å; E334-I336 VanDerWaalsContact C-N 3.29Å; E334-I336 PolarHBondContact O-N 3.48Å; I336-Q338 PolarHBondContact O-N 3.49Å; I336-R339 PolarHBondContact O-N 3.17Å; I336-R339 VanDerWaalsContact O-N 3.11Å; I336-I344 HydrophobicContact CG1-CD1 4.25Å
337A90.8Very high89Confident55 Ų5564.2 Ų64.246%0.45531%0.306SS..Hα-helixtrans-62.3-40.4-177.600000112.7L42 V67 A333 E334 R339L42-A337 HydrophobicContact CD1-CB 4.31Å; V67-A337 HydrophobicContact CG2-CB 3.83Å; A333-A337 VanDerWaalsContact O-CB 3.28Å; A333-A337 WeakPolarHBondContact O-CB 3.35Å; A333-A337 PolarHBondContact O-N 2.98Å; E334-A337 PolarHBondContact O-N 3.21Å; A337-R339 VanDerWaalsContact C-N 3.29Å
338Q90.9Very high88.7Confident140 Ų14059.2 Ų59.265%0.65429%0.288SS*.THydrogen-bonded Turntrans-82.2-5.4178.1-63.4179.516.600113.4E334 I336 H340E334-Q338 WeakPolarHBondContact O-CB 3.41Å; E334-Q338 WeakPolarHBondContact O-CG 3.42Å; E334-Q338 PolarHBondContact O-N 3.29Å; I336-Q338 PolarHBondContact O-N 3.49Å; Q338-H340 HydrophobicContact CB-CB 4.37Å; Q338-H340 PolarHBondContact O-N 3.37Å
339R87.1Confident88.1Confident228 Ų22862 Ų6286%0.8631%0.306SS*.THydrogen-bonded Turntrans55.127.9-172.4-54.8-178.7177.4-172.7-2.5113.2C335 I336 A337C335-R339 PolarHBondContact O-N 3.17Å; C335-R339 VanDerWaalsContact O-N 3.16Å; I336-R339 PolarHBondContact O-N 3.17Å; I336-R339 VanDerWaalsContact O-N 3.11Å; A337-R339 VanDerWaalsContact C-N 3.29Å
340H86.2Confident87.7Confident102 Ų10262 Ų6247%0.47231%0.307SS..  trans-108.190.8179.8-170.964.3000110.3C335 Q338C335-H340 WeakPolarHBondContact CB-O 2.87Å; C335-H340 PolarHBondContact O-N 3.13Å; Q338-H340 HydrophobicContact CB-CB 4.37Å; Q338-H340 PolarHBondContact O-N 3.37Å
341R84Confident87.2Confident106 Ų10665.3 Ų65.340%0.432%0.319SS..  trans-91.2-1.2-174.5-60.9-171.2-179.6-141.2-4.7115C39 K343 I344C39-R341 PolarHBondContact O-NH2 2.9Å; R341-K343 PolarHBondContact O-N 3.19Å; R341-K343 VanDerWaalsContact O-N 3.11Å; R341-I344 HydrophobicContact CB-CG2 4.41Å; R341-I344 VanDerWaalsContact O-CG2 3.32Å; R341-I344 WeakPolarHBondContact O-CG2 3.24Å; R341-I344 PolarHBondContact O-N 3.02Å
342A82.6Confident87Confident83 Ų8363.8 Ų63.869%0.68632%0.317SS*.THydrogen-bonded Turntrans-61.9-25.3-172.200000113.8
343K81.7Confident86.7Confident93 Ų9367.1 Ų67.140%0.40433%0.334SS..THydrogen-bonded Turntrans-124.520.9-179.4-64.2-173.7177-174.40112.8W331 R341 D345 N346W331-K343 HydrophobicContact CZ2-CB 4.11Å; W331-K343 PolarHBondContact NE1-O 3.36Å; R341-K343 PolarHBondContact O-N 3.19Å; R341-K343 VanDerWaalsContact O-N 3.11Å; K343-D345 PolarHBondContact O-N 3.24Å; K343-N346 HydrophobicContact CB-CB 4.48Å; K343-N346 VanDerWaalsContact O-CB 3.32Å; K343-N346 WeakPolarHBondContact O-CB 3.22Å; K343-N346 PolarHBondContact O-N 3.38Å; K343-N346 VanDerWaalsContact O-N 3.09Å
344I83.6Confident86.3Confident6 Ų670.8 Ų70.83%0.03135%0.352CS..THydrogen-bonded Turntrans-63.3-29.6-177.8-162.1166.3000111.7V37 I332 C335 I336 R341 N346 Y347V37-I344 HydrophobicContact CG1-CD1 4.2Å; V37-I344 HydrophobicContact CG1-CG1 4.26Å; V37-I344 HydrophobicContact CG1-CG2 3.67Å; V37-I344 HydrophobicContact CG2-CG1 4.27Å; I332-I344 HydrophobicContact CG1-CG1 4.49Å; I332-I344 HydrophobicContact CG2-CD1 4.32Å; I332-I344 HydrophobicContact CG2-CG1 4.43Å; C335-I344 HydrophobicContact CB-CB 4.11Å; C335-I344 HydrophobicContact CB-CD1 3.95Å; C335-I344 HydrophobicContact CB-CG1 3.78Å; I336-I344 HydrophobicContact CG1-CD1 4.25Å; R341-I344 HydrophobicContact CB-CG2 4.41Å; R341-I344 VanDerWaalsContact O-CG2 3.32Å; R341-I344 WeakPolarHBondContact O-CG2 3.24Å; R341-I344 PolarHBondContact O-N 3.02Å; I344-N346 PolarHBondContact O-N 2.7Å; I344-Y347 WeakPolarHBondContact O-CD1 3.41Å
345D83.7Confident85.9Confident104 Ų10470.6 Ų70.656%0.55635%0.353SS*.THydrogen-bonded Turntrans-78.4-0.7178.1-59.7-45.6000114K343 Y347K343-D345 PolarHBondContact O-N 3.24Å; D345-Y347 PolarHBondContact O-N 2.73Å; D345-Y347 VanDerWaalsContact O-N 3.14Å
346N83.6Confident85.5Confident81 Ų8174.6 Ų74.643%0.43337%0.371SS..  trans-78.514.6180-736.7000113.8K343 I344K343-N346 HydrophobicContact CB-CB 4.48Å; K343-N346 VanDerWaalsContact O-CB 3.32Å; K343-N346 WeakPolarHBondContact O-CB 3.22Å; K343-N346 PolarHBondContact O-N 3.38Å; K343-N346 VanDerWaalsContact O-N 3.09Å; I344-N346 PolarHBondContact O-N 2.7Å
347Y85.3Confident85.1Confident22 Ų2279 Ų799%0.08639%0.394CS..SBendtrans-70.8156.8171.866.5-89.2000111Y33 V37 I332 I344 D345 P349Y33-Y347 VanDerWaalsContact CB-CE2 3.47Å; Y33-Y347 AromaticContact CD1-CD2 3.89Å; Y33-Y347 HydrophobicContact CD1-CD2 3.89Å; Y33-Y347 AromaticContact CD1-CE2 3.99Å; Y33-Y347 HydrophobicContact CD1-CE2 3.99Å; Y33-Y347 HydrophobicContact CD1-CG 4.43Å; Y33-Y347 HydrophobicContact CD2-CD2 4.36Å; Y33-Y347 AromaticContact CD2-CE2 3.97Å; Y33-Y347 HydrophobicContact CD2-CE2 3.97Å; Y33-Y347 HydrophobicContact CE1-CD2 4.33Å; Y33-Y347 AromaticContact CG-CD2 3.91Å; Y33-Y347 HydrophobicContact CG-CD2 3.91Å; Y33-Y347 AromaticContact CG-CE2 3.54Å; Y33-Y347 HydrophobicContact CG-CE2 3.54Å; V37-Y347 HydrophobicContact CG2-CD1 4.36Å; V37-Y347 HydrophobicContact CG2-CE1 3.85Å; I332-Y347 HydrophobicContact CD1-CD1 4.32Å; I332-Y347 HydrophobicContact CD1-CG 4.5Å; I344-Y347 WeakPolarHBondContact O-CD1 3.41Å; D345-Y347 PolarHBondContact O-N 2.73Å; D345-Y347 VanDerWaalsContact O-N 3.14Å; Y347-P349 HydrophobicContact CE2-CB 4.14Å; Y347-P349 VanDerWaalsContact O-CD 3.24Å; Y347-P349 WeakPolarHBondContact O-CD 3.32Å
348I86.1Confident84.7Confident13 Ų1380.7 Ų80.77%0.06739%0.389CS..  trans-99.3102-179.8-60.4175.9000108.5F295 E296 V299 Q324 N328 I350F295-I348 HydrophobicContact CB-CD1 3.37Å; F295-I348 HydrophobicContact CD2-CD1 4.46Å; F295-I348 HydrophobicContact CG-CD1 4.36Å; E296-I348 HydrophobicContact CG-CD1 4.35Å; E296-I348 HydrophobicContact CG-CG1 4.42Å; E296-I348 HydrophobicContact CG-CG2 4.02Å; V299-I348 HydrophobicContact CG2-CG2 4.1Å; Q324-I348 HydrophobicContact CG-CB 4.45Å; N328-I348 PolarHBondContact ND2-O 3.11Å; N328-I348 PolarHBondContact OD1-N 2.98Å; I348-I350 PolarHBondContact O-N 3.07Å
349P81.5Confident84.2Confident62 Ų6276.2 Ų76.240%0.40337%0.369SS..  trans-64.5134.8-17826-33.9000111Y347Y347-P349 HydrophobicContact CE2-CB 4.14Å; Y347-P349 VanDerWaalsContact O-CD 3.24Å; Y347-P349 WeakPolarHBondContact O-CD 3.32Å
350I86.1Confident84Confident1 Ų163.5 Ų63.51%0.00533%0.328CS..  trans-89.5-62.1-179.5-58.2167.8000110.7V27 V299 K303 L321 Q324 E325 I348V27-I350 HydrophobicContact CG1-CB 4.2Å; V27-I350 HydrophobicContact CG1-CD1 3.95Å; V27-I350 HydrophobicContact CG1-CG2 4.12Å; V299-I350 HydrophobicContact CG1-CB 4.49Å; V299-I350 HydrophobicContact CG1-CG1 4.35Å; V299-I350 HydrophobicContact CG1-CG2 4.29Å; K303-I350 WeakPolarHBondContact CD-O 3.5Å; K303-I350 WeakPolarHBondContact CE-O 3.28Å; K303-I350 HydrophobicContact CG-CG2 4.42Å; K303-I350 PolarHBondContact NZ-O 3.35Å; L321-I350 HydrophobicContact CB-CG2 4.39Å; L321-I350 HydrophobicContact CD1-CG2 4.16Å; L321-I350 HydrophobicContact CD2-CG2 3.75Å; L321-I350 HydrophobicContact CG-CG2 4.31Å; L321-I350 WeakPolarHBondContact O-CD1 3.49Å; Q324-I350 HydrophobicContact CB-CD1 4.31Å; E325-I350 HydrophobicContact CB-CD1 3.73Å; I348-I350 PolarHBondContact O-N 3.07Å
351F83.8Confident83.8Confident89 Ų8960 Ų6039%0.3932%0.315SS..  trans-112.30-176.1-70.6-66.4000114.1K24 V27 Q30 K303 L321K24-F351 HydrophobicContact CD-CZ 4.29Å; K24-F351 VanDerWaalsContact CE-CE1 3.48Å; K24-F351 HydrophobicContact CG-CE2 4.26Å; K24-F351 HydrophobicContact CG-CZ 4.15Å; V27-F351 HydrophobicContact CB-CD2 3.81Å; V27-F351 HydrophobicContact CB-CE2 3.87Å; V27-F351 HydrophobicContact CG1-CD2 3.63Å; V27-F351 HydrophobicContact CG1-CE2 3.83Å; V27-F351 HydrophobicContact CG2-CE2 4.17Å; Q30-F351 PolarHBondContact N-O 3.23Å; K303-F351 HydrophobicContact CD-CE1 4.47Å; K303-F351 HydrophobicContact CG-CE1 3.93Å; K303-F351 HydrophobicContact CG-CZ 4.26Å; L321-F351 HydrophobicContact CD1-CE2 4.18Å; L321-F351 HydrophobicContact CD1-CZ 3.82Å

Retrieved 351 of 351 residues in 93.3 ms (Link to these results)