G4VRR8_SCHMA Loading...

Putative syntaxin-31 (AtSYP31) (AtSED5)

AlphaFold DB , UniProt , Accession G4VRR8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 384 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M44.5Very low75.8Confident243 Ų243131.5 Ų131.5100%1.19771%0.705SS**  091.60-85.6-162.2-97.800109.1G3M1-G3 VanDerWaalsContact C-N 3.33Å; M1-G3 PolarHBondContact O-N 2.94Å
2I53.1Low77.2Confident181 Ų181134.4 Ų134.493%0.92870%0.699SS**  trans-9579.8164.7-62.7163.7000104.4
3G60.1Low78.3Confident44 Ų44128.3 Ų128.345%0.45468%0.68SS.*  trans-72.7139.8173.300000108.9M1 F5M1-G3 VanDerWaalsContact C-N 3.33Å; M1-G3 PolarHBondContact O-N 2.94Å; G3-F5 VanDerWaalsContact C-N 3.3Å; G3-F5 WeakPolarHBondContact O-CD2 3.23Å; G3-F5 PolarHBondContact O-N 3.36Å
4A69.6Low79.2Confident112 Ų112125.1 Ų125.193%0.92667%0.671SS**  trans-60.896.6166.300000108
5F77.4Confident80Confident175 Ų175120.3 Ų120.377%0.76865%0.649SS**  trans-67.6137172.4-81.5-85.3000109G3 R7G3-F5 VanDerWaalsContact C-N 3.3Å; G3-F5 WeakPolarHBondContact O-CD2 3.23Å; G3-F5 PolarHBondContact O-N 3.36Å; F5-R7 PolarHBondContact O-N 2.95Å
6D83.2Confident80.7Confident130 Ų130120.8 Ų120.870%0.69565%0.646SS**  trans-64.9102.1172.1-179.313.4000109.9T8D6-T8 VanDerWaalsContact C-N 3.29Å; D6-T8 WeakPolarHBondContact OD1-CB 3.37Å; D6-T8 PolarHBondContact OD1-N 3.4Å; D6-T8 PolarHBondContact OD1-OG1 3.42Å
7R86.7Confident81.2Confident177 Ų177116.4 Ų116.467%0.66863%0.627SS**  trans-89.99.8175.7-60.2-170.5-171.9-171.50.8112.7F5 G9 E10 F11F5-R7 PolarHBondContact O-N 2.95Å; R7-G9 PolarHBondContact O-N 3.34Å; R7-E10 PolarHBondContact O-N 2.97Å; R7-F11 PolarHBondContact O-N 3.19Å
8T89.1Confident81.6Confident68 Ų68114.7 Ų114.742%0.41762%0.617SS.*Hα-helixtrans-59-33.7177.8-55.20000111.2D6 F11 R12D6-T8 VanDerWaalsContact C-N 3.29Å; D6-T8 WeakPolarHBondContact OD1-CB 3.37Å; D6-T8 PolarHBondContact OD1-N 3.4Å; D6-T8 PolarHBondContact OD1-OG1 3.42Å; T8-F11 PolarHBondContact O-N 3.33Å; T8-R12 WeakPolarHBondContact O-CG 3.43Å; T8-R12 PolarHBondContact O-N 3.48Å
9G89.3Confident82Confident47 Ų47114.1 Ų114.149%0.48561%0.609SS.*Hα-helixtrans-63.2-48.8174.300000113.4R7 F11 R12 A13R7-G9 PolarHBondContact O-N 3.34Å; G9-F11 VanDerWaalsContact C-N 3.31Å; G9-F11 PolarHBondContact O-N 3.48Å; G9-R12 PolarHBondContact O-N 2.96Å; G9-A13 PolarHBondContact O-N 3.4Å
10E90.2Very high82.4Confident132 Ų132113.3 Ų113.362%0.61761%0.605SS**Hα-helixtrans-61.2-40.8176-64.9179.8-171.900111.4R7 A13 C14R7-E10 PolarHBondContact O-N 2.97Å; E10-A13 PolarHBondContact O-N 3.3Å; E10-C14 VanDerWaalsContact O-CB 3.3Å; E10-C14 WeakPolarHBondContact O-CB 3.29Å; E10-C14 PolarHBondContact O-N 2.76Å
11F91.1Very high82.7Confident138 Ų138114.5 Ų114.561%0.60560%0.601SS**Hα-helixtrans-62.5-44.1175177.6-100.2000112R7 T8 G9 C14 T15R7-F11 PolarHBondContact O-N 3.19Å; T8-F11 PolarHBondContact O-N 3.33Å; G9-F11 VanDerWaalsContact C-N 3.31Å; G9-F11 PolarHBondContact O-N 3.48Å; F11-C14 PolarHBondContact O-N 3.24Å; F11-T15 HydrophobicContact CD1-CG2 4.28Å; F11-T15 HydrophobicContact CD2-CG2 4.37Å; F11-T15 HydrophobicContact CE1-CG2 3.81Å; F11-T15 HydrophobicContact CE2-CG2 3.92Å; F11-T15 HydrophobicContact CZ-CG2 3.62Å; F11-T15 WeakPolarHBondContact O-CG2 3.41Å; F11-T15 PolarHBondContact O-N 3.03Å; F11-T15 PolarHBondContact O-OG1 3.36Å
12R92.5Very high84.6Confident166 Ų166106.4 Ų106.463%0.62656%0.562SS**Hα-helixtrans-61.8-43.5174.9-76.3-179.3-170.4-99.23.4111.9T8 G9 C14 T15 Q16T8-R12 WeakPolarHBondContact O-CG 3.43Å; T8-R12 PolarHBondContact O-N 3.48Å; G9-R12 PolarHBondContact O-N 2.96Å; R12-C14 PolarHBondContact O-N 2.94Å; R12-T15 WeakPolarHBondContact CA-OG1 3.34Å; R12-T15 PolarHBondContact O-N 2.9Å; R12-T15 PolarHBondContact O-OG1 3.19Å; R12-Q16 WeakPolarHBondContact O-CB 3.18Å; R12-Q16 VanDerWaalsContact O-CG 3.3Å; R12-Q16 WeakPolarHBondContact O-CG 3.3Å; R12-Q16 PolarHBondContact O-N 3.24Å
13A91.2Very high86.2Confident55 Ų55103.7 Ų103.746%0.45555%0.549SS..Hα-helixtrans-64.5-40176.400000112.3G9 E10 Q16 S17G9-A13 PolarHBondContact O-N 3.4Å; E10-A13 PolarHBondContact O-N 3.3Å; A13-Q16 PolarHBondContact O-N 3.48Å; A13-S17 WeakPolarHBondContact O-CB 3.34Å; A13-S17 PolarHBondContact O-N 3.22Å
14C91.3Very high87.5Confident83 Ų83104.9 Ų104.956%0.56155%0.55SS**Hα-helixtrans-65.1-44.5176.2-174.90000112E10 F11 R12 S17 L18E10-C14 VanDerWaalsContact O-CB 3.3Å; E10-C14 WeakPolarHBondContact O-CB 3.29Å; E10-C14 PolarHBondContact O-N 2.76Å; F11-C14 PolarHBondContact O-N 3.24Å; R12-C14 PolarHBondContact O-N 2.94Å; C14-S17 PolarHBondContact O-N 2.95Å; C14-L18 WeakPolarHBondContact O-CB 3.47Å; C14-L18 PolarHBondContact O-N 3.32Å
15T90.1Very high87.9Confident54 Ų54101.8 Ų101.833%0.33153%0.529SS..Hα-helixtrans-65.7-38.2176.649.50000112.3F11 R12 L18 H19F11-T15 HydrophobicContact CD1-CG2 4.28Å; F11-T15 HydrophobicContact CD2-CG2 4.37Å; F11-T15 HydrophobicContact CE1-CG2 3.81Å; F11-T15 HydrophobicContact CE2-CG2 3.92Å; F11-T15 HydrophobicContact CZ-CG2 3.62Å; F11-T15 WeakPolarHBondContact O-CG2 3.41Å; F11-T15 PolarHBondContact O-N 3.03Å; F11-T15 PolarHBondContact O-OG1 3.36Å; R12-T15 WeakPolarHBondContact CA-OG1 3.34Å; R12-T15 PolarHBondContact O-N 2.9Å; R12-T15 PolarHBondContact O-OG1 3.19Å; T15-L18 PolarHBondContact O-N 2.77Å; T15-H19 WeakPolarHBondContact O-CB 3.25Å; T15-H19 PolarHBondContact O-N 2.94Å
16Q91.4Very high87.8Confident128 Ų128103.9 Ų103.960%0.59853%0.532SS*.Hα-helixtrans-61.4-48.1170.6-75.4173.8-1500111.3R12 A13 L18 H19 D20R12-Q16 WeakPolarHBondContact O-CB 3.18Å; R12-Q16 VanDerWaalsContact O-CG 3.3Å; R12-Q16 WeakPolarHBondContact O-CG 3.3Å; R12-Q16 PolarHBondContact O-N 3.24Å; A13-Q16 PolarHBondContact O-N 3.48Å; Q16-L18 VanDerWaalsContact C-N 3.29Å; Q16-L18 PolarHBondContact O-N 2.89Å; Q16-H19 WeakPolarHBondContact O-CB 3.46Å; Q16-H19 PolarHBondContact O-N 2.92Å; Q16-H19 VanDerWaalsContact O-N 3.12Å; Q16-D20 PolarHBondContact O-N 2.84Å
17S90.4Very high87.3Confident46 Ų46100.2 Ų100.232%0.32251%0.512SS..Hα-helixtrans-60.4-37.7176-171.80000112.6A13 C14 R21A13-S17 WeakPolarHBondContact O-CB 3.34Å; A13-S17 PolarHBondContact O-N 3.22Å; C14-S17 PolarHBondContact O-N 2.95Å; S17-R21 WeakPolarHBondContact O-CB 3.47Å; S17-R21 WeakPolarHBondContact O-CG 3.48Å; S17-R21 PolarHBondContact O-N 3.07Å; S17-R21 PolarHBondContact OG-NE 3.43Å
18L87.9Confident86.6Confident86 Ų86102.9 Ų102.945%0.4552%0.523SS..Hα-helixtrans-65-43.7174.6-174.871.8000111.5C14 T15 Q16 R21 L22 L27C14-L18 WeakPolarHBondContact O-CB 3.47Å; C14-L18 PolarHBondContact O-N 3.32Å; T15-L18 PolarHBondContact O-N 2.77Å; Q16-L18 VanDerWaalsContact C-N 3.29Å; Q16-L18 PolarHBondContact O-N 2.89Å; L18-R21 PolarHBondContact O-N 3.05Å; L18-L22 PolarHBondContact O-N 2.98Å; L18-L27 HydrophobicContact CD1-CD2 3.35Å; L18-L27 HydrophobicContact CG-CD2 4.24Å
19H89Confident85.7Confident102 Ų102105 Ų10547%0.47253%0.531SS..Hα-helixtrans-62.3-45.3176.5-172.176000111.3T15 Q16 R21 L22 L23T15-H19 WeakPolarHBondContact O-CB 3.25Å; T15-H19 PolarHBondContact O-N 2.94Å; Q16-H19 WeakPolarHBondContact O-CB 3.46Å; Q16-H19 PolarHBondContact O-N 2.92Å; Q16-H19 VanDerWaalsContact O-N 3.12Å; H19-R21 VanDerWaalsContact C-N 3.31Å; H19-R21 PolarHBondContact O-N 2.94Å; H19-L22 WeakPolarHBondContact O-CA 3.32Å; H19-L22 VanDerWaalsContact O-CB 3.31Å; H19-L22 WeakPolarHBondContact O-CB 3.25Å; H19-L22 PolarHBondContact O-N 3.44Å; H19-L22 VanDerWaalsContact O-N 3.07Å; H19-L23 WeakPolarHBondContact NE2-CD1 3.45Å; H19-L23 WeakPolarHBondContact O-CG 3.39Å; H19-L23 PolarHBondContact O-N 3.43Å
20D89.8Confident84.6Confident98 Ų98111 Ų11152%0.52454%0.543SS..Hα-helixtrans-62.3-37.2175.8-68.3-20.4000112.1Q16 L22 L23 S24Q16-D20 PolarHBondContact O-N 2.84Å; D20-L22 VanDerWaalsContact C-N 3.33Å; D20-L23 PolarHBondContact O-N 2.93Å; D20-S24 VanDerWaalsContact O-CB 3.24Å; D20-S24 WeakPolarHBondContact O-CB 3.34Å; D20-S24 PolarHBondContact O-N 2.92Å; D20-S24 PolarHBondContact O-OG 3.26Å
21R88.9Confident83.3Confident140 Ų140109.7 Ų109.753%0.52855%0.546SS..Hα-helixtrans-66.8-34.7173.7-73171-164.1-1664.2112.4S17 L18 H19 S24 G25 R26 L27S17-R21 WeakPolarHBondContact O-CB 3.47Å; S17-R21 WeakPolarHBondContact O-CG 3.48Å; S17-R21 PolarHBondContact O-N 3.07Å; S17-R21 PolarHBondContact OG-NE 3.43Å; L18-R21 PolarHBondContact O-N 3.05Å; H19-R21 VanDerWaalsContact C-N 3.31Å; H19-R21 PolarHBondContact O-N 2.94Å; R21-S24 WeakPolarHBondContact CA-OG 3.06Å; R21-S24 PolarHBondContact O-OG 3.24Å; R21-G25 PolarHBondContact O-N 2.77Å; R21-R26 PolarHBondContact O-N 3.28Å; R21-L27 HydrophobicContact CB-CB 4.04Å; R21-L27 PolarHBondContact O-N 3.5Å
22L85.2Confident81.8Confident73 Ų73108.9 Ų108.938%0.38256%0.555SS.*Hα-helixtrans-67.8-49.3174.8-166.982.5000110.5L18 H19 D20 S24 G25 L29L18-L22 PolarHBondContact O-N 2.98Å; H19-L22 WeakPolarHBondContact O-CA 3.32Å; H19-L22 VanDerWaalsContact O-CB 3.31Å; H19-L22 WeakPolarHBondContact O-CB 3.25Å; H19-L22 PolarHBondContact O-N 3.44Å; H19-L22 VanDerWaalsContact O-N 3.07Å; D20-L22 VanDerWaalsContact C-N 3.33Å; L22-S24 PolarHBondContact O-N 3.13Å; L22-G25 PolarHBondContact O-N 3.39Å; L22-G25 VanDerWaalsContact O-N 3.12Å; L22-L29 HydrophobicContact CD1-CB 4.11Å; L22-L29 HydrophobicContact CD1-CD1 3.7Å; L22-L29 HydrophobicContact CD1-CG 3.7Å
23L86Confident80Confident123 Ų123106.7 Ų106.764%0.64455%0.552SS**Hα-helixtrans-64.6-38.4179.5-69.2-179.9000112.6H19 D20 G25H19-L23 WeakPolarHBondContact NE2-CD1 3.45Å; H19-L23 WeakPolarHBondContact O-CG 3.39Å; H19-L23 PolarHBondContact O-N 3.43Å; D20-L23 PolarHBondContact O-N 2.93Å; L23-G25 PolarHBondContact O-N 3.16Å
24S86.2Confident78.1Confident69 Ų69110.4 Ų110.448%0.48357%0.571SS.*THydrogen-bonded Turntrans-75.20.1175.959.90000114D20 R21 L22 R26D20-S24 VanDerWaalsContact O-CB 3.24Å; D20-S24 WeakPolarHBondContact O-CB 3.34Å; D20-S24 PolarHBondContact O-N 2.92Å; D20-S24 PolarHBondContact O-OG 3.26Å; R21-S24 WeakPolarHBondContact CA-OG 3.06Å; R21-S24 PolarHBondContact O-OG 3.24Å; L22-S24 PolarHBondContact O-N 3.13Å; S24-R26 PolarHBondContact O-N 3.39Å; S24-R26 VanDerWaalsContact O-N 3.12Å
25G79.2Confident76.3Confident47 Ų47113.1 Ų113.149%0.48557%0.573SS.*THydrogen-bonded Turntrans69.44-179.300000114.7R21 L22 L23 L27R21-G25 PolarHBondContact O-N 2.77Å; L22-G25 PolarHBondContact O-N 3.39Å; L22-G25 VanDerWaalsContact O-N 3.12Å; L23-G25 PolarHBondContact O-N 3.16Å; G25-L27 PolarHBondContact O-N 3.07Å
26R75.4Confident74.3Confident219 Ų219119 Ų11983%0.82659%0.59SS**SBendtrans-71.8-18.4176.3-67-176.7179.8-172.21.6112.4R21 S24R21-R26 PolarHBondContact O-N 3.28Å; S24-R26 PolarHBondContact O-N 3.39Å; S24-R26 VanDerWaalsContact O-N 3.12Å
27L72.5Confident72Confident54 Ų54121 Ų12128%0.28361%0.605SS.*  trans-124.6120.4171.7-176.167.5000109.4L18 R21 G25 L29L18-L27 HydrophobicContact CD1-CD2 3.35Å; L18-L27 HydrophobicContact CG-CD2 4.24Å; R21-L27 HydrophobicContact CB-CB 4.04Å; R21-L27 PolarHBondContact O-N 3.5Å; G25-L27 PolarHBondContact O-N 3.07Å; L27-L29 HydrophobicContact CD2-CD2 4.02Å; L27-L29 HydrophobicContact CD2-CG 4.15Å; L27-L29 HydrophobicContact CG-CD2 4.26Å; L27-L29 HydrophobicContact CG-CG 4.3Å
28R72.1Confident70.1Confident233 Ų233122.6 Ų122.688%0.87961%0.607SS**  trans-102.998.3167.5-71.9-175.1172.2175.4-2.6108.3K30R28-K30 PolarHBondContact O-N 3.02Å
29L69.2Low68.3Low112 Ų112122.6 Ų122.659%0.58661%0.614SS**PPolyproline II helixtrans-67.4121.6165.6-66.5177.1000107.1L22 L27L22-L29 HydrophobicContact CD1-CB 4.11Å; L22-L29 HydrophobicContact CD1-CD1 3.7Å; L22-L29 HydrophobicContact CD1-CG 3.7Å; L27-L29 HydrophobicContact CD2-CD2 4.02Å; L27-L29 HydrophobicContact CD2-CG 4.15Å; L27-L29 HydrophobicContact CG-CD2 4.26Å; L27-L29 HydrophobicContact CG-CG 4.3Å
30K67.9Low66.6Low173 Ų173120.3 Ų120.375%0.75261%0.613SS**PPolyproline II helixtrans-59.1130.5168-139.3173.4-174.3-179.80105.8R28R28-K30 PolarHBondContact O-N 3.02Å
31P62.2Low65.1Low104 Ų104116.9 Ų116.968%0.67559%0.594SS**PPolyproline II helixtrans-52.2138.4175.921-31.2000108H33P31-H33 PolarHBondContact O-N 3.03Å
32P58.6Low64.3Low121 Ų121115.3 Ų115.379%0.78660%0.597SS**PPolyproline II helixtrans-52.3123172.622.2-30000106.1P34P32-P34 WeakPolarHBondContact O-CD 3.36Å; P32-P34 VanDerWaalsContact O-N 3.12Å
33H54.4Low64.1Low121 Ų121115 Ų11556%0.5660%0.598SS**PPolyproline II helixtrans-52126.8172-85-69.7000106.3P31 K35P31-H33 PolarHBondContact O-N 3.03Å; H33-K35 HydrophobicContact CB-CB 4.37Å; H33-K35 HydrophobicContact CB-CD 3.98Å; H33-K35 HydrophobicContact CB-CG 3.93Å; H33-K35 PolarHBondContact O-N 3.1Å
34P52.3Low64Low133 Ų133113.3 Ų113.386%0.86458%0.583SS**  trans-69.672.9169.229.3-32.4000106.8P32P32-P34 WeakPolarHBondContact O-CD 3.36Å; P32-P34 VanDerWaalsContact O-N 3.12Å
35K52.5Low63.9Low140 Ų140110.3 Ų110.361%0.60956%0.562SS**  trans-101.6105.6175-85.4178.8-178.2-170.30105.4H33H33-K35 HydrophobicContact CB-CB 4.37Å; H33-K35 HydrophobicContact CB-CD 3.98Å; H33-K35 HydrophobicContact CB-CG 3.93Å; H33-K35 PolarHBondContact O-N 3.1Å
36Y49Very low64.2Low176 Ų176110.3 Ų110.369%0.6956%0.557SS**  trans83.265166.2-46.5-62.6000116H38Y36-H38 AromaticContact CD1-CD2 3.8Å; Y36-H38 AromaticContact CD1-NE2 3.26Å; Y36-H38 VanDerWaalsContact CD1-NE2 3.26Å; Y36-H38 WeakPolarHBondContact CD1-NE2 3.44Å; Y36-H38 AromaticContact CG-CD2 3.97Å; Y36-H38 AromaticContact CG-NE2 3.89Å; Y36-H38 PolarHBondContact O-N 3.38Å
37L42.5Very low64.8Low172 Ų172105.1 Ų105.190%0.90155%0.546SS*.  trans-70.268.9147.9-166.680.8000108.2S39L37-S39 PolarHBondContact O-N 3.09Å
38H50.7Low65.7Low79 Ų79102.6 Ų102.637%0.36653%0.533SS..  trans-77.482169.2-78.3-63.6000108.2Y36 A40 D41 N42Y36-H38 AromaticContact CD1-CD2 3.8Å; Y36-H38 AromaticContact CD1-NE2 3.26Å; Y36-H38 VanDerWaalsContact CD1-NE2 3.26Å; Y36-H38 WeakPolarHBondContact CD1-NE2 3.44Å; Y36-H38 AromaticContact CG-CD2 3.97Å; Y36-H38 AromaticContact CG-NE2 3.89Å; Y36-H38 PolarHBondContact O-N 3.38Å; H38-A40 PolarHBondContact O-N 3.06Å; H38-D41 HydrophobicContact CB-CB 3.77Å; H38-D41 IonicContact CG-OD1 2.59Å; H38-D41 IonicContact CG-OD2 3.82Å; H38-D41 IonicContact ND1-OD1 3.23Å; H38-D41 PolarHBondContact O-N 3.37Å; H38-N42 PolarHBondContact O-N 3.23Å
39S50.7Low66.5Low85 Ų8595 Ų9559%0.59451%0.509SS*.THydrogen-bonded Turntrans-60.2-26.7174.4-172.50000112L37 T43L37-S39 PolarHBondContact O-N 3.09Å; S39-T43 VanDerWaalsContact O-CG2 3.23Å; S39-T43 WeakPolarHBondContact O-CG2 3.27Å
40A52.5Low67.6Low55 Ų5592.5 Ų92.546%0.45550%0.504SS..THydrogen-bonded Turntrans-80.1-44.9179.700000112.5H38 N42 T43 Y44H38-A40 PolarHBondContact O-N 3.06Å; A40-N42 PolarHBondContact O-N 2.95Å; A40-T43 PolarHBondContact O-N 3.46Å; A40-T43 PolarHBondContact O-OG1 3.43Å; A40-Y44 WeakPolarHBondContact O-CD2 3.36Å
41D59.6Low68.7Low25 Ų2586.6 Ų86.613%0.13448%0.479CS..Hα-helixtrans-59.4-32.7175.6-6226.5000110.4H38 T45 T117H38-D41 HydrophobicContact CB-CB 3.77Å; H38-D41 IonicContact CG-OD1 2.59Å; H38-D41 IonicContact CG-OD2 3.82Å; H38-D41 IonicContact ND1-OD1 3.23Å; H38-D41 PolarHBondContact O-N 3.37Å; D41-T45 WeakPolarHBondContact O-CG2 3.39Å; D41-T45 PolarHBondContact O-OG1 3.5Å; D41-T117 PolarHBondContact OD2-N 3.49Å; D41-T117 VanDerWaalsContact OD2-N 3.17Å; D41-T117 PolarHBondContact OD2-OG1 2.94Å
42N71.9Confident70.1Confident108 Ų10882 Ų8258%0.57845%0.449SS*.Hα-helixtrans-73.3-22.8176.5-160.839.8000113.9H38 A40 T45 A46H38-N42 PolarHBondContact O-N 3.23Å; A40-N42 PolarHBondContact O-N 2.95Å; N42-T45 WeakPolarHBondContact CA-OG1 3.39Å; N42-T45 PolarHBondContact O-OG1 3.44Å; N42-A46 WeakPolarHBondContact O-CB 3.28Å; N42-A46 PolarHBondContact O-N 2.98Å
43T81.4Confident71.8Confident66 Ų6682.8 Ų82.841%0.40544%0.44SS..Hα-helixtrans-77.2-43.9-177.3540000112.1S39 A40 T45 A46 N47S39-T43 VanDerWaalsContact O-CG2 3.23Å; S39-T43 WeakPolarHBondContact O-CG2 3.27Å; A40-T43 PolarHBondContact O-N 3.46Å; A40-T43 PolarHBondContact O-OG1 3.43Å; T43-T45 VanDerWaalsContact C-N 3.32Å; T43-T45 PolarHBondContact O-N 3.32Å; T43-A46 PolarHBondContact O-N 2.99Å; T43-N47 WeakPolarHBondContact O-CB 3.44Å; T43-N47 VanDerWaalsContact O-CG 3.23Å; T43-N47 PolarHBondContact O-N 3.08Å; T43-N47 PolarHBondContact O-ND2 2.92Å; T43-N47 VanDerWaalsContact O-ND2 3.09Å
44Y82.6Confident73.7Confident87 Ų8782.2 Ų82.234%0.34144%0.438SS..Hα-helixtrans-64.6-41.6177.4-66.6-80.1000111.1A40 N47 L48 H115A40-Y44 WeakPolarHBondContact O-CD2 3.36Å; Y44-N47 PolarHBondContact O-N 2.87Å; Y44-L48 WeakPolarHBondContact O-CB 3.3Å; Y44-L48 PolarHBondContact O-N 3.38Å; Y44-H115 HydrophobicContact CD2-CB 4.37Å; Y44-H115 HydrophobicContact CE2-CB 4.36Å
45T84.7Confident75.7Confident7 Ų776 Ų764%0.04340%0.397CS..Hα-helixtrans-70.9-40.8179.762.30000111.2D41 N42 T43 N47 L48 I49 V112 H122 I126D41-T45 WeakPolarHBondContact O-CG2 3.39Å; D41-T45 PolarHBondContact O-OG1 3.5Å; N42-T45 WeakPolarHBondContact CA-OG1 3.39Å; N42-T45 PolarHBondContact O-OG1 3.44Å; T43-T45 VanDerWaalsContact C-N 3.32Å; T43-T45 PolarHBondContact O-N 3.32Å; T45-N47 PolarHBondContact O-N 2.93Å; T45-L48 PolarHBondContact O-N 3.15Å; T45-I49 WeakPolarHBondContact O-CB 3.35Å; T45-I49 WeakPolarHBondContact O-CD1 3.46Å; T45-I49 WeakPolarHBondContact O-CG1 3.01Å; T45-I49 PolarHBondContact O-N 3.38Å; T45-V112 HydrophobicContact CG2-CG1 3.72Å; T45-V112 HydrophobicContact CG2-CG2 4.16Å; T45-H122 WeakPolarHBondContact CG2-CE1 3.48Å; T45-I126 HydrophobicContact CG2-CD1 4.09Å
46A85.7Confident77.7Confident46 Ų4671.3 Ų71.338%0.3838%0.382SS..Hα-helixtrans-62.3-42173.100000112.3N42 T43 I49 A50N42-A46 WeakPolarHBondContact O-CB 3.28Å; N42-A46 PolarHBondContact O-N 2.98Å; T43-A46 PolarHBondContact O-N 2.99Å; A46-I49 PolarHBondContact O-N 3.24Å; A46-A50 VanDerWaalsContact O-CB 3.3Å; A46-A50 WeakPolarHBondContact O-CB 3.05Å; A46-A50 PolarHBondContact O-N 3.01Å
47N88.8Confident79.8Confident111 Ų11167.3 Ų67.359%0.59437%0.37SS*.Hα-helixtrans-63.7-43.3175.6-75.6-33.5000111.6T43 Y44 T45 A50 K51T43-N47 WeakPolarHBondContact O-CB 3.44Å; T43-N47 VanDerWaalsContact O-CG 3.23Å; T43-N47 PolarHBondContact O-N 3.08Å; T43-N47 PolarHBondContact O-ND2 2.92Å; T43-N47 VanDerWaalsContact O-ND2 3.09Å; Y44-N47 PolarHBondContact O-N 2.87Å; T45-N47 PolarHBondContact O-N 2.93Å; N47-A50 PolarHBondContact O-N 3.15Å; N47-K51 WeakPolarHBondContact O-CB 3.48Å; N47-K51 PolarHBondContact O-N 3.01Å
48L90Very high82.3Confident1 Ų161.3 Ų61.31%0.00534%0.337CS..Hα-helixtrans-61.3-47.8175.6-173.3158.5000111Y44 T45 A50 K51 S52 L105 I109 V112 I126Y44-L48 WeakPolarHBondContact O-CB 3.3Å; Y44-L48 PolarHBondContact O-N 3.38Å; T45-L48 PolarHBondContact O-N 3.15Å; L48-A50 VanDerWaalsContact C-N 3.34Å; L48-A50 PolarHBondContact O-N 3.37Å; L48-K51 PolarHBondContact O-N 3.16Å; L48-S52 WeakPolarHBondContact O-CB 3.32Å; L48-S52 PolarHBondContact O-N 3.32Å; L48-S52 PolarHBondContact O-OG 3.21Å; L48-L105 HydrophobicContact CG-CD2 4.24Å; L48-I109 HydrophobicContact CD1-CG1 3.81Å; L48-V112 HydrophobicContact CD1-CG2 3.91Å; L48-I126 HydrophobicContact CD1-CD1 4.5Å; L48-I126 HydrophobicContact CD1-CG2 3.64Å; L48-I126 HydrophobicContact CD2-CD1 4.45Å; L48-I126 HydrophobicContact CD2-CG1 4.37Å; L48-I126 HydrophobicContact CD2-CG2 3.75Å; L48-I126 HydrophobicContact CG-CG2 4.39Å
49I89.6Confident84.4Confident74 Ų7458 Ų5838%0.37932%0.322SS..Hα-helixtrans-63.6-40.3179.1-68.6165.5000111T45 A46 K51 S52 K53T45-I49 WeakPolarHBondContact O-CB 3.35Å; T45-I49 WeakPolarHBondContact O-CD1 3.46Å; T45-I49 WeakPolarHBondContact O-CG1 3.01Å; T45-I49 PolarHBondContact O-N 3.38Å; A46-I49 PolarHBondContact O-N 3.24Å; I49-K51 VanDerWaalsContact C-N 3.32Å; I49-K51 PolarHBondContact O-N 3.3Å; I49-S52 WeakPolarHBondContact CA-OG 3.45Å; I49-S52 PolarHBondContact O-N 3.17Å; I49-S52 PolarHBondContact O-OG 3.4Å; I49-K53 VanDerWaalsContact O-CB 3.26Å; I49-K53 WeakPolarHBondContact O-CB 3.36Å; I49-K53 PolarHBondContact O-N 3.17Å
50A91.7Very high86.4Confident58 Ų5860.2 Ų60.248%0.47932%0.321SS..Hα-helixtrans-62.3-42.3175.600000111.3A46 N47 L48 Q54A46-A50 VanDerWaalsContact O-CB 3.3Å; A46-A50 WeakPolarHBondContact O-CB 3.05Å; A46-A50 PolarHBondContact O-N 3.01Å; N47-A50 PolarHBondContact O-N 3.15Å; L48-A50 VanDerWaalsContact C-N 3.34Å; L48-A50 PolarHBondContact O-N 3.37Å; A50-Q54 PolarHBondContact O-N 2.99Å
51K91.9Very high88.4Confident50 Ų5062.9 Ų62.922%0.21733%0.326CS..Hα-helixtrans-70.4-40178.1-171.2173.9-167.1151.10113.2N47 L48 I49 K53 Q54 M55 T101 L105N47-K51 WeakPolarHBondContact O-CB 3.48Å; N47-K51 PolarHBondContact O-N 3.01Å; L48-K51 PolarHBondContact O-N 3.16Å; I49-K51 VanDerWaalsContact C-N 3.32Å; I49-K51 PolarHBondContact O-N 3.3Å; K51-K53 VanDerWaalsContact C-N 3.33Å; K51-Q54 PolarHBondContact O-N 3.49Å; K51-M55 PolarHBondContact O-N 3.38Å; K51-T101 HydrophobicContact CG-CG2 4.17Å; K51-L105 HydrophobicContact CB-CD2 3.85Å; K51-L105 HydrophobicContact CD-CD2 3.86Å; K51-L105 HydrophobicContact CD-CG 4.09Å; K51-L105 HydrophobicContact CG-CD2 3.74Å; K51-L105 HydrophobicContact CG-CG 4.06Å
52S91.5Very high90.1Very high8 Ų861.8 Ų61.86%0.05632%0.32CS..Hα-helixtrans-66.4-38.517669.60000110.8L48 I49 M55 S56L48-S52 WeakPolarHBondContact O-CB 3.32Å; L48-S52 PolarHBondContact O-N 3.32Å; L48-S52 PolarHBondContact O-OG 3.21Å; I49-S52 WeakPolarHBondContact CA-OG 3.45Å; I49-S52 PolarHBondContact O-N 3.17Å; I49-S52 PolarHBondContact O-OG 3.4Å; S52-M55 PolarHBondContact O-N 3.08Å; S52-S56 WeakPolarHBondContact O-CB 3.47Å; S52-S56 PolarHBondContact O-N 3.38Å
53K93.6Very high91.1Very high137 Ų13759.3 Ų59.360%0.59631%0.308SS*.Hα-helixtrans-61.5-47.9170.9-176.9179.6178.6-179.10111.7I49 K51 M55 S56 E57I49-K53 VanDerWaalsContact O-CB 3.26Å; I49-K53 WeakPolarHBondContact O-CB 3.36Å; I49-K53 PolarHBondContact O-N 3.17Å; K51-K53 VanDerWaalsContact C-N 3.33Å; K53-M55 VanDerWaalsContact C-N 3.35Å; K53-M55 PolarHBondContact O-N 3.18Å; K53-S56 PolarHBondContact O-N 3.22Å; K53-S56 VanDerWaalsContact O-N 3.15Å; K53-S56 PolarHBondContact O-OG 3.3Å; K53-E57 PolarHBondContact O-N 3.29Å; K53-E57 VanDerWaalsContact O-N 3.07Å
54Q94.7Very high91.6Very high109 Ų10958.8 Ų58.851%0.50931%0.307SS..Hα-helixtrans-56.5-49.2176.2-178.5-175.1-16.200111.4A50 K51 S56 E57 E58A50-Q54 PolarHBondContact O-N 2.99Å; K51-Q54 PolarHBondContact O-N 3.49Å; Q54-S56 VanDerWaalsContact C-N 3.27Å; Q54-S56 PolarHBondContact O-N 3.26Å; Q54-E57 PolarHBondContact O-N 3.46Å; Q54-E57 VanDerWaalsContact O-N 3.17Å; Q54-E58 WeakPolarHBondContact CG-OE1 3.32Å; Q54-E58 PolarHBondContact NE2-OE1 2.88Å; Q54-E58 WeakPolarHBondContact O-CG 3.47Å; Q54-E58 PolarHBondContact O-N 3.36Å
55M94.2Very high92Very high1 Ų157.2 Ų57.21%0.00530%0.302CS..Hα-helixtrans-58.5-39176.7-172.5-179.6170.700112.1K51 S52 K53 E58 L59 L98 T101 K102 L105 L133 L137K51-M55 PolarHBondContact O-N 3.38Å; S52-M55 PolarHBondContact O-N 3.08Å; K53-M55 VanDerWaalsContact C-N 3.35Å; K53-M55 PolarHBondContact O-N 3.18Å; M55-E58 PolarHBondContact O-N 3.3Å; M55-L59 HydrophobicContact CE-CD1 4.25Å; M55-L59 HydrophobicContact CG-CD1 4.29Å; M55-L59 WeakPolarHBondContact O-CB 3.34Å; M55-L59 WeakPolarHBondContact O-CG 3.42Å; M55-L59 PolarHBondContact O-N 3.32Å; M55-L98 HydrophobicContact CG-CD2 3.82Å; M55-T101 HydrophobicContact CB-CG2 3.8Å; M55-T101 HydrophobicContact CG-CG2 4Å; M55-T101 HydrophobicContact SD-CG2 4.09Å; M55-K102 HydrophobicContact CE-CB 3.95Å; M55-L105 HydrophobicContact CB-CD1 4.3Å; M55-L105 HydrophobicContact SD-CD1 3.42Å; M55-L105 WeakPolarHBondContact SD-CD1 3.36Å; M55-L133 HydrophobicContact CE-CB 4.28Å; M55-L133 HydrophobicContact SD-CB 4.3Å; M55-L133 HydrophobicContact SD-CD1 4.23Å; M55-L137 HydrophobicContact CE-CB 4.45Å; M55-L137 HydrophobicContact CE-CD2 3.89Å
56S93.6Very high92.2Very high43 Ų4356.9 Ų56.930%0.30130%0.3SS..Hα-helixtrans-64.7-38.2178.177.70000113S52 K53 Q54 K60S52-S56 WeakPolarHBondContact O-CB 3.47Å; S52-S56 PolarHBondContact O-N 3.38Å; K53-S56 PolarHBondContact O-N 3.22Å; K53-S56 VanDerWaalsContact O-N 3.15Å; K53-S56 PolarHBondContact O-OG 3.3Å; Q54-S56 VanDerWaalsContact C-N 3.27Å; Q54-S56 PolarHBondContact O-N 3.26Å; S56-K60 WeakPolarHBondContact O-CB 3.49Å; S56-K60 PolarHBondContact O-N 2.95Å
57E95Very high92.4Very high92 Ų9258 Ų5843%0.4330%0.303SS..Hα-helixtrans-71.4-41.8176.1-67-60.8157.200111.1K53 Q54 L59 K60 M61K53-E57 PolarHBondContact O-N 3.29Å; K53-E57 VanDerWaalsContact O-N 3.07Å; Q54-E57 PolarHBondContact O-N 3.46Å; Q54-E57 VanDerWaalsContact O-N 3.17Å; E57-L59 VanDerWaalsContact C-N 3.34Å; E57-L59 PolarHBondContact O-N 2.93Å; E57-K60 PolarHBondContact O-N 3.48Å; E57-M61 VanDerWaalsContact O-CG 3.27Å; E57-M61 WeakPolarHBondContact O-CG 3.47Å; E57-M61 PolarHBondContact O-N 3.48Å
58E94.5Very high92.4Very high46 Ų4659.2 Ų59.222%0.21530%0.302CS..Hα-helixtrans-60.6-42.2173.9-72.5170.1-171.800111.8Q54 M55 M61 T62 L98Q54-E58 WeakPolarHBondContact CG-OE1 3.32Å; Q54-E58 PolarHBondContact NE2-OE1 2.88Å; Q54-E58 WeakPolarHBondContact O-CG 3.47Å; Q54-E58 PolarHBondContact O-N 3.36Å; M55-E58 PolarHBondContact O-N 3.3Å; E58-M61 PolarHBondContact O-N 2.96Å; E58-T62 WeakPolarHBondContact O-CB 3.42Å; E58-T62 PolarHBondContact O-N 3.48Å; E58-T62 PolarHBondContact O-OG1 2.93Å; E58-L98 HydrophobicContact CB-CD2 3.64Å
59L93.9Very high92.2Very high10 Ų1059.2 Ų59.25%0.05230%0.302CS..Hα-helixtrans-58.2-50172.7-85.2166.1000111.2M55 E57 M61 T62 V63 L98 L133 H136 L137 L140M55-L59 HydrophobicContact CE-CD1 4.25Å; M55-L59 HydrophobicContact CG-CD1 4.29Å; M55-L59 WeakPolarHBondContact O-CB 3.34Å; M55-L59 WeakPolarHBondContact O-CG 3.42Å; M55-L59 PolarHBondContact O-N 3.32Å; E57-L59 VanDerWaalsContact C-N 3.34Å; E57-L59 PolarHBondContact O-N 2.93Å; L59-M61 VanDerWaalsContact C-N 3.32Å; L59-M61 PolarHBondContact O-N 3Å; L59-T62 PolarHBondContact O-N 3.41Å; L59-T62 VanDerWaalsContact O-N 3.14Å; L59-V63 VanDerWaalsContact O-CG2 3.32Å; L59-V63 WeakPolarHBondContact O-CG2 3.26Å; L59-V63 PolarHBondContact O-N 2.59Å; L59-L98 HydrophobicContact CD2-CD1 3.76Å; L59-L98 HydrophobicContact CD2-CD2 4.38Å; L59-L98 HydrophobicContact CG-CD1 4.11Å; L59-L98 HydrophobicContact CG-CD2 3.89Å; L59-L133 HydrophobicContact CD1-CD2 3.68Å; L59-H136 HydrophobicContact CD1-CB 4.39Å; L59-L137 HydrophobicContact CD2-CB 4.06Å; L59-L137 HydrophobicContact CD2-CD1 4.07Å; L59-L140 HydrophobicContact CD2-CD2 4.01Å
60K94.2Very high92Very high130 Ų13059.5 Ų59.557%0.56530%0.301SS*.Hα-helixtrans-60-41.7179.3-177.8-176.5176.9-173.90112.3S56 E57 S64S56-K60 WeakPolarHBondContact O-CB 3.49Å; S56-K60 PolarHBondContact O-N 2.95Å; E57-K60 PolarHBondContact O-N 3.48Å; K60-S64 PolarHBondContact O-N 3.34Å; K60-S64 PolarHBondContact O-OG 3.15Å
61M93.8Very high91.6Very high112 Ų11261.2 Ų61.255%0.55230%0.301SS*.Hα-helixtrans-65-40.8175.7-69.6-59.3-68.600111.4E57 E58 L59 S64 K65E57-M61 VanDerWaalsContact O-CG 3.27Å; E57-M61 WeakPolarHBondContact O-CG 3.47Å; E57-M61 PolarHBondContact O-N 3.48Å; E58-M61 PolarHBondContact O-N 2.96Å; L59-M61 VanDerWaalsContact C-N 3.32Å; L59-M61 PolarHBondContact O-N 3Å; M61-S64 WeakPolarHBondContact O-CB 3.44Å; M61-S64 PolarHBondContact O-N 2.87Å; M61-K65 WeakPolarHBondContact O-CG 3.44Å; M61-K65 PolarHBondContact O-N 3.21Å
62T94.1Very high91Very high2 Ų261.5 Ų61.51%0.01231%0.305CS..Hα-helixtrans-69.2-39.9179-49.80000111.8E58 L59 S64 K65 M66 I91 D94 L140E58-T62 WeakPolarHBondContact O-CB 3.42Å; E58-T62 PolarHBondContact O-N 3.48Å; E58-T62 PolarHBondContact O-OG1 2.93Å; L59-T62 PolarHBondContact O-N 3.41Å; L59-T62 VanDerWaalsContact O-N 3.14Å; T62-S64 VanDerWaalsContact C-N 3.3Å; T62-S64 PolarHBondContact O-N 2.91Å; T62-K65 WeakPolarHBondContact O-CB 3.43Å; T62-K65 PolarHBondContact O-N 3.06Å; T62-K65 VanDerWaalsContact O-N 3.16Å; T62-M66 PolarHBondContact O-N 3.16Å; T62-I91 HydrophobicContact CG2-CG2 4.34Å; T62-D94 HydrophobicContact CG2-CB 3.72Å; T62-L140 HydrophobicContact CG2-CD1 4.44Å; T62-L140 HydrophobicContact CG2-CD2 3.71Å
63V92.8Very high90.2Very high56 Ų5662.8 Ų62.834%0.33931%0.309SS..Hα-helixtrans-59-42.9170.7171.60000110.5L59 K65 M66 T67 L140L59-V63 VanDerWaalsContact O-CG2 3.32Å; L59-V63 WeakPolarHBondContact O-CG2 3.26Å; L59-V63 PolarHBondContact O-N 2.59Å; V63-K65 VanDerWaalsContact C-N 3.32Å; V63-K65 PolarHBondContact O-N 3.29Å; V63-M66 WeakPolarHBondContact O-CA 3.06Å; V63-M66 VanDerWaalsContact O-CB 3.26Å; V63-M66 WeakPolarHBondContact O-CB 3.18Å; V63-M66 PolarHBondContact O-N 3.39Å; V63-M66 VanDerWaalsContact O-N 3.09Å; V63-T67 PolarHBondContact O-N 2.94Å; V63-T67 PolarHBondContact O-OG1 2.91Å; V63-T67 VanDerWaalsContact O-OG1 3.05Å; V63-L140 HydrophobicContact CG2-CD1 3.99Å
64S92.4Very high89.2Confident54 Ų5464 Ų6438%0.37832%0.317SS..Hα-helixtrans-62.9-37.8176.6-57.90000112.4K60 M61 T62 K68K60-S64 PolarHBondContact O-N 3.34Å; K60-S64 PolarHBondContact O-OG 3.15Å; M61-S64 WeakPolarHBondContact O-CB 3.44Å; M61-S64 PolarHBondContact O-N 2.87Å; T62-S64 VanDerWaalsContact C-N 3.3Å; T62-S64 PolarHBondContact O-N 2.91Å; S64-K68 WeakPolarHBondContact O-CG 3.35Å; S64-K68 PolarHBondContact O-N 3.44Å; S64-K68 VanDerWaalsContact O-N 3.15Å
65K91.7Very high87.8Confident55 Ų5563.1 Ų63.124%0.23932%0.316CS..Hα-helixtrans-65.7-39.5172-66.8171.9-167.9171.50111.3M61 T62 V63 K68 L69 L87 V90 I91 D94M61-K65 WeakPolarHBondContact O-CG 3.44Å; M61-K65 PolarHBondContact O-N 3.21Å; T62-K65 WeakPolarHBondContact O-CB 3.43Å; T62-K65 PolarHBondContact O-N 3.06Å; T62-K65 VanDerWaalsContact O-N 3.16Å; V63-K65 VanDerWaalsContact C-N 3.32Å; V63-K65 PolarHBondContact O-N 3.29Å; K65-K68 WeakPolarHBondContact O-CB 3.37Å; K65-K68 PolarHBondContact O-N 3.4Å; K65-L69 WeakPolarHBondContact O-CB 3.46Å; K65-L69 PolarHBondContact O-N 3.3Å; K65-L87 HydrophobicContact CB-CD1 4.24Å; K65-V90 HydrophobicContact CD-CG1 4.04Å; K65-I91 HydrophobicContact CB-CD1 4.09Å; K65-I91 HydrophobicContact CB-CG1 3.94Å; K65-D94 VanDerWaalsContact CD-OD2 3.26Å; K65-D94 WeakPolarHBondContact CD-OD2 3.36Å; K65-D94 WeakPolarHBondContact CE-OD2 3.48Å; K65-D94 VanDerWaalsContact NZ-CG 3.29Å; K65-D94 IonicContact NZ-OD1 3.93Å; K65-D94 PolarHBondContact NZ-OD1 3.42Å; K65-D94 IonicContact NZ-OD2 3.28Å; K65-D94 PolarHBondContact NZ-OD2 2.86Å
66M89.4Confident86.1Confident0 Ų068.1 Ų68.10%035%0.349CS..Hα-helixtrans-60.9-46.2175.2-168.662.366.300112T62 V63 K68 L69 K70 I91 L140 E143 F144 V147T62-M66 PolarHBondContact O-N 3.16Å; V63-M66 WeakPolarHBondContact O-CA 3.06Å; V63-M66 VanDerWaalsContact O-CB 3.26Å; V63-M66 WeakPolarHBondContact O-CB 3.18Å; V63-M66 PolarHBondContact O-N 3.39Å; V63-M66 VanDerWaalsContact O-N 3.09Å; M66-K68 VanDerWaalsContact C-N 3.3Å; M66-K68 PolarHBondContact O-N 3Å; M66-L69 WeakPolarHBondContact O-CB 3.3Å; M66-L69 PolarHBondContact O-N 3.48Å; M66-L69 VanDerWaalsContact O-N 3.13Å; M66-L69 HydrophobicContact SD-CD2 4.15Å; M66-K70 WeakPolarHBondContact O-CG 3.32Å; M66-K70 PolarHBondContact O-N 3.13Å; M66-I91 HydrophobicContact CE-CG2 3.61Å; M66-L140 HydrophobicContact CB-CD1 4.22Å; M66-L140 HydrophobicContact CE-CD1 3.75Å; M66-L140 HydrophobicContact CG-CD1 4.42Å; M66-E143 HydrophobicContact CG-CG 4.35Å; M66-F144 HydrophobicContact CE-CB 3.33Å; M66-F144 HydrophobicContact CE-CD2 3.41Å; M66-F144 VanDerWaalsContact CE-CD2 3.41Å; M66-F144 HydrophobicContact CE-CE2 4.35Å; M66-F144 HydrophobicContact CE-CG 3.57Å; M66-F144 HydrophobicContact SD-CB 4.19Å; M66-F144 HydrophobicContact SD-CD2 3.75Å; M66-F144 HydrophobicContact SD-CG 4.37Å; M66-V147 HydrophobicContact SD-CG2 4.44Å
67T89.5Confident84.1Confident70 Ų7070.5 Ų70.543%0.42937%0.365SS..Hα-helixtrans-61-42.1176.8-50.50000111V63 L69 K70 I71V63-T67 PolarHBondContact O-N 2.94Å; V63-T67 PolarHBondContact O-OG1 2.91Å; V63-T67 VanDerWaalsContact O-OG1 3.05Å; T67-L69 VanDerWaalsContact C-N 3.35Å; T67-K70 PolarHBondContact O-N 3.38Å; T67-I71 HydrophobicContact CG2-CD1 4.37Å; T67-I71 WeakPolarHBondContact O-CG1 3.26Å; T67-I71 PolarHBondContact O-N 3.44Å; T67-I71 VanDerWaalsContact O-N 3.08Å
68K87.8Confident82Confident136 Ų13674 Ų7459%0.59138%0.381SS*.Hα-helixtrans-61.6-42.8173.2-70.9175.4-178.2-175.50111.8S64 K65 M66 K70 I71 L72S64-K68 WeakPolarHBondContact O-CG 3.35Å; S64-K68 PolarHBondContact O-N 3.44Å; S64-K68 VanDerWaalsContact O-N 3.15Å; K65-K68 WeakPolarHBondContact O-CB 3.37Å; K65-K68 PolarHBondContact O-N 3.4Å; M66-K68 VanDerWaalsContact C-N 3.3Å; M66-K68 PolarHBondContact O-N 3Å; K68-K70 VanDerWaalsContact C-N 3.33Å; K68-K70 PolarHBondContact O-N 3.42Å; K68-I71 PolarHBondContact O-N 3.03Å; K68-L72 WeakPolarHBondContact O-CG 3.25Å; K68-L72 PolarHBondContact O-N 2.7Å
69L86Confident80.3Confident0 Ų073.5 Ų73.50%038%0.382CS..Hα-helixtrans-58.9-44.8177-178.968.6000111.2K65 M66 T67 I71 L72 F73 L84 L87 I88 I91 F144 V147K65-L69 WeakPolarHBondContact O-CB 3.46Å; K65-L69 PolarHBondContact O-N 3.3Å; M66-L69 WeakPolarHBondContact O-CB 3.3Å; M66-L69 PolarHBondContact O-N 3.48Å; M66-L69 VanDerWaalsContact O-N 3.13Å; M66-L69 HydrophobicContact SD-CD2 4.15Å; T67-L69 VanDerWaalsContact C-N 3.35Å; L69-I71 PolarHBondContact O-N 3.26Å; L69-L72 PolarHBondContact O-N 2.94Å; L69-F73 HydrophobicContact CD1-CD2 4.29Å; L69-F73 HydrophobicContact CD1-CE2 3.6Å; L69-F73 HydrophobicContact CD1-CZ 3.91Å; L69-F73 HydrophobicContact CD2-CE2 3.82Å; L69-F73 HydrophobicContact CG-CD2 3.93Å; L69-F73 HydrophobicContact CG-CE2 3.41Å; L69-F73 VanDerWaalsContact CG-CE2 3.41Å; L69-F73 HydrophobicContact CG-CZ 4.2Å; L69-F73 WeakPolarHBondContact O-CD2 3.49Å; L69-F73 PolarHBondContact O-N 3.18Å; L69-L84 HydrophobicContact CD1-CD1 3.37Å; L69-L84 HydrophobicContact CD1-CG 4.46Å; L69-L87 HydrophobicContact CB-CD2 3.76Å; L69-L87 HydrophobicContact CB-CG 4.32Å; L69-L87 HydrophobicContact CD1-CB 4.33Å; L69-L87 HydrophobicContact CD1-CD2 3.8Å; L69-L87 HydrophobicContact CD1-CG 4.06Å; L69-L87 HydrophobicContact CG-CD2 4.4Å; L69-I88 HydrophobicContact CD1-CG1 4.07Å; L69-I88 HydrophobicContact CD2-CG1 4.3Å; L69-I91 HydrophobicContact CB-CD1 4.02Å; L69-I91 HydrophobicContact CD2-CD1 3.75Å; L69-I91 HydrophobicContact CG-CD1 4.4Å; L69-F144 HydrophobicContact CD2-CD2 4.2Å; L69-F144 HydrophobicContact CD2-CE2 3.84Å; L69-V147 HydrophobicContact CD2-CG1 3.87Å; L69-V147 HydrophobicContact CG-CG1 4.22Å
70K85.2Confident78.9Confident80 Ų8075.6 Ų75.635%0.34840%0.398SS..Hα-helixtrans-60.1-43.3175.2-71.3-173.4179.4-168.30113.1M66 T67 K68 L72 F73 Q74 E143 V147M66-K70 WeakPolarHBondContact O-CG 3.32Å; M66-K70 PolarHBondContact O-N 3.13Å; T67-K70 PolarHBondContact O-N 3.38Å; K68-K70 VanDerWaalsContact C-N 3.33Å; K68-K70 PolarHBondContact O-N 3.42Å; K70-L72 VanDerWaalsContact C-N 3.33Å; K70-L72 PolarHBondContact O-N 2.94Å; K70-F73 PolarHBondContact O-N 3.17Å; K70-Q74 PolarHBondContact O-N 2.93Å; K70-E143 WeakPolarHBondContact CE-OE1 3.46Å; K70-E143 IonicContact NZ-OE1 3.66Å; K70-E143 PolarHBondContact NZ-OE1 3.05Å; K70-V147 HydrophobicContact CD-CG2 4.05Å; K70-V147 HydrophobicContact CG-CG1 4.46Å; K70-V147 HydrophobicContact CG-CG2 3.63Å
71I83.4Confident77.7Confident95 Ų9573.7 Ų73.749%0.48740%0.399SS..Hα-helixtrans-61.7-44.4176.9-66.3164.2000110.1T67 K68 L69 F73 Q74 D75T67-I71 HydrophobicContact CG2-CD1 4.37Å; T67-I71 WeakPolarHBondContact O-CG1 3.26Å; T67-I71 PolarHBondContact O-N 3.44Å; T67-I71 VanDerWaalsContact O-N 3.08Å; K68-I71 PolarHBondContact O-N 3.03Å; L69-I71 PolarHBondContact O-N 3.26Å; I71-F73 PolarHBondContact O-N 2.96Å; I71-Q74 PolarHBondContact O-N 3.15Å; I71-Q74 VanDerWaalsContact O-N 3.08Å; I71-D75 PolarHBondContact O-N 3.08Å
72L80.4Confident76.7Confident56 Ų5675.5 Ų75.529%0.29341%0.406SS..Hα-helixtrans-64.1-29.1178-68.4175.4000113.1K68 L69 K70 S79 L87K68-L72 WeakPolarHBondContact O-CG 3.25Å; K68-L72 PolarHBondContact O-N 2.7Å; L69-L72 PolarHBondContact O-N 2.94Å; K70-L72 VanDerWaalsContact C-N 3.33Å; K70-L72 PolarHBondContact O-N 2.94Å; L72-S79 PolarHBondContact O-OG 3.13Å; L72-L87 HydrophobicContact CD1-CD2 3.93Å
73F75.1Confident76Confident35 Ų3579.4 Ų79.415%0.15443%0.43CS..Hα-helixtrans-71.9-30.1172.7-77-50.1000113.7L69 K70 I71 L84 I88 V147 H151L69-F73 HydrophobicContact CD1-CD2 4.29Å; L69-F73 HydrophobicContact CD1-CE2 3.6Å; L69-F73 HydrophobicContact CD1-CZ 3.91Å; L69-F73 HydrophobicContact CD2-CE2 3.82Å; L69-F73 HydrophobicContact CG-CD2 3.93Å; L69-F73 HydrophobicContact CG-CE2 3.41Å; L69-F73 VanDerWaalsContact CG-CE2 3.41Å; L69-F73 HydrophobicContact CG-CZ 4.2Å; L69-F73 WeakPolarHBondContact O-CD2 3.49Å; L69-F73 PolarHBondContact O-N 3.18Å; K70-F73 PolarHBondContact O-N 3.17Å; I71-F73 PolarHBondContact O-N 2.96Å; F73-L84 HydrophobicContact CD1-CD1 4.03Å; F73-L84 HydrophobicContact CD1-CD2 4.23Å; F73-L84 HydrophobicContact CE1-CD1 3.4Å; F73-L84 VanDerWaalsContact CE1-CD1 3.4Å; F73-L84 HydrophobicContact CE1-CD2 3.38Å; F73-L84 HydrophobicContact CE1-CG 3.85Å; F73-L84 HydrophobicContact CE2-CD1 4.23Å; F73-L84 HydrophobicContact CZ-CD1 3.57Å; F73-L84 HydrophobicContact CZ-CD2 4.06Å; F73-L84 HydrophobicContact CZ-CG 4.11Å; F73-I88 HydrophobicContact CZ-CD1 4.26Å; F73-V147 HydrophobicContact CD2-CG1 3.5Å; F73-V147 VanDerWaalsContact CD2-CG1 3.5Å; F73-V147 HydrophobicContact CE2-CG1 3.25Å; F73-V147 HydrophobicContact CZ-CG1 4.43Å; F73-H151 HydrophobicContact CD1-CB 3.81Å; F73-H151 AromaticContact CD1-CD2 3.53Å; F73-H151 AromaticContact CD1-CG 3.76Å; F73-H151 HydrophobicContact CE1-CB 3.27Å; F73-H151 AromaticContact CE1-CD2 3.06Å; F73-H151 WeakPolarHBondContact CE1-CD2 3.43Å; F73-H151 AromaticContact CE1-CE1 3.9Å; F73-H151 AromaticContact CE1-CG 2.99Å; F73-H151 AromaticContact CE1-ND1 3.57Å; F73-H151 AromaticContact CE1-NE2 3.64Å; F73-H151 HydrophobicContact CE2-CB 4.17Å; F73-H151 HydrophobicContact CZ-CB 3.44Å; F73-H151 VanDerWaalsContact CZ-CB 3.44Å; F73-H151 AromaticContact CZ-CG 3.49Å; F73-H151 VanDerWaalsContact CZ-CG 3.49Å; F73-H151 AromaticContact CZ-ND1 3.83Å
74Q71.5Confident75.3Confident161 Ų16177.4 Ų77.475%0.75242%0.417SS*.Hα-helixtrans-77-23.3-178.3-166.3136.529.600113.1K70 I71 P76K70-Q74 PolarHBondContact O-N 2.93Å; I71-Q74 PolarHBondContact O-N 3.15Å; I71-Q74 VanDerWaalsContact O-N 3.08Å; Q74-P76 VanDerWaalsContact C-CD 3.41Å; Q74-P76 WeakPolarHBondContact O-CD 3.34Å
75D65.1Low74.7Confident91 Ų9175.8 Ų75.849%0.48741%0.406SS..  trans-107.779.2179-69.2-28.8000112I71 S77 S79I71-D75 PolarHBondContact O-N 3.08Å; D75-S77 PolarHBondContact O-N 3.34Å; D75-S77 VanDerWaalsContact O-N 3.1Å; D75-S79 PolarHBondContact O-OG 2.89Å
76P58.8Low74.4Confident107 Ų10779.8 Ų79.870%0.69542%0.423SS*.THydrogen-bonded Turntrans-66.9-10.5-175.824.8-33.9000114.8Q74Q74-P76 VanDerWaalsContact C-CD 3.41Å; Q74-P76 WeakPolarHBondContact O-CD 3.34Å
77S52.2Low74.3Confident92 Ų9281.2 Ų81.264%0.64343%0.431SS*.THydrogen-bonded Turntrans-86-16.5-175.458.30000115.2D75D75-S77 PolarHBondContact O-N 3.34Å; D75-S77 VanDerWaalsContact O-N 3.1Å
78H50Low74.1Confident166 Ų16678 Ų7877%0.76941%0.411SS*.THydrogen-bonded Turntrans-128.3-7.8-173.9-67.4-63.2000114.9S80H78-S80 PolarHBondContact O-N 3.32Å
79S58.9Low74.1Confident35 Ų3574.3 Ų74.325%0.24540%0.396CS..  trans-82.7102.3-177.6-680000111.2L72 D75L72-S79 PolarHBondContact O-OG 3.13Å; D75-S79 PolarHBondContact O-OG 2.89Å
80S64.6Low74.3Confident55 Ų5576.9 Ų76.939%0.38541%0.411SS..  trans-58.7128.1171.1174.40000109.8H78 E82 V83 L84H78-S80 PolarHBondContact O-N 3.32Å; S80-E82 PolarHBondContact O-N 3.21Å; S80-V83 PolarHBondContact O-N 2.94Å; S80-V83 VanDerWaalsContact O-N 3.07Å; S80-L84 PolarHBondContact O-N 3.19Å
81P69.3Low74.5Confident90 Ų9073 Ų7358%0.58440%0.395SS*.Hα-helixtrans-58.9-23.6-178.724.1-34.2000112.5S85P81-S85 WeakPolarHBondContact O-CB 3.27Å; P81-S85 PolarHBondContact O-N 3.46Å
82E71.9Confident74.8Confident149 Ų14969.5 Ų69.570%0.69638%0.376SS*.Hα-helixtrans-70.3-45.9176.2-170.8-178171.300112.6S80 L84 S85 K86S80-E82 PolarHBondContact O-N 3.21Å; E82-L84 PolarHBondContact O-N 2.9Å; E82-S85 PolarHBondContact O-N 3.31Å; E82-K86 WeakPolarHBondContact O-CB 3.26Å; E82-K86 PolarHBondContact O-N 3.35Å
83V79.2Confident75.3Confident85 Ų8574.2 Ų74.252%0.51539%0.391SS..Hα-helixtrans-62.3-40.3178.7175.70000109.9S80 K86 L87S80-V83 PolarHBondContact O-N 2.94Å; S80-V83 VanDerWaalsContact O-N 3.07Å; V83-K86 PolarHBondContact O-N 3.48Å; V83-L87 WeakPolarHBondContact O-CB 3.27Å; V83-L87 PolarHBondContact O-N 3.22Å
84L79.9Confident76.2Confident14 Ų1474.2 Ų74.27%0.07339%0.392CS..Hα-helixtrans-66.3-49.6179.1-174.573.7000112.1L69 F73 S80 E82 K86 L87 I88 H151L69-L84 HydrophobicContact CD1-CD1 3.37Å; L69-L84 HydrophobicContact CD1-CG 4.46Å; F73-L84 HydrophobicContact CD1-CD1 4.03Å; F73-L84 HydrophobicContact CD1-CD2 4.23Å; F73-L84 HydrophobicContact CE1-CD1 3.4Å; F73-L84 VanDerWaalsContact CE1-CD1 3.4Å; F73-L84 HydrophobicContact CE1-CD2 3.38Å; F73-L84 HydrophobicContact CE1-CG 3.85Å; F73-L84 HydrophobicContact CE2-CD1 4.23Å; F73-L84 HydrophobicContact CZ-CD1 3.57Å; F73-L84 HydrophobicContact CZ-CD2 4.06Å; F73-L84 HydrophobicContact CZ-CG 4.11Å; S80-L84 PolarHBondContact O-N 3.19Å; E82-L84 PolarHBondContact O-N 2.9Å; L84-K86 PolarHBondContact O-N 2.98Å; L84-L87 PolarHBondContact O-N 3.49Å; L84-L87 VanDerWaalsContact O-N 3.15Å; L84-I88 HydrophobicContact CG-CD1 4.08Å; L84-I88 VanDerWaalsContact O-CG1 3.3Å; L84-I88 WeakPolarHBondContact O-CG1 3.35Å; L84-I88 PolarHBondContact O-N 3.26Å; L84-H151 WeakPolarHBondContact CD2-CE1 3.39Å; L84-H151 VanDerWaalsContact CD2-NE2 3.27Å; L84-H151 WeakPolarHBondContact CD2-NE2 3.43Å
85S79.9Confident77.2Confident19 Ų1966.5 Ų66.513%0.13336%0.357CS..Hα-helixtrans-56.1-43.2176-171.20000111.1P81 E82 I88 E89 R304P81-S85 WeakPolarHBondContact O-CB 3.27Å; P81-S85 PolarHBondContact O-N 3.46Å; E82-S85 PolarHBondContact O-N 3.31Å; S85-I88 PolarHBondContact O-N 3.3Å; S85-E89 WeakPolarHBondContact O-CG 3.42Å; S85-E89 PolarHBondContact O-N 3.04Å; S85-R304 WeakPolarHBondContact OG-CD 3.46Å; S85-R304 VanDerWaalsContact OG-CZ 3.22Å; S85-R304 PolarHBondContact OG-NE 2.99Å; S85-R304 VanDerWaalsContact OG-NE 3.09Å; S85-R304 PolarHBondContact OG-NH1 3.18Å
86K84.2Confident78.4Confident139 Ų13966.4 Ų66.460%0.60435%0.354SS*.Hα-helixtrans-67.3-38.4178.9-168.2155.2-174167.20112.6E82 V83 L84 E89 V90E82-K86 WeakPolarHBondContact O-CB 3.26Å; E82-K86 PolarHBondContact O-N 3.35Å; V83-K86 PolarHBondContact O-N 3.48Å; L84-K86 PolarHBondContact O-N 2.98Å; K86-E89 PolarHBondContact O-N 3.36Å; K86-V90 VanDerWaalsContact O-CG2 3.25Å; K86-V90 WeakPolarHBondContact O-CG2 3.48Å; K86-V90 PolarHBondContact O-N 2.88Å
87L87Confident80Confident30 Ų3065 Ų6516%0.15734%0.341CS..Hα-helixtrans-68.7-39.2177.3-174.657.6000111.7K65 L69 L72 V83 L84 V90 I91K65-L87 HydrophobicContact CB-CD1 4.24Å; L69-L87 HydrophobicContact CB-CD2 3.76Å; L69-L87 HydrophobicContact CB-CG 4.32Å; L69-L87 HydrophobicContact CD1-CB 4.33Å; L69-L87 HydrophobicContact CD1-CD2 3.8Å; L69-L87 HydrophobicContact CD1-CG 4.06Å; L69-L87 HydrophobicContact CG-CD2 4.4Å; L72-L87 HydrophobicContact CD1-CD2 3.93Å; V83-L87 WeakPolarHBondContact O-CB 3.27Å; V83-L87 PolarHBondContact O-N 3.22Å; L84-L87 PolarHBondContact O-N 3.49Å; L84-L87 VanDerWaalsContact O-N 3.15Å; L87-V90 PolarHBondContact O-N 2.9Å; L87-I91 HydrophobicContact CD1-CD1 4.13Å; L87-I91 HydrophobicContact CD1-CG1 4.4Å; L87-I91 HydrophobicContact CG-CD1 3.96Å; L87-I91 WeakPolarHBondContact O-CB 3.5Å; L87-I91 WeakPolarHBondContact O-CG1 3.35Å; L87-I91 PolarHBondContact O-N 3.24Å
88I86.1Confident82Confident4 Ų460.7 Ų60.72%0.02131%0.31CS..Hα-helixtrans-59.7-48.1172.8-69.5167.2000110.2L69 F73 L84 S85 V90 I91 Q92 F144 L148 V305 T308L69-I88 HydrophobicContact CD1-CG1 4.07Å; L69-I88 HydrophobicContact CD2-CG1 4.3Å; F73-I88 HydrophobicContact CZ-CD1 4.26Å; L84-I88 HydrophobicContact CG-CD1 4.08Å; L84-I88 VanDerWaalsContact O-CG1 3.3Å; L84-I88 WeakPolarHBondContact O-CG1 3.35Å; L84-I88 PolarHBondContact O-N 3.26Å; S85-I88 PolarHBondContact O-N 3.3Å; I88-V90 PolarHBondContact O-N 3.37Å; I88-I91 PolarHBondContact O-N 3.3Å; I88-Q92 WeakPolarHBondContact O-CB 3.47Å; I88-Q92 PolarHBondContact O-N 2.9Å; I88-F144 HydrophobicContact CG2-CZ 4.03Å; I88-L148 HydrophobicContact CD1-CD2 3.9Å; I88-L148 HydrophobicContact CG1-CD2 3.98Å; I88-L148 HydrophobicContact CG2-CD2 3.9Å; I88-V305 HydrophobicContact CD1-CG2 4.38Å; I88-T308 HydrophobicContact CG2-CG2 4.2Å
89E87.2Confident84Confident58 Ų5853.6 Ų53.627%0.27128%0.278SS..Hα-helixtrans-60.4-44.8177-74.2170.4-162.700111.5S85 K86 I91 Q92 Y93 R304S85-E89 WeakPolarHBondContact O-CG 3.42Å; S85-E89 PolarHBondContact O-N 3.04Å; K86-E89 PolarHBondContact O-N 3.36Å; E89-I91 PolarHBondContact O-N 2.96Å; E89-Q92 WeakPolarHBondContact O-CB 3.36Å; E89-Q92 PolarHBondContact O-N 3.41Å; E89-Y93 WeakPolarHBondContact O-CD2 3.41Å; E89-Y93 PolarHBondContact O-N 2.73Å; E89-R304 IonicContact OE1-NE 3.3Å; E89-R304 PolarHBondContact OE1-NE 2.72Å
90V90.3Very high85.6Confident53 Ų5357.6 Ų57.632%0.32129%0.291SS..Hα-helixtrans-60.4-47177.1168.60000111.5K65 K86 L87 I88 Q92 Y93 D94K65-V90 HydrophobicContact CD-CG1 4.04Å; K86-V90 VanDerWaalsContact O-CG2 3.25Å; K86-V90 WeakPolarHBondContact O-CG2 3.48Å; K86-V90 PolarHBondContact O-N 2.88Å; L87-V90 PolarHBondContact O-N 2.9Å; I88-V90 PolarHBondContact O-N 3.37Å; V90-Q92 VanDerWaalsContact C-N 3.32Å; V90-Q92 PolarHBondContact O-N 3.49Å; V90-Y93 PolarHBondContact O-N 3.26Å; V90-D94 PolarHBondContact O-N 2.84Å
91I90.6Very high86.9Confident0 Ų055.5 Ų55.50%028%0.276CS..Hα-helixtrans-65.3-38.7179.3-70.8165.4000110.8T62 K65 M66 L69 L87 I88 E89 D94 I95 F144T62-I91 HydrophobicContact CG2-CG2 4.34Å; K65-I91 HydrophobicContact CB-CD1 4.09Å; K65-I91 HydrophobicContact CB-CG1 3.94Å; M66-I91 HydrophobicContact CE-CG2 3.61Å; L69-I91 HydrophobicContact CB-CD1 4.02Å; L69-I91 HydrophobicContact CD2-CD1 3.75Å; L69-I91 HydrophobicContact CG-CD1 4.4Å; L87-I91 HydrophobicContact CD1-CD1 4.13Å; L87-I91 HydrophobicContact CD1-CG1 4.4Å; L87-I91 HydrophobicContact CG-CD1 3.96Å; L87-I91 WeakPolarHBondContact O-CB 3.5Å; L87-I91 WeakPolarHBondContact O-CG1 3.35Å; L87-I91 PolarHBondContact O-N 3.24Å; I88-I91 PolarHBondContact O-N 3.3Å; E89-I91 PolarHBondContact O-N 2.96Å; I91-D94 PolarHBondContact O-N 3.09Å; I91-I95 HydrophobicContact CG2-CD1 3.88Å; I91-I95 HydrophobicContact CG2-CG1 4.44Å; I91-I95 WeakPolarHBondContact O-CG1 3.11Å; I91-I95 PolarHBondContact O-N 2.84Å; I91-F144 HydrophobicContact CB-CE2 4.18Å; I91-F144 HydrophobicContact CB-CZ 4.1Å; I91-F144 HydrophobicContact CG2-CD1 4.12Å; I91-F144 HydrophobicContact CG2-CD2 3.88Å; I91-F144 HydrophobicContact CG2-CE1 3.97Å; I91-F144 HydrophobicContact CG2-CE2 3.68Å; I91-F144 HydrophobicContact CG2-CG 4.08Å; I91-F144 HydrophobicContact CG2-CZ 3.72Å
92Q89Confident87.8Confident20 Ų2051.7 Ų51.79%0.09325%0.25CS..Hα-helixtrans-58.9-48.7174.4178.3-179.4-4.500111.1I88 E89 V90 I95 M96 F144 T308I88-Q92 WeakPolarHBondContact O-CB 3.47Å; I88-Q92 PolarHBondContact O-N 2.9Å; E89-Q92 WeakPolarHBondContact O-CB 3.36Å; E89-Q92 PolarHBondContact O-N 3.41Å; V90-Q92 VanDerWaalsContact C-N 3.32Å; V90-Q92 PolarHBondContact O-N 3.49Å; Q92-I95 PolarHBondContact O-N 3.47Å; Q92-M96 HydrophobicContact CG-SD 4.39Å; Q92-M96 WeakPolarHBondContact O-CG 3.21Å; Q92-M96 PolarHBondContact O-N 2.91Å; Q92-F144 HydrophobicContact CB-CE1 4.43Å; Q92-T308 HydrophobicContact CB-CG2 4.25Å; Q92-T308 HydrophobicContact CG-CG2 4.18Å; Q92-T308 PolarHBondContact OE1-OG1 3.14Å
93Y91.2Very high88.7Confident155 Ų15548.8 Ų48.861%0.60824%0.239SC*.Hα-helixtrans-62.7-42176.3-76.6-62.1000112.4E89 V90 I95 M96 D97E89-Y93 WeakPolarHBondContact O-CD2 3.41Å; E89-Y93 PolarHBondContact O-N 2.73Å; V90-Y93 PolarHBondContact O-N 3.26Å; Y93-I95 VanDerWaalsContact C-N 3.34Å; Y93-I95 PolarHBondContact O-N 3.39Å; Y93-M96 PolarHBondContact O-N 2.91Å; Y93-D97 PolarHBondContact O-N 3.03Å
94D93.9Very high89.3Confident35 Ų3548.3 Ų48.319%0.18723%0.231CC..Hα-helixtrans-59.4-45176.8-66.6-25.9000111T62 K65 V90 I91 M96 D97 L98T62-D94 HydrophobicContact CG2-CB 3.72Å; K65-D94 VanDerWaalsContact CD-OD2 3.26Å; K65-D94 WeakPolarHBondContact CD-OD2 3.36Å; K65-D94 WeakPolarHBondContact CE-OD2 3.48Å; K65-D94 VanDerWaalsContact NZ-CG 3.29Å; K65-D94 IonicContact NZ-OD1 3.93Å; K65-D94 PolarHBondContact NZ-OD1 3.42Å; K65-D94 IonicContact NZ-OD2 3.28Å; K65-D94 PolarHBondContact NZ-OD2 2.86Å; V90-D94 PolarHBondContact O-N 2.84Å; I91-D94 PolarHBondContact O-N 3.09Å; D94-M96 VanDerWaalsContact C-N 3.35Å; D94-M96 PolarHBondContact O-N 3.14Å; D94-D97 PolarHBondContact O-N 3.32Å; D94-L98 WeakPolarHBondContact O-CB 3.28Å; D94-L98 WeakPolarHBondContact O-CG 3.37Å; D94-L98 PolarHBondContact O-N 3.05Å
95I92.2Very high89.8Confident0 Ų047.7 Ų47.70%023%0.228CC..Hα-helixtrans-64.4-39.4178.2-69.8168.8000111.4I91 Q92 Y93 N99 L140 V141 F144 L312 I315I91-I95 HydrophobicContact CG2-CD1 3.88Å; I91-I95 HydrophobicContact CG2-CG1 4.44Å; I91-I95 WeakPolarHBondContact O-CG1 3.11Å; I91-I95 PolarHBondContact O-N 2.84Å; Q92-I95 PolarHBondContact O-N 3.47Å; Y93-I95 VanDerWaalsContact C-N 3.34Å; Y93-I95 PolarHBondContact O-N 3.39Å; I95-N99 WeakPolarHBondContact O-CB 3.33Å; I95-N99 PolarHBondContact O-N 2.9Å; I95-L140 HydrophobicContact CG1-CD2 4.23Å; I95-V141 HydrophobicContact CG2-CG2 3.63Å; I95-F144 HydrophobicContact CD1-CB 4.12Å; I95-F144 HydrophobicContact CD1-CD1 3.46Å; I95-F144 VanDerWaalsContact CD1-CD1 3.46Å; I95-F144 HydrophobicContact CD1-CE1 4.1Å; I95-F144 HydrophobicContact CD1-CG 4.03Å; I95-L312 HydrophobicContact CD1-CD1 4.41Å; I95-L312 HydrophobicContact CG2-CD1 3.79Å; I95-I315 HydrophobicContact CG2-CD1 4.42Å; I95-I315 HydrophobicContact CG2-CG2 4.47Å
96M90.3Very high90.2Very high89 Ų8951 Ų5144%0.43824%0.24SC..Hα-helixtrans-64.5-42.3176.1-71.4177.46900111.8Q92 Y93 D94 N99 K100 I315Q92-M96 HydrophobicContact CG-SD 4.39Å; Q92-M96 WeakPolarHBondContact O-CG 3.21Å; Q92-M96 PolarHBondContact O-N 2.91Å; Y93-M96 PolarHBondContact O-N 2.91Å; D94-M96 VanDerWaalsContact C-N 3.35Å; D94-M96 PolarHBondContact O-N 3.14Å; M96-N99 PolarHBondContact O-N 3.3Å; M96-K100 PolarHBondContact O-N 3.04Å; M96-I315 HydrophobicContact CG-CD1 4.08Å
97D92.8Very high90.4Very high76 Ų7648.3 Ų48.341%0.40624%0.235SC..Hα-helixtrans-68.1-42.6177.9-163.752.3000111.4Y93 D94 N99 K100 T101Y93-D97 PolarHBondContact O-N 3.03Å; D94-D97 PolarHBondContact O-N 3.32Å; D97-N99 VanDerWaalsContact C-N 3.29Å; D97-N99 PolarHBondContact O-N 2.92Å; D97-K100 WeakPolarHBondContact O-CA 3.22Å; D97-K100 WeakPolarHBondContact O-CB 3.39Å; D97-K100 PolarHBondContact O-N 3.34Å; D97-K100 VanDerWaalsContact O-N 3.09Å; D97-T101 PolarHBondContact O-N 2.91Å; D97-T101 PolarHBondContact O-OG1 2.86Å
98L94Very high90.3Very high2 Ų247.9 Ų47.91%0.0124%0.235CC..Hα-helixtrans-58.3-40.7171.8-74.8170.5000112M55 E58 L59 D94 K100 T101 K102 L137 L140M55-L98 HydrophobicContact CG-CD2 3.82Å; E58-L98 HydrophobicContact CB-CD2 3.64Å; L59-L98 HydrophobicContact CD2-CD1 3.76Å; L59-L98 HydrophobicContact CD2-CD2 4.38Å; L59-L98 HydrophobicContact CG-CD1 4.11Å; L59-L98 HydrophobicContact CG-CD2 3.89Å; D94-L98 WeakPolarHBondContact O-CB 3.28Å; D94-L98 WeakPolarHBondContact O-CG 3.37Å; D94-L98 PolarHBondContact O-N 3.05Å; L98-K100 VanDerWaalsContact C-N 3.34Å; L98-T101 PolarHBondContact O-N 3.42Å; L98-K102 WeakPolarHBondContact O-CB 3.32Å; L98-K102 PolarHBondContact O-N 2.84Å; L98-L137 HydrophobicContact CB-CD1 3.8Å; L98-L137 HydrophobicContact CB-CD2 4.2Å; L98-L137 HydrophobicContact CD1-CD1 4.08Å; L98-L140 HydrophobicContact CD1-CD2 4.21Å
99N91.1Very high90.3Very high17 Ų1748.8 Ų48.89%0.09124%0.24CC..Hα-helixtrans-66.1-36.7176-169.147.5000112.2I95 M96 D97 K102 L103I95-N99 WeakPolarHBondContact O-CB 3.33Å; I95-N99 PolarHBondContact O-N 2.9Å; M96-N99 PolarHBondContact O-N 3.3Å; D97-N99 VanDerWaalsContact C-N 3.29Å; D97-N99 PolarHBondContact O-N 2.92Å; N99-K102 WeakPolarHBondContact O-CB 3.32Å; N99-K102 WeakPolarHBondContact OD1-CE 3.34Å; N99-K102 PolarHBondContact OD1-NZ 2.57Å; N99-L103 WeakPolarHBondContact O-CG 3.45Å; N99-L103 PolarHBondContact O-N 2.87Å; N99-L103 VanDerWaalsContact O-N 3.12Å
100K92.1Very high90.2Very high119 Ų11949.7 Ų49.752%0.51725%0.252SS..Hα-helixtrans-65.4-45.3172.5-177.9-175.5177.1-174.10111.3M96 D97 L98 K102 L103 Q104M96-K100 PolarHBondContact O-N 3.04Å; D97-K100 WeakPolarHBondContact O-CA 3.22Å; D97-K100 WeakPolarHBondContact O-CB 3.39Å; D97-K100 PolarHBondContact O-N 3.34Å; D97-K100 VanDerWaalsContact O-N 3.09Å; L98-K100 VanDerWaalsContact C-N 3.34Å; K100-K102 VanDerWaalsContact C-N 3.34Å; K100-K102 PolarHBondContact O-N 3.37Å; K100-L103 WeakPolarHBondContact O-CB 3.38Å; K100-L103 PolarHBondContact O-N 3.44Å; K100-Q104 WeakPolarHBondContact O-CG 3.31Å; K100-Q104 PolarHBondContact O-N 2.98Å
101T91.8Very high89.9Confident11 Ų1151.1 Ų51.17%0.06726%0.255CS..Hα-helixtrans-62.1-40.5176.6-63.20000111.5K51 M55 D97 L98 L103 Q104 L105K51-T101 HydrophobicContact CG-CG2 4.17Å; M55-T101 HydrophobicContact CB-CG2 3.8Å; M55-T101 HydrophobicContact CG-CG2 4Å; M55-T101 HydrophobicContact SD-CG2 4.09Å; D97-T101 PolarHBondContact O-N 2.91Å; D97-T101 PolarHBondContact O-OG1 2.86Å; L98-T101 PolarHBondContact O-N 3.42Å; T101-L103 PolarHBondContact O-N 3.25Å; T101-Q104 PolarHBondContact O-N 3.33Å; T101-L105 HydrophobicContact CG2-CD1 4.3Å; T101-L105 WeakPolarHBondContact O-CG 3.37Å; T101-L105 PolarHBondContact O-N 2.83Å
102K90.1Very high89.6Confident10 Ų1051.2 Ų51.24%0.04326%0.256CS..Hα-helixtrans-54.1-51.2171.1-179.8-162.276.3-175.20111.7M55 L98 N99 K100 Q104 L105 K106 E134 L137 F319M55-K102 HydrophobicContact CE-CB 3.95Å; L98-K102 WeakPolarHBondContact O-CB 3.32Å; L98-K102 PolarHBondContact O-N 2.84Å; N99-K102 WeakPolarHBondContact O-CB 3.32Å; N99-K102 WeakPolarHBondContact OD1-CE 3.34Å; N99-K102 PolarHBondContact OD1-NZ 2.57Å; K100-K102 VanDerWaalsContact C-N 3.34Å; K100-K102 PolarHBondContact O-N 3.37Å; K102-Q104 VanDerWaalsContact C-N 3.31Å; K102-Q104 PolarHBondContact O-N 2.99Å; K102-L105 WeakPolarHBondContact O-CB 3.43Å; K102-L105 PolarHBondContact O-N 2.9Å; K102-K106 PolarHBondContact O-N 2.9Å; K102-E134 HydrophobicContact CD-CG 3.93Å; K102-E134 HydrophobicContact CG-CG 3.88Å; K102-L137 HydrophobicContact CB-CD2 4.34Å; K102-L137 HydrophobicContact CD-CD2 4.27Å; K102-F319 HydrophobicContact CD-CE1 3.87Å; K102-F319 HydrophobicContact CD-CZ 4.15Å
103L89.6Confident89.2Confident88 Ų8857.4 Ų57.446%0.46128%0.283SS..Hα-helixtrans-59.5-44.3179.4-71.9162.2000111.2N99 K100 T101 L105 K106 T107N99-L103 WeakPolarHBondContact O-CG 3.45Å; N99-L103 PolarHBondContact O-N 2.87Å; N99-L103 VanDerWaalsContact O-N 3.12Å; K100-L103 WeakPolarHBondContact O-CB 3.38Å; K100-L103 PolarHBondContact O-N 3.44Å; T101-L103 PolarHBondContact O-N 3.25Å; L103-L105 VanDerWaalsContact C-N 3.35Å; L103-L105 PolarHBondContact O-N 3.09Å; L103-K106 PolarHBondContact O-N 3.35Å; L103-T107 PolarHBondContact O-N 3.31Å; L103-T107 VanDerWaalsContact O-N 3.14Å; L103-T107 PolarHBondContact O-OG1 2.87Å
104Q91.3Very high88.7Confident76 Ų7657.4 Ų57.436%0.35529%0.288SS..Hα-helixtrans-67.4-34177.9-63.1174.9-1300112.9K100 T101 K102 T107 S108K100-Q104 WeakPolarHBondContact O-CG 3.31Å; K100-Q104 PolarHBondContact O-N 2.98Å; T101-Q104 PolarHBondContact O-N 3.33Å; K102-Q104 VanDerWaalsContact C-N 3.31Å; K102-Q104 PolarHBondContact O-N 2.99Å; Q104-T107 PolarHBondContact O-N 2.94Å; Q104-S108 PolarHBondContact O-N 3.46Å; Q104-S108 PolarHBondContact O-OG 2.93Å
105L90.8Very high87.6Confident1 Ų159.7 Ų59.71%0.00530%0.298CS..Hα-helixtrans-64-42.7172.9-80.8170.3000111.3L48 K51 M55 T101 K102 L103 T107 S108 I109 V130 L133L48-L105 HydrophobicContact CG-CD2 4.24Å; K51-L105 HydrophobicContact CB-CD2 3.85Å; K51-L105 HydrophobicContact CD-CD2 3.86Å; K51-L105 HydrophobicContact CD-CG 4.09Å; K51-L105 HydrophobicContact CG-CD2 3.74Å; K51-L105 HydrophobicContact CG-CG 4.06Å; M55-L105 HydrophobicContact CB-CD1 4.3Å; M55-L105 HydrophobicContact SD-CD1 3.42Å; M55-L105 WeakPolarHBondContact SD-CD1 3.36Å; T101-L105 HydrophobicContact CG2-CD1 4.3Å; T101-L105 WeakPolarHBondContact O-CG 3.37Å; T101-L105 PolarHBondContact O-N 2.83Å; K102-L105 WeakPolarHBondContact O-CB 3.43Å; K102-L105 PolarHBondContact O-N 2.9Å; L103-L105 VanDerWaalsContact C-N 3.35Å; L103-L105 PolarHBondContact O-N 3.09Å; L105-T107 VanDerWaalsContact C-N 3.31Å; L105-T107 PolarHBondContact O-N 3.32Å; L105-S108 WeakPolarHBondContact O-CB 3.35Å; L105-S108 PolarHBondContact O-N 2.93Å; L105-S108 VanDerWaalsContact O-N 3.11Å; L105-I109 WeakPolarHBondContact O-CG1 3.37Å; L105-I109 PolarHBondContact O-N 3.45Å; L105-V130 HydrophobicContact CB-CG2 4.49Å; L105-L133 HydrophobicContact CD1-CD1 4.32Å
106K88.5Confident86.6Confident87 Ų8760.6 Ų60.638%0.37830%0.304SS..Hα-helixtrans-59.2-40.9174.3-72.5-162.4174.8-170.20112.8K102 L103 I109 S110 E134K102-K106 PolarHBondContact O-N 2.9Å; L103-K106 PolarHBondContact O-N 3.35Å; K106-I109 PolarHBondContact O-N 3.45Å; K106-S110 PolarHBondContact O-N 3.32Å; K106-S110 PolarHBondContact O-OG 3.3Å; K106-E134 WeakPolarHBondContact CE-OE1 3.5Å; K106-E134 WeakPolarHBondContact CE-OE2 3.34Å; K106-E134 IonicContact NZ-OE1 3.58Å; K106-E134 PolarHBondContact NZ-OE1 2.97Å; K106-E134 IonicContact NZ-OE2 2.89Å; K106-E134 PolarHBondContact NZ-OE2 3.48Å
107T88.3Confident85.4Confident83 Ų8361.3 Ų61.351%0.50931%0.313SS..Hα-helixtrans-62.9-45.4173.5-51.90000110.9L103 Q104 L105 I109 S110 E111L103-T107 PolarHBondContact O-N 3.31Å; L103-T107 VanDerWaalsContact O-N 3.14Å; L103-T107 PolarHBondContact O-OG1 2.87Å; Q104-T107 PolarHBondContact O-N 2.94Å; L105-T107 VanDerWaalsContact C-N 3.31Å; L105-T107 PolarHBondContact O-N 3.32Å; T107-I109 VanDerWaalsContact C-N 3.31Å; T107-I109 PolarHBondContact O-N 3.43Å; T107-S110 WeakPolarHBondContact O-CB 3.49Å; T107-S110 PolarHBondContact O-N 2.99Å; T107-E111 PolarHBondContact O-N 3.43Å; T107-E111 VanDerWaalsContact O-N 3.16Å
108S85.6Confident84Confident22 Ų2259.4 Ų59.415%0.15431%0.308CS..Hα-helixtrans-63.1-34.2179.2-51.70000112.6Q104 L105 S110 E111 V112Q104-S108 PolarHBondContact O-N 3.46Å; Q104-S108 PolarHBondContact O-OG 2.93Å; L105-S108 WeakPolarHBondContact O-CB 3.35Å; L105-S108 PolarHBondContact O-N 2.93Å; L105-S108 VanDerWaalsContact O-N 3.11Å; S108-S110 VanDerWaalsContact C-N 3.3Å; S108-S110 PolarHBondContact O-N 3.42Å; S108-E111 PolarHBondContact O-N 3.07Å; S108-V112 WeakPolarHBondContact O-CG2 3.44Å; S108-V112 PolarHBondContact O-N 3.4Å
109I86.5Confident82.7Confident23 Ų2361.8 Ų61.812%0.11833%0.333CS..Hα-helixtrans-60.9-42.3173.1-70.2164.2000110.7L48 L105 K106 T107 E111 V112 K113 I126 D127 V130L48-I109 HydrophobicContact CD1-CG1 3.81Å; L105-I109 WeakPolarHBondContact O-CG1 3.37Å; L105-I109 PolarHBondContact O-N 3.45Å; K106-I109 PolarHBondContact O-N 3.45Å; T107-I109 VanDerWaalsContact C-N 3.31Å; T107-I109 PolarHBondContact O-N 3.43Å; I109-E111 VanDerWaalsContact C-N 3.33Å; I109-E111 PolarHBondContact O-N 2.65Å; I109-V112 PolarHBondContact O-N 3.39Å; I109-K113 WeakPolarHBondContact O-CB 3.46Å; I109-K113 PolarHBondContact O-N 3.17Å; I109-I126 HydrophobicContact CG1-CG2 4.03Å; I109-D127 WeakPolarHBondContact CG2-OD1 3.42Å; I109-V130 HydrophobicContact CD1-CB 3.67Å; I109-V130 HydrophobicContact CD1-CG1 3.69Å; I109-V130 HydrophobicContact CD1-CG2 3.51Å; I109-V130 HydrophobicContact CG1-CG2 4.18Å
110S84.7Confident81.8Confident76 Ų7665.1 Ų65.153%0.53135%0.354SS..Hα-helixtrans-64.5-41.3-179.2-58.30000110.8K106 T107 S108 K113 E114K106-S110 PolarHBondContact O-N 3.32Å; K106-S110 PolarHBondContact O-OG 3.3Å; T107-S110 WeakPolarHBondContact O-CB 3.49Å; T107-S110 PolarHBondContact O-N 2.99Å; S108-S110 VanDerWaalsContact C-N 3.3Å; S108-S110 PolarHBondContact O-N 3.42Å; S110-K113 PolarHBondContact O-N 3.06Å; S110-E114 PolarHBondContact O-N 3.41Å
111E84Confident80.9Confident83 Ų8365.2 Ų65.239%0.38836%0.356SS..Hα-helixtrans-61.9-45.3173.4-65.5172.3-176.600111.8T107 S108 I109 K113 E114 H115T107-E111 PolarHBondContact O-N 3.43Å; T107-E111 VanDerWaalsContact O-N 3.16Å; S108-E111 PolarHBondContact O-N 3.07Å; I109-E111 VanDerWaalsContact C-N 3.33Å; I109-E111 PolarHBondContact O-N 2.65Å; E111-K113 VanDerWaalsContact C-N 3.35Å; E111-K113 PolarHBondContact O-N 3.04Å; E111-E114 PolarHBondContact O-N 3.15Å; E111-H115 PolarHBondContact O-N 2.86Å; E111-H115 PolarHBondContact O-ND1 2.85Å
112V83.5Confident80.2Confident3 Ų367.6 Ų67.62%0.01837%0.367CS..Hα-helixtrans-61.8-43.3175.8169.80000110.6T45 L48 S108 I109 E114 H115 S116 L123 I126T45-V112 HydrophobicContact CG2-CG1 3.72Å; T45-V112 HydrophobicContact CG2-CG2 4.16Å; L48-V112 HydrophobicContact CD1-CG2 3.91Å; S108-V112 WeakPolarHBondContact O-CG2 3.44Å; S108-V112 PolarHBondContact O-N 3.4Å; I109-V112 PolarHBondContact O-N 3.39Å; V112-E114 VanDerWaalsContact C-N 3.3Å; V112-E114 PolarHBondContact O-N 3.45Å; V112-H115 PolarHBondContact O-N 3.3Å; V112-S116 WeakPolarHBondContact O-CA 3.12Å; V112-S116 WeakPolarHBondContact O-CB 3.45Å; V112-S116 PolarHBondContact O-N 3.04Å; V112-L123 HydrophobicContact CG1-CD2 3.85Å; V112-I126 HydrophobicContact CG1-CD1 4.07Å
113K82Confident79.8Confident149 Ų14968.8 Ų68.865%0.64837%0.373SS*.Hα-helixtrans-65.5-32.7-179.7-173.7175.2179.4177.20112.8I109 S110 E111 L123I109-K113 WeakPolarHBondContact O-CB 3.46Å; I109-K113 PolarHBondContact O-N 3.17Å; S110-K113 PolarHBondContact O-N 3.06Å; E111-K113 VanDerWaalsContact C-N 3.35Å; E111-K113 PolarHBondContact O-N 3.04Å; K113-L123 HydrophobicContact CB-CD2 4.41Å
114E79.3Confident79.2Confident156 Ų15667.9 Ų67.973%0.72937%0.365SS*.Hα-helixtrans-74.6-41.9177.2-173.6179.3-178.100112.3S110 E111 V112S110-E114 PolarHBondContact O-N 3.41Å; E111-E114 PolarHBondContact O-N 3.15Å; V112-E114 VanDerWaalsContact C-N 3.3Å; V112-E114 PolarHBondContact O-N 3.45Å
115H71.8Confident78.8Confident83 Ų8369.2 Ų69.238%0.38437%0.372SS..Hα-helixtrans-92.6-16.9-174.1-63.879.4000113.6Y44 E111 V112 T117Y44-H115 HydrophobicContact CD2-CB 4.37Å; Y44-H115 HydrophobicContact CE2-CB 4.36Å; E111-H115 PolarHBondContact O-N 2.86Å; E111-H115 PolarHBondContact O-ND1 2.85Å; V112-H115 PolarHBondContact O-N 3.3Å; H115-T117 PolarHBondContact O-N 3.07Å
116S69.7Low78.5Confident18 Ų1869.2 Ų69.213%0.12637%0.372CS..  trans-79.3112.8-177.31730000111.1V112 A118V112-S116 WeakPolarHBondContact O-CA 3.12Å; V112-S116 WeakPolarHBondContact O-CB 3.45Å; V112-S116 PolarHBondContact O-N 3.04Å; S116-A118 WeakPolarHBondContact OG-CA 3.06Å; S116-A118 WeakPolarHBondContact OG-CB 3.38Å; S116-A118 PolarHBondContact OG-N 3.22Å
117T65.2Low78.3Confident104 Ų10468.1 Ų68.164%0.63837%0.37SS*.  trans-79.8-2.1157.662.50000112D41 H115D41-T117 PolarHBondContact OD2-N 3.49Å; D41-T117 VanDerWaalsContact OD2-N 3.17Å; D41-T117 PolarHBondContact OD2-OG1 2.94Å; H115-T117 PolarHBondContact O-N 3.07Å
118A63.2Low78.1Confident37 Ų3766.9 Ų66.931%0.30636%0.36SS..SBendtrans-63.8148.6-175.500000112.2S116 H122S116-A118 WeakPolarHBondContact OG-CA 3.06Å; S116-A118 WeakPolarHBondContact OG-CB 3.38Å; S116-A118 PolarHBondContact OG-N 3.22Å; A118-H122 HydrophobicContact CB-CB 4.42Å
119G68Low78.2Confident51 Ų5168 Ų6853%0.52636%0.363SS..  trans-53.9146.8-176.600000112.7Q121 H122G119-Q121 PolarHBondContact O-N 3.46Å; G119-H122 PolarHBondContact O-N 2.97Å
120V72.5Confident78.2Confident87 Ų8767 Ų6753%0.52736%0.359SS..Hα-helixtrans-45.4-30.8-179.4178.90000113.2K124V120-K124 HydrophobicContact CG1-CD 4.07Å; V120-K124 HydrophobicContact CG1-CG 4.39Å; V120-K124 WeakPolarHBondContact O-CB 3.3Å; V120-K124 VanDerWaalsContact O-CG 3.28Å; V120-K124 WeakPolarHBondContact O-CG 3.26Å; V120-K124 PolarHBondContact O-N 2.85Å; V120-K124 VanDerWaalsContact O-N 3.09Å
121Q72.6Confident78.2Confident122 Ų12265.5 Ų65.557%0.5734%0.344SS*.Hα-helixtrans-65.6-40.8179-66.2-179.8-6.700113.9G119 K124 H125G119-Q121 PolarHBondContact O-N 3.46Å; Q121-K124 PolarHBondContact O-N 3.48Å; Q121-H125 PolarHBondContact O-N 2.86Å
122H78Confident78.2Confident61 Ų6162.6 Ų62.628%0.28234%0.336SS..Hα-helixtrans-67.6-42.6-178.5176.9-89.2000111.1T45 A118 G119 H125 I126T45-H122 WeakPolarHBondContact CG2-CE1 3.48Å; A118-H122 HydrophobicContact CB-CB 4.42Å; G119-H122 PolarHBondContact O-N 2.97Å; H122-H125 PolarHBondContact O-N 3.4Å; H122-I126 WeakPolarHBondContact CE1-CD1 3.3Å; H122-I126 PolarHBondContact O-N 3.12Å
123L80Confident78.5Confident34 Ų3463.2 Ų63.218%0.17834%0.339CS..Hα-helixtrans-61.1-46.2174.3-70.8166.6000111.4V112 K113 H125 I126 D127V112-L123 HydrophobicContact CG1-CD2 3.85Å; K113-L123 HydrophobicContact CB-CD2 4.41Å; L123-H125 VanDerWaalsContact C-N 3.31Å; L123-H125 PolarHBondContact O-N 3.33Å; L123-I126 PolarHBondContact O-N 2.69Å; L123-D127 PolarHBondContact O-N 3.29Å
124K78.7Confident78.8Confident69 Ų6956.4 Ų56.430%0.331%0.31SS..Hα-helixtrans-57.5-42.4174.9-76.9177.6175.4-173.80112.7V120 Q121 D127 L128 N339V120-K124 HydrophobicContact CG1-CD 4.07Å; V120-K124 HydrophobicContact CG1-CG 4.39Å; V120-K124 WeakPolarHBondContact O-CB 3.3Å; V120-K124 VanDerWaalsContact O-CG 3.28Å; V120-K124 WeakPolarHBondContact O-CG 3.26Å; V120-K124 PolarHBondContact O-N 2.85Å; V120-K124 VanDerWaalsContact O-N 3.09Å; Q121-K124 PolarHBondContact O-N 3.48Å; K124-D127 PolarHBondContact O-N 3.39Å; K124-L128 WeakPolarHBondContact O-CB 3.42Å; K124-L128 VanDerWaalsContact O-CG 3.3Å; K124-L128 WeakPolarHBondContact O-CG 3.39Å; K124-L128 PolarHBondContact O-N 3.29Å; K124-N339 VanDerWaalsContact NZ-CB 3.28Å
125H81.3Confident79.1Confident105 Ų10553 Ų5349%0.48629%0.291SS..Hα-helixtrans-63.6-42.5177.6179.461.8000112.1Q121 H122 L123 L128 I129Q121-H125 PolarHBondContact O-N 2.86Å; H122-H125 PolarHBondContact O-N 3.4Å; L123-H125 VanDerWaalsContact C-N 3.31Å; L123-H125 PolarHBondContact O-N 3.33Å; H125-L128 WeakPolarHBondContact O-CB 3.15Å; H125-L128 PolarHBondContact O-N 2.82Å; H125-I129 WeakPolarHBondContact NE2-CD1 3.34Å; H125-I129 WeakPolarHBondContact O-CG1 3.41Å; H125-I129 PolarHBondContact O-N 3.41Å
126I85.4Confident79.8Confident1 Ų154.4 Ų54.41%0.00530%0.297CS..Hα-helixtrans-61.7-46.2175-76.8-178.4000111.4T45 L48 I109 V112 H122 L123 L128 I129 V130T45-I126 HydrophobicContact CG2-CD1 4.09Å; L48-I126 HydrophobicContact CD1-CD1 4.5Å; L48-I126 HydrophobicContact CD1-CG2 3.64Å; L48-I126 HydrophobicContact CD2-CD1 4.45Å; L48-I126 HydrophobicContact CD2-CG1 4.37Å; L48-I126 HydrophobicContact CD2-CG2 3.75Å; L48-I126 HydrophobicContact CG-CG2 4.39Å; I109-I126 HydrophobicContact CG1-CG2 4.03Å; V112-I126 HydrophobicContact CG1-CD1 4.07Å; H122-I126 WeakPolarHBondContact CE1-CD1 3.3Å; H122-I126 PolarHBondContact O-N 3.12Å; L123-I126 PolarHBondContact O-N 2.69Å; I126-L128 VanDerWaalsContact C-N 3.27Å; I126-L128 PolarHBondContact O-N 3.44Å; I126-I129 PolarHBondContact O-N 2.85Å; I126-V130 PolarHBondContact O-N 3.49Å
127D84Confident80.8Confident63 Ų6353.5 Ų53.534%0.33729%0.291SS..Hα-helixtrans-58.8-42.5178-71.7-22.7000110.6I109 L123 K124 I129 V130 I131I109-D127 WeakPolarHBondContact CG2-OD1 3.42Å; L123-D127 PolarHBondContact O-N 3.29Å; K124-D127 PolarHBondContact O-N 3.39Å; D127-I129 PolarHBondContact O-N 2.92Å; D127-V130 PolarHBondContact O-N 2.79Å; D127-I131 WeakPolarHBondContact O-CB 3.42Å; D127-I131 VanDerWaalsContact O-CG1 3.23Å; D127-I131 WeakPolarHBondContact O-CG1 3.45Å; D127-I131 PolarHBondContact O-N 3.29Å
128L83.9Confident81.7Confident57 Ų5748.7 Ų48.730%0.29826%0.262SS..Hα-helixtrans-62.6-41.5177-78166.5000113.8K124 H125 I126 V130 I131 G132K124-L128 WeakPolarHBondContact O-CB 3.42Å; K124-L128 VanDerWaalsContact O-CG 3.3Å; K124-L128 WeakPolarHBondContact O-CG 3.39Å; K124-L128 PolarHBondContact O-N 3.29Å; H125-L128 WeakPolarHBondContact O-CB 3.15Å; H125-L128 PolarHBondContact O-N 2.82Å; I126-L128 VanDerWaalsContact C-N 3.27Å; I126-L128 PolarHBondContact O-N 3.44Å; L128-V130 VanDerWaalsContact C-N 3.28Å; L128-V130 PolarHBondContact O-N 3.48Å; L128-I131 PolarHBondContact O-N 2.94Å; L128-G132 PolarHBondContact O-N 3.5Å
129I87.6Confident82.8Confident45 Ų4552.1 Ų52.123%0.23127%0.27CS..Hα-helixtrans-58.3-47176.7-70.6164.2000109.6H125 I126 D127 G132 L133H125-I129 WeakPolarHBondContact NE2-CD1 3.34Å; H125-I129 WeakPolarHBondContact O-CG1 3.41Å; H125-I129 PolarHBondContact O-N 3.41Å; I126-I129 PolarHBondContact O-N 2.85Å; D127-I129 PolarHBondContact O-N 2.92Å; I129-G132 PolarHBondContact O-N 2.99Å; I129-L133 HydrophobicContact CG2-CD1 4.01Å; I129-L133 WeakPolarHBondContact O-CG 3.37Å; I129-L133 PolarHBondContact O-N 3.33Å
130V87.4Confident83.9Confident4 Ų449.7 Ų49.72%0.02425%0.245CC..Hα-helixtrans-70.5-41.2-177.2174.30000111.6L105 I109 I126 D127 L128 G132 L133 E134L105-V130 HydrophobicContact CB-CG2 4.49Å; I109-V130 HydrophobicContact CD1-CB 3.67Å; I109-V130 HydrophobicContact CD1-CG1 3.69Å; I109-V130 HydrophobicContact CD1-CG2 3.51Å; I109-V130 HydrophobicContact CG1-CG2 4.18Å; I126-V130 PolarHBondContact O-N 3.49Å; D127-V130 PolarHBondContact O-N 2.79Å; L128-V130 VanDerWaalsContact C-N 3.28Å; L128-V130 PolarHBondContact O-N 3.48Å; V130-G132 VanDerWaalsContact C-N 3.3Å; V130-G132 PolarHBondContact O-N 3.23Å; V130-L133 PolarHBondContact O-N 3.48Å; V130-E134 HydrophobicContact CG1-CG 4.41Å; V130-E134 WeakPolarHBondContact CG1-OE1 3.38Å; V130-E134 WeakPolarHBondContact O-CB 3.46Å; V130-E134 WeakPolarHBondContact O-CG 3.35Å; V130-E134 PolarHBondContact O-N 2.93Å
131I83.2Confident84.6Confident43 Ų4345.5 Ų45.522%0.22122%0.22CC..Hα-helixtrans-57.2-44.9172.5-69.5165000110.7D127 L128 L133 E134 Y135 V330D127-I131 WeakPolarHBondContact O-CB 3.42Å; D127-I131 VanDerWaalsContact O-CG1 3.23Å; D127-I131 WeakPolarHBondContact O-CG1 3.45Å; D127-I131 PolarHBondContact O-N 3.29Å; L128-I131 PolarHBondContact O-N 2.94Å; I131-L133 PolarHBondContact O-N 3.44Å; I131-E134 PolarHBondContact O-N 3.43Å; I131-Y135 PolarHBondContact O-N 3.35Å; I131-V330 HydrophobicContact CG2-CG2 3.62Å
132G85.7Confident85.2Confident22 Ų2241.6 Ų41.623%0.22721%0.206CC..Hα-helixtrans-61.6-43.5176.600000112.9L128 I129 V130 Y135 H136L128-G132 PolarHBondContact O-N 3.5Å; I129-G132 PolarHBondContact O-N 2.99Å; V130-G132 VanDerWaalsContact C-N 3.3Å; V130-G132 PolarHBondContact O-N 3.23Å; G132-Y135 PolarHBondContact O-N 2.96Å; G132-H136 PolarHBondContact O-CD2 2.94Å; G132-H136 VanDerWaalsContact O-CD2 3.23Å; G132-H136 PolarHBondContact O-N 2.98Å
133L89.6Confident85.7Confident16 Ų1640.4 Ų40.48%0.08420%0.201CC..Hα-helixtrans-65.3-37.5175.7-70170.5000112.3M55 L59 L105 I129 V130 I131 H136 L137M55-L133 HydrophobicContact CE-CB 4.28Å; M55-L133 HydrophobicContact SD-CB 4.3Å; M55-L133 HydrophobicContact SD-CD1 4.23Å; L59-L133 HydrophobicContact CD1-CD2 3.68Å; L105-L133 HydrophobicContact CD1-CD1 4.32Å; I129-L133 HydrophobicContact CG2-CD1 4.01Å; I129-L133 WeakPolarHBondContact O-CG 3.37Å; I129-L133 PolarHBondContact O-N 3.33Å; V130-L133 PolarHBondContact O-N 3.48Å; I131-L133 PolarHBondContact O-N 3.44Å; L133-H136 PolarHBondContact O-N 3.22Å; L133-L137 WeakPolarHBondContact O-CB 3.41Å; L133-L137 PolarHBondContact O-N 2.9Å
134E86.7Confident86.2Confident7 Ų738.8 Ų38.83%0.03319%0.192CC..Hα-helixtrans-64.2-44.3175.7-78.3178.4-148.400112.1K102 K106 V130 I131 L137 S138 L322K102-E134 HydrophobicContact CD-CG 3.93Å; K102-E134 HydrophobicContact CG-CG 3.88Å; K106-E134 WeakPolarHBondContact CE-OE1 3.5Å; K106-E134 WeakPolarHBondContact CE-OE2 3.34Å; K106-E134 IonicContact NZ-OE1 3.58Å; K106-E134 PolarHBondContact NZ-OE1 2.97Å; K106-E134 IonicContact NZ-OE2 2.89Å; K106-E134 PolarHBondContact NZ-OE2 3.48Å; V130-E134 HydrophobicContact CG1-CG 4.41Å; V130-E134 WeakPolarHBondContact CG1-OE1 3.38Å; V130-E134 WeakPolarHBondContact O-CB 3.46Å; V130-E134 WeakPolarHBondContact O-CG 3.35Å; V130-E134 PolarHBondContact O-N 2.93Å; I131-E134 PolarHBondContact O-N 3.43Å; E134-L137 PolarHBondContact O-N 2.86Å; E134-S138 WeakPolarHBondContact O-CB 3.23Å; E134-S138 PolarHBondContact O-N 3.22Å; E134-L322 HydrophobicContact CB-CD2 4.48Å; E134-L322 WeakPolarHBondContact OE2-CD1 3.47Å
135Y85.8Confident86.6Confident84 Ų8440.3 Ų40.333%0.32920%0.196SC..Hα-helixtrans-59.3-49.2174.5176.5-93.6000111.3I131 G132 L137 S138 F139I131-Y135 PolarHBondContact O-N 3.35Å; G132-Y135 PolarHBondContact O-N 2.96Å; Y135-L137 PolarHBondContact O-N 3.27Å; Y135-S138 WeakPolarHBondContact O-CB 3.46Å; Y135-S138 PolarHBondContact O-N 3.41Å; Y135-F139 PolarHBondContact O-N 3.4Å
136H87.3Confident86.9Confident112 Ų11240 Ų4052%0.51920%0.201SC..Hα-helixtrans-62.8-40.3179.2-84.1-66.7000112.8L59 G132 L133 F139 L140L59-H136 HydrophobicContact CD1-CB 4.39Å; G132-H136 PolarHBondContact O-CD2 2.94Å; G132-H136 VanDerWaalsContact O-CD2 3.23Å; G132-H136 PolarHBondContact O-N 2.98Å; L133-H136 PolarHBondContact O-N 3.22Å; H136-F139 PolarHBondContact O-N 3.37Å; H136-L140 WeakPolarHBondContact O-CB 3Å; H136-L140 PolarHBondContact O-N 3.05Å
137L90.2Very high86.9Confident0 Ų040 Ų400%020%0.201CC..Hα-helixtrans-64.6-41.9175179.855.8000111.4M55 L59 L98 K102 L133 E134 Y135 F139 L140 V141 F319M55-L137 HydrophobicContact CE-CB 4.45Å; M55-L137 HydrophobicContact CE-CD2 3.89Å; L59-L137 HydrophobicContact CD2-CB 4.06Å; L59-L137 HydrophobicContact CD2-CD1 4.07Å; L98-L137 HydrophobicContact CB-CD1 3.8Å; L98-L137 HydrophobicContact CB-CD2 4.2Å; L98-L137 HydrophobicContact CD1-CD1 4.08Å; K102-L137 HydrophobicContact CB-CD2 4.34Å; K102-L137 HydrophobicContact CD-CD2 4.27Å; L133-L137 WeakPolarHBondContact O-CB 3.41Å; L133-L137 PolarHBondContact O-N 2.9Å; E134-L137 PolarHBondContact O-N 2.86Å; Y135-L137 PolarHBondContact O-N 3.27Å; L137-F139 VanDerWaalsContact C-N 3.35Å; L137-F139 PolarHBondContact O-N 3.01Å; L137-L140 HydrophobicContact CD1-CD2 4.48Å; L137-L140 PolarHBondContact O-N 3.18Å; L137-V141 HydrophobicContact CD1-CG2 4.22Å; L137-V141 WeakPolarHBondContact O-CG2 3.48Å; L137-V141 PolarHBondContact O-N 2.96Å; L137-F319 HydrophobicContact CB-CZ 4.38Å; L137-F319 HydrophobicContact CD2-CE1 4.25Å; L137-F319 HydrophobicContact CD2-CE2 4.38Å; L137-F319 HydrophobicContact CD2-CZ 3.54Å; L137-F319 HydrophobicContact CG-CE1 4.29Å; L137-F319 HydrophobicContact CG-CE2 4.09Å; L137-F319 HydrophobicContact CG-CZ 3.59Å
138S85.3Confident87Confident2 Ų237 Ų371%0.01419%0.185CC..Hα-helixtrans-62.1-42.8175-179.70000112.2E134 Y135 V141 S142 F319 V323E134-S138 WeakPolarHBondContact O-CB 3.23Å; E134-S138 PolarHBondContact O-N 3.22Å; Y135-S138 WeakPolarHBondContact O-CB 3.46Å; Y135-S138 PolarHBondContact O-N 3.41Å; S138-V141 PolarHBondContact O-N 3.28Å; S138-S142 PolarHBondContact O-N 2.97Å; S138-S142 PolarHBondContact O-OG 3.26Å; S138-F319 WeakPolarHBondContact OG-CB 3.5Å; S138-V323 WeakPolarHBondContact OG-CG2 3.45Å
139F86.3Confident87Confident109 Ų10937.3 Ų37.348%0.47819%0.185SC..Hα-helixtrans-60-47.9176.6175.1-94.8000110.5Y135 H136 L137 V141 S142 E143Y135-F139 PolarHBondContact O-N 3.4Å; H136-F139 PolarHBondContact O-N 3.37Å; L137-F139 VanDerWaalsContact C-N 3.35Å; L137-F139 PolarHBondContact O-N 3.01Å; F139-V141 VanDerWaalsContact C-N 3.34Å; F139-V141 PolarHBondContact O-N 3.47Å; F139-S142 PolarHBondContact O-N 3.09Å; F139-E143 WeakPolarHBondContact CE1-OE2 3.39Å; F139-E143 VanDerWaalsContact O-CB 3.31Å; F139-E143 WeakPolarHBondContact O-CB 3.19Å; F139-E143 PolarHBondContact O-N 3.44Å
140L89.8Confident86.7Confident0 Ų040.8 Ų40.80%020%0.2CC..Hα-helixtrans-58.7-42.9177.3176.566.8000112.4L59 T62 V63 M66 I95 L98 H136 L137 E143 F144L59-L140 HydrophobicContact CD2-CD2 4.01Å; T62-L140 HydrophobicContact CG2-CD1 4.44Å; T62-L140 HydrophobicContact CG2-CD2 3.71Å; V63-L140 HydrophobicContact CG2-CD1 3.99Å; M66-L140 HydrophobicContact CB-CD1 4.22Å; M66-L140 HydrophobicContact CE-CD1 3.75Å; M66-L140 HydrophobicContact CG-CD1 4.42Å; I95-L140 HydrophobicContact CG1-CD2 4.23Å; L98-L140 HydrophobicContact CD1-CD2 4.21Å; H136-L140 WeakPolarHBondContact O-CB 3Å; H136-L140 PolarHBondContact O-N 3.05Å; L137-L140 HydrophobicContact CD1-CD2 4.48Å; L137-L140 PolarHBondContact O-N 3.18Å; L140-E143 PolarHBondContact O-N 3.14Å; L140-F144 WeakPolarHBondContact O-CB 3.48Å; L140-F144 PolarHBondContact O-N 2.93Å
141V88.5Confident86.2Confident0 Ų041.4 Ų41.40%020%0.203CC..Hα-helixtrans-64.4-44.6178.31710000111.1I95 L137 S138 F139 F144 R145 L312 I315 Y316 F319I95-V141 HydrophobicContact CG2-CG2 3.63Å; L137-V141 HydrophobicContact CD1-CG2 4.22Å; L137-V141 WeakPolarHBondContact O-CG2 3.48Å; L137-V141 PolarHBondContact O-N 2.96Å; S138-V141 PolarHBondContact O-N 3.28Å; F139-V141 VanDerWaalsContact C-N 3.34Å; F139-V141 PolarHBondContact O-N 3.47Å; V141-F144 PolarHBondContact O-N 2.8Å; V141-R145 PolarHBondContact O-N 3.5Å; V141-L312 HydrophobicContact CG1-CD1 4.02Å; V141-L312 HydrophobicContact CG1-CD2 4.11Å; V141-L312 HydrophobicContact CG1-CG 3.92Å; V141-I315 HydrophobicContact CG1-CG2 4.49Å; V141-I315 HydrophobicContact CG2-CG2 4.25Å; V141-Y316 HydrophobicContact CG1-CD2 4.31Å; V141-F319 HydrophobicContact CB-CD2 4.27Å; V141-F319 HydrophobicContact CB-CE2 4.47Å; V141-F319 HydrophobicContact CG1-CD2 4.27Å; V141-F319 HydrophobicContact CG2-CD2 4.03Å; V141-F319 HydrophobicContact CG2-CE2 3.74Å
142S85.6Confident86.1Confident40 Ų4042.3 Ų42.328%0.2821%0.205SC..Hα-helixtrans-63.9-44.1176.3-67.30000111.8S138 F139 R145 V146S138-S142 PolarHBondContact O-N 2.97Å; S138-S142 PolarHBondContact O-OG 3.26Å; F139-S142 PolarHBondContact O-N 3.09Å; S142-R145 PolarHBondContact O-N 2.92Å; S142-V146 WeakPolarHBondContact O-CG2 3.17Å; S142-V146 PolarHBondContact O-N 3.48Å
143E87.3Confident85.7Confident36 Ų3645.1 Ų45.117%0.16822%0.218CC..Hα-helixtrans-61.9-44176.6-173.2-180-162.900111.3M66 K70 F139 L140 R145 V146 V147M66-E143 HydrophobicContact CG-CG 4.35Å; K70-E143 WeakPolarHBondContact CE-OE1 3.46Å; K70-E143 IonicContact NZ-OE1 3.66Å; K70-E143 PolarHBondContact NZ-OE1 3.05Å; F139-E143 WeakPolarHBondContact CE1-OE2 3.39Å; F139-E143 VanDerWaalsContact O-CB 3.31Å; F139-E143 WeakPolarHBondContact O-CB 3.19Å; F139-E143 PolarHBondContact O-N 3.44Å; L140-E143 PolarHBondContact O-N 3.14Å; E143-R145 VanDerWaalsContact C-N 3.31Å; E143-R145 PolarHBondContact O-N 3.49Å; E143-V146 PolarHBondContact O-N 2.79Å; E143-V147 WeakPolarHBondContact O-CB 3.34Å; E143-V147 VanDerWaalsContact O-CG2 3.27Å; E143-V147 WeakPolarHBondContact O-CG2 3.46Å; E143-V147 PolarHBondContact O-N 3.32Å
144F89.9Confident84.8Confident0 Ų046.9 Ų46.90%023%0.232CC..Hα-helixtrans-59.5-43.6176.3-171.3-146.4000111.9M66 L69 I88 I91 Q92 I95 L140 V141 V147 L148 T308 L312M66-F144 HydrophobicContact CE-CB 3.33Å; M66-F144 HydrophobicContact CE-CD2 3.41Å; M66-F144 VanDerWaalsContact CE-CD2 3.41Å; M66-F144 HydrophobicContact CE-CE2 4.35Å; M66-F144 HydrophobicContact CE-CG 3.57Å; M66-F144 HydrophobicContact SD-CB 4.19Å; M66-F144 HydrophobicContact SD-CD2 3.75Å; M66-F144 HydrophobicContact SD-CG 4.37Å; L69-F144 HydrophobicContact CD2-CD2 4.2Å; L69-F144 HydrophobicContact CD2-CE2 3.84Å; I88-F144 HydrophobicContact CG2-CZ 4.03Å; I91-F144 HydrophobicContact CB-CE2 4.18Å; I91-F144 HydrophobicContact CB-CZ 4.1Å; I91-F144 HydrophobicContact CG2-CD1 4.12Å; I91-F144 HydrophobicContact CG2-CD2 3.88Å; I91-F144 HydrophobicContact CG2-CE1 3.97Å; I91-F144 HydrophobicContact CG2-CE2 3.68Å; I91-F144 HydrophobicContact CG2-CG 4.08Å; I91-F144 HydrophobicContact CG2-CZ 3.72Å; Q92-F144 HydrophobicContact CB-CE1 4.43Å; I95-F144 HydrophobicContact CD1-CB 4.12Å; I95-F144 HydrophobicContact CD1-CD1 3.46Å; I95-F144 VanDerWaalsContact CD1-CD1 3.46Å; I95-F144 HydrophobicContact CD1-CE1 4.1Å; I95-F144 HydrophobicContact CD1-CG 4.03Å; L140-F144 WeakPolarHBondContact O-CB 3.48Å; L140-F144 PolarHBondContact O-N 2.93Å; V141-F144 PolarHBondContact O-N 2.8Å; F144-V147 PolarHBondContact O-N 3Å; F144-L148 HydrophobicContact CD1-CD1 4.08Å; F144-L148 HydrophobicContact CD2-CD1 4.19Å; F144-L148 HydrophobicContact CD2-CG 4.02Å; F144-L148 HydrophobicContact CE1-CD1 3.78Å; F144-L148 HydrophobicContact CE2-CD1 3.93Å; F144-L148 HydrophobicContact CE2-CD2 3.91Å; F144-L148 HydrophobicContact CE2-CG 3.84Å; F144-L148 HydrophobicContact CG-CD1 4.28Å; F144-L148 HydrophobicContact CZ-CD1 3.73Å; F144-L148 HydrophobicContact CZ-CD2 4.19Å; F144-L148 HydrophobicContact CZ-CG 4.15Å; F144-L148 WeakPolarHBondContact O-CG 3.45Å; F144-L148 PolarHBondContact O-N 3.11Å; F144-T308 HydrophobicContact CE1-CG2 4.02Å; F144-T308 HydrophobicContact CZ-CG2 4.24Å; F144-L312 HydrophobicContact CB-CD2 4.42Å; F144-L312 HydrophobicContact CD1-CD2 3.53Å; F144-L312 HydrophobicContact CE1-CD2 4.25Å; F144-L312 HydrophobicContact CG-CD2 4.37Å
145R87.3Confident84.1Confident101 Ų10147.9 Ų47.938%0.38124%0.237SC..Hα-helixtrans-60-49.8177.5-177.7-174.4172.3-155.6-3.1111.1V141 S142 E143 V147 L148 E149V141-R145 PolarHBondContact O-N 3.5Å; S142-R145 PolarHBondContact O-N 2.92Å; E143-R145 VanDerWaalsContact C-N 3.31Å; E143-R145 PolarHBondContact O-N 3.49Å; R145-V147 PolarHBondContact O-N 2.88Å; R145-L148 PolarHBondContact O-N 3.2Å; R145-L148 VanDerWaalsContact O-N 3.14Å; R145-E149 HydrophobicContact CG-CG 4.36Å; R145-E149 WeakPolarHBondContact O-CG 3.44Å; R145-E149 PolarHBondContact O-N 3.48Å
146V87.5Confident83.4Confident97 Ų9746.2 Ų46.259%0.58824%0.238SC*.Hα-helixtrans-56.6-43.6178.9172.30000110.7S142 E143 E149 E150S142-V146 WeakPolarHBondContact O-CG2 3.17Å; S142-V146 PolarHBondContact O-N 3.48Å; E143-V146 PolarHBondContact O-N 2.79Å; V146-E149 PolarHBondContact O-N 3.32Å; V146-E150 WeakPolarHBondContact O-CB 3.41Å; V146-E150 PolarHBondContact O-N 3.4Å
147V86.7Confident82.4Confident2 Ų244.5 Ų44.51%0.01224%0.235CC..Hα-helixtrans-63.5-41.1177.8167.80000112.4M66 L69 K70 F73 E143 F144 R145 H151M66-V147 HydrophobicContact SD-CG2 4.44Å; L69-V147 HydrophobicContact CD2-CG1 3.87Å; L69-V147 HydrophobicContact CG-CG1 4.22Å; K70-V147 HydrophobicContact CD-CG2 4.05Å; K70-V147 HydrophobicContact CG-CG1 4.46Å; K70-V147 HydrophobicContact CG-CG2 3.63Å; F73-V147 HydrophobicContact CD2-CG1 3.5Å; F73-V147 VanDerWaalsContact CD2-CG1 3.5Å; F73-V147 HydrophobicContact CE2-CG1 3.25Å; F73-V147 HydrophobicContact CZ-CG1 4.43Å; E143-V147 WeakPolarHBondContact O-CB 3.34Å; E143-V147 VanDerWaalsContact O-CG2 3.27Å; E143-V147 WeakPolarHBondContact O-CG2 3.46Å; E143-V147 PolarHBondContact O-N 3.32Å; F144-V147 PolarHBondContact O-N 3Å; R145-V147 PolarHBondContact O-N 2.88Å; V147-H151 PolarHBondContact O-N 2.85Å
148L85Confident81.2Confident0 Ų047.9 Ų47.90%025%0.253CS..Hα-helixtrans-68.2-37.7176.2-71.5177.7000112.6I88 F144 R145 H151 K152 V305 T308 I309I88-L148 HydrophobicContact CD1-CD2 3.9Å; I88-L148 HydrophobicContact CG1-CD2 3.98Å; I88-L148 HydrophobicContact CG2-CD2 3.9Å; F144-L148 HydrophobicContact CD1-CD1 4.08Å; F144-L148 HydrophobicContact CD2-CD1 4.19Å; F144-L148 HydrophobicContact CD2-CG 4.02Å; F144-L148 HydrophobicContact CE1-CD1 3.78Å; F144-L148 HydrophobicContact CE2-CD1 3.93Å; F144-L148 HydrophobicContact CE2-CD2 3.91Å; F144-L148 HydrophobicContact CE2-CG 3.84Å; F144-L148 HydrophobicContact CG-CD1 4.28Å; F144-L148 HydrophobicContact CZ-CD1 3.73Å; F144-L148 HydrophobicContact CZ-CD2 4.19Å; F144-L148 HydrophobicContact CZ-CG 4.15Å; F144-L148 WeakPolarHBondContact O-CG 3.45Å; F144-L148 PolarHBondContact O-N 3.11Å; R145-L148 PolarHBondContact O-N 3.2Å; R145-L148 VanDerWaalsContact O-N 3.14Å; L148-H151 PolarHBondContact O-N 2.97Å; L148-K152 WeakPolarHBondContact O-CB 3.4Å; L148-K152 PolarHBondContact O-N 2.84Å; L148-V305 HydrophobicContact CB-CG1 4.1Å; L148-V305 HydrophobicContact CD2-CG1 4.29Å; L148-T308 HydrophobicContact CD1-CG2 3.75Å; L148-I309 HydrophobicContact CB-CD1 4.08Å; L148-I309 HydrophobicContact CB-CG1 3.96Å; L148-I309 HydrophobicContact CD1-CG1 4.01Å
149E84.4Confident80Confident63 Ų6349.2 Ų49.229%0.29426%0.263SS..Hα-helixtrans-66.6-43.1175.1-65.7-71-178.200111R145 V146 H151 K152 T153 I309R145-E149 HydrophobicContact CG-CG 4.36Å; R145-E149 WeakPolarHBondContact O-CG 3.44Å; R145-E149 PolarHBondContact O-N 3.48Å; V146-E149 PolarHBondContact O-N 3.32Å; E149-H151 VanDerWaalsContact C-N 3.34Å; E149-H151 PolarHBondContact O-N 2.85Å; E149-K152 WeakPolarHBondContact O-CB 3.49Å; E149-K152 PolarHBondContact O-N 3.34Å; E149-T153 WeakPolarHBondContact O-CG2 3.4Å; E149-T153 PolarHBondContact O-N 2.76Å; E149-I309 HydrophobicContact CG-CD1 4.48Å
150E82Confident79.1Confident119 Ų11951 Ų5156%0.55627%0.27SS*.Hα-helixtrans-57.4-48.2174.5-177.6172.9-16500110.9V146 K152 T153 S154V146-E150 WeakPolarHBondContact O-CB 3.41Å; V146-E150 PolarHBondContact O-N 3.4Å; E150-K152 PolarHBondContact O-N 2.96Å; E150-T153 PolarHBondContact O-N 3.29Å; E150-T153 PolarHBondContact O-OG1 3.14Å; E150-S154 PolarHBondContact O-N 2.92Å
151H77.3Confident77.9Confident17 Ų1757.2 Ų57.28%0.07930%0.297CS..Hα-helixtrans-62-41.7175.7179.1-130.6000113.5F73 L84 V147 L148 E149 T153 S154 L155F73-H151 HydrophobicContact CD1-CB 3.81Å; F73-H151 AromaticContact CD1-CD2 3.53Å; F73-H151 AromaticContact CD1-CG 3.76Å; F73-H151 HydrophobicContact CE1-CB 3.27Å; F73-H151 AromaticContact CE1-CD2 3.06Å; F73-H151 WeakPolarHBondContact CE1-CD2 3.43Å; F73-H151 AromaticContact CE1-CE1 3.9Å; F73-H151 AromaticContact CE1-CG 2.99Å; F73-H151 AromaticContact CE1-ND1 3.57Å; F73-H151 AromaticContact CE1-NE2 3.64Å; F73-H151 HydrophobicContact CE2-CB 4.17Å; F73-H151 HydrophobicContact CZ-CB 3.44Å; F73-H151 VanDerWaalsContact CZ-CB 3.44Å; F73-H151 AromaticContact CZ-CG 3.49Å; F73-H151 VanDerWaalsContact CZ-CG 3.49Å; F73-H151 AromaticContact CZ-ND1 3.83Å; L84-H151 WeakPolarHBondContact CD2-CE1 3.39Å; L84-H151 VanDerWaalsContact CD2-NE2 3.27Å; L84-H151 WeakPolarHBondContact CD2-NE2 3.43Å; V147-H151 PolarHBondContact O-N 2.85Å; L148-H151 PolarHBondContact O-N 2.97Å; E149-H151 VanDerWaalsContact C-N 3.34Å; E149-H151 PolarHBondContact O-N 2.85Å; H151-T153 VanDerWaalsContact C-N 3.26Å; H151-T153 PolarHBondContact O-N 3.21Å; H151-S154 PolarHBondContact O-N 3.4Å; H151-L155 WeakPolarHBondContact CE1-CD1 3.42Å; H151-L155 WeakPolarHBondContact NE2-CD1 2.94Å; H151-L155 PolarHBondContact O-N 2.99Å
152K79.4Confident76.6Confident61 Ų6159.4 Ų59.427%0.26531%0.308SS..Hα-helixtrans-57.3-43174.8-178.5-177.5-177.9172.20110.9L148 E149 E150 S156 V305 E306L148-K152 WeakPolarHBondContact O-CB 3.4Å; L148-K152 PolarHBondContact O-N 2.84Å; E149-K152 WeakPolarHBondContact O-CB 3.49Å; E149-K152 PolarHBondContact O-N 3.34Å; E150-K152 PolarHBondContact O-N 2.96Å; K152-S156 WeakPolarHBondContact O-CB 3.49Å; K152-S156 PolarHBondContact O-N 3.36Å; K152-V305 HydrophobicContact CB-CG1 4.31Å; K152-E306 HydrophobicContact CD-CG 4.5Å; K152-E306 VanDerWaalsContact CE-OE1 3.25Å; K152-E306 WeakPolarHBondContact CE-OE1 3.33Å; K152-E306 IonicContact NZ-OE1 3.93Å; K152-E306 PolarHBondContact NZ-OE1 3.35Å
153T77.1Confident75.3Confident82 Ų8260.8 Ų60.850%0.50331%0.313SS..Hα-helixtrans-67.8-38.5177.465.40000112.1E149 E150 H151 S156 V157E149-T153 WeakPolarHBondContact O-CG2 3.4Å; E149-T153 PolarHBondContact O-N 2.76Å; E150-T153 PolarHBondContact O-N 3.29Å; E150-T153 PolarHBondContact O-OG1 3.14Å; H151-T153 VanDerWaalsContact C-N 3.26Å; H151-T153 PolarHBondContact O-N 3.21Å; T153-S156 PolarHBondContact O-N 3.28Å; T153-V157 VanDerWaalsContact O-CG2 3.32Å; T153-V157 WeakPolarHBondContact O-CG2 3.45Å; T153-V157 PolarHBondContact O-N 3.44Å
154S72.7Confident74.1Confident53 Ų5361.7 Ų61.737%0.37133%0.327SS..Hα-helixtrans-61.8-47175.8178.40000111.7E150 H151 S156 V157 D158E150-S154 PolarHBondContact O-N 2.92Å; H151-S154 PolarHBondContact O-N 3.4Å; S154-S156 VanDerWaalsContact C-N 3.33Å; S154-S156 PolarHBondContact O-N 3.5Å; S154-V157 PolarHBondContact O-N 3.28Å; S154-D158 PolarHBondContact O-N 3.2Å
155L71.4Confident72.5Confident28 Ų2867.5 Ų67.515%0.14736%0.358CS..Hα-helixtrans-62.9-36.8175.7-71.2177000112.8H151 S159 A301 I302H151-L155 WeakPolarHBondContact CE1-CD1 3.42Å; H151-L155 WeakPolarHBondContact NE2-CD1 2.94Å; H151-L155 PolarHBondContact O-N 2.99Å; L155-S159 PolarHBondContact O-N 2.98Å; L155-S159 VanDerWaalsContact O-N 3.15Å; L155-A301 HydrophobicContact CD1-CB 4.25Å; L155-I302 HydrophobicContact CB-CD1 4.11Å; L155-I302 HydrophobicContact CB-CG1 3.94Å; L155-I302 HydrophobicContact CD1-CG1 3.84Å
156S71.3Confident71.1Confident49 Ų4965.5 Ų65.534%0.34335%0.354SS..Hα-helixtrans-71.4-37.6178.9-173.90000113K152 T153 S154 D158 S159 K160K152-S156 WeakPolarHBondContact O-CB 3.49Å; K152-S156 PolarHBondContact O-N 3.36Å; T153-S156 PolarHBondContact O-N 3.28Å; S154-S156 VanDerWaalsContact C-N 3.33Å; S154-S156 PolarHBondContact O-N 3.5Å; S156-D158 VanDerWaalsContact C-N 3.34Å; S156-S159 WeakPolarHBondContact O-CB 3.37Å; S156-S159 PolarHBondContact O-N 2.9Å; S156-K160 PolarHBondContact O-N 2.58Å; S156-K160 VanDerWaalsContact O-N 3.16Å
157V66.7Low69.5Low76 Ų7668 Ų6846%0.46136%0.359SS..Hα-helixtrans-64.6-41.2176.4169.10000110.9T153 S154 S159 K160 K161T153-V157 VanDerWaalsContact O-CG2 3.32Å; T153-V157 WeakPolarHBondContact O-CG2 3.45Å; T153-V157 PolarHBondContact O-N 3.44Å; S154-V157 PolarHBondContact O-N 3.28Å; V157-S159 VanDerWaalsContact C-N 3.34Å; V157-K160 PolarHBondContact O-N 2.9Å; V157-K161 PolarHBondContact O-N 3.23Å
158D63.7Low67.8Low70 Ų7075.4 Ų75.437%0.37440%0.396SS..Hα-helixtrans-68-34.4178-71.6-16.7000112.2S154 S156 K161 L162S154-D158 PolarHBondContact O-N 3.2Å; S156-D158 VanDerWaalsContact C-N 3.34Å; D158-K161 PolarHBondContact O-N 3.43Å; D158-K161 IonicContact OD1-NZ 3.96Å; D158-L162 PolarHBondContact O-N 3.16Å; D158-L162 VanDerWaalsContact O-N 3.16Å
159S60.8Low66Low31 Ų3181.1 Ų81.122%0.21743%0.426CS..Hα-helixtrans-58.5-49170.5-167.90000111.8L155 S156 V157 K161 L162 D163L155-S159 PolarHBondContact O-N 2.98Å; L155-S159 VanDerWaalsContact O-N 3.15Å; S156-S159 WeakPolarHBondContact O-CB 3.37Å; S156-S159 PolarHBondContact O-N 2.9Å; V157-S159 VanDerWaalsContact C-N 3.34Å; S159-K161 VanDerWaalsContact C-N 3.3Å; S159-K161 PolarHBondContact O-N 2.96Å; S159-L162 PolarHBondContact O-N 3.24Å; S159-D163 PolarHBondContact O-N 3.42Å
160K66.2Low64.3Low146 Ų14684.3 Ų84.364%0.63545%0.445SS*.Hα-helixtrans-63.9-33.6-178.5-69.2-179.7-176.6179.40113S156 V157 A164S156-K160 PolarHBondContact O-N 2.58Å; S156-K160 VanDerWaalsContact O-N 3.16Å; V157-K160 PolarHBondContact O-N 2.9Å; K160-A164 WeakPolarHBondContact O-CB 3.02Å; K160-A164 PolarHBondContact O-N 3.27Å
161K66.1Low62.4Low131 Ų13186 Ų8657%0.5746%0.458SS*.Hα-helixtrans-67.4-40.9175.5-73.1175.6-175.9166.60111.7V157 D158 S159 A164 N165V157-K161 PolarHBondContact O-N 3.23Å; D158-K161 PolarHBondContact O-N 3.43Å; D158-K161 IonicContact OD1-NZ 3.96Å; S159-K161 VanDerWaalsContact C-N 3.3Å; S159-K161 PolarHBondContact O-N 2.96Å; K161-A164 PolarHBondContact O-N 3.49Å; K161-N165 PolarHBondContact O-N 3.38Å; K161-N165 VanDerWaalsContact O-N 3.07Å
162L59.9Low60.6Low45 Ų4592.7 Ų92.724%0.23649%0.489CS..Hα-helixtrans-65.9-44.8176.9-164.897.9000110.9D158 S159 A164 N165 I166 I291 V295D158-L162 PolarHBondContact O-N 3.16Å; D158-L162 VanDerWaalsContact O-N 3.16Å; S159-L162 PolarHBondContact O-N 3.24Å; L162-A164 VanDerWaalsContact C-N 3.33Å; L162-A164 PolarHBondContact O-N 3.04Å; L162-N165 WeakPolarHBondContact O-CB 3.37Å; L162-N165 PolarHBondContact O-N 3.35Å; L162-N165 VanDerWaalsContact O-N 3.13Å; L162-I166 HydrophobicContact CD2-CD1 4.12Å; L162-I166 HydrophobicContact CG-CD1 4.27Å; L162-I166 WeakPolarHBondContact O-CG1 3.11Å; L162-I166 PolarHBondContact O-N 3.4Å; L162-I291 HydrophobicContact CD2-CG2 4.08Å; L162-V295 HydrophobicContact CD2-CG2 3.68Å
163D58.9Low58.6Low70 Ų7097.1 Ų97.137%0.37452%0.516SS..Hα-helixtrans-62.5-39.4177.5-66.4-32.3000112.1S159 N165 I166 Q167S159-D163 PolarHBondContact O-N 3.42Å; D163-N165 VanDerWaalsContact C-N 3.35Å; D163-I166 PolarHBondContact O-N 3Å; D163-Q167 WeakPolarHBondContact O-CG 3.41Å; D163-Q167 PolarHBondContact O-N 3.49Å
164A61Low56.5Low55 Ų5599.3 Ų99.346%0.45553%0.531SS..Hα-helixtrans-63.6-39.6173.900000112.1K160 K161 L162 I166 Q167 M168K160-A164 WeakPolarHBondContact O-CB 3.02Å; K160-A164 PolarHBondContact O-N 3.27Å; K161-A164 PolarHBondContact O-N 3.49Å; L162-A164 VanDerWaalsContact C-N 3.33Å; L162-A164 PolarHBondContact O-N 3.04Å; A164-I166 VanDerWaalsContact C-N 3.34Å; A164-Q167 PolarHBondContact O-N 3.19Å; A164-M168 PolarHBondContact O-N 3.28Å
165N56.4Low54.5Low122 Ų122106.6 Ų106.665%0.65256%0.557SS**Hα-helixtrans-66.7-34.3174.7-10618.3000112.4K161 L162 D163 N169K161-N165 PolarHBondContact O-N 3.38Å; K161-N165 VanDerWaalsContact O-N 3.07Å; L162-N165 WeakPolarHBondContact O-CB 3.37Å; L162-N165 PolarHBondContact O-N 3.35Å; L162-N165 VanDerWaalsContact O-N 3.13Å; D163-N165 VanDerWaalsContact C-N 3.35Å; N165-N169 WeakPolarHBondContact O-CB 3.33Å; N165-N169 PolarHBondContact O-N 2.93Å
166I58Low53Low59 Ų59109.5 Ų109.530%0.30359%0.585SS.*Hα-helixtrans-72-37.6175.8-65.3168000110.9L162 D163 A164 N169 N170 I291L162-I166 HydrophobicContact CD2-CD1 4.12Å; L162-I166 HydrophobicContact CG-CD1 4.27Å; L162-I166 WeakPolarHBondContact O-CG1 3.11Å; L162-I166 PolarHBondContact O-N 3.4Å; D163-I166 PolarHBondContact O-N 3Å; A164-I166 VanDerWaalsContact C-N 3.34Å; I166-N169 PolarHBondContact O-N 2.81Å; I166-N170 PolarHBondContact O-N 3Å; I166-I291 HydrophobicContact CD1-CG2 3.88Å
167Q55.3Low51.1Low150 Ų150115.1 Ų115.170%0.70161%0.606SS**Hα-helixtrans-70.6-32176.4-73.4-176.116.600113.3D163 A164D163-Q167 WeakPolarHBondContact O-CG 3.41Å; D163-Q167 PolarHBondContact O-N 3.49Å; A164-Q167 PolarHBondContact O-N 3.19Å
168M51.2Low49.6Very low157 Ų157122.8 Ų122.877%0.77363%0.628SS**Hα-helixtrans-72.6-30.3172.5-96.4-169.2152.900113.1A164A164-M168 PolarHBondContact O-N 3.28Å
169N47Very low48.2Very low119 Ų119123.7 Ų123.764%0.63664%0.636SS**Hα-helixtrans-83.6-14.7-178.2-157.122000113.9N165 I166 N171N165-N169 WeakPolarHBondContact O-CB 3.33Å; N165-N169 PolarHBondContact O-N 2.93Å; I166-N169 PolarHBondContact O-N 2.81Å; N169-N171 VanDerWaalsContact C-N 3.34Å; N169-N171 PolarHBondContact O-N 3.47Å
170N47.4Very low46.8Very low131 Ų131126.3 Ų126.370%0.70166%0.655SS**THydrogen-bonded Turntrans-86.34.4179.5-86.4-14.5000114.9I166I166-N170 PolarHBondContact O-N 3Å
171N42.1Very low45.3Very low153 Ų153128.3 Ų128.382%0.81866%0.66SS**THydrogen-bonded Turntrans-11715.9176.3-90.4-10000114.3N169N169-N171 VanDerWaalsContact C-N 3.34Å; N169-N171 PolarHBondContact O-N 3.47Å
172Q40.2Very low43.5Very low158 Ų158127.1 Ų127.174%0.73867%0.668SS**SBendtrans-130.1122.3171-73.3-176.8-19.400110.7
173N36.6Very low42.4Very low154 Ų154129.8 Ų129.882%0.82469%0.69SS**  trans-44.8134.5179.6-77.4-35.6000112.8F175N173-F175 VanDerWaalsContact C-N 3.29Å; N173-F175 PolarHBondContact O-N 3.34Å
174P33.5Very low41.1Very low128 Ų128133.8 Ų133.883%0.83171%0.71SS**SBendtrans-81.475.9175.633.5-31.5000109.5
175F31.8Very low39.8Very low206 Ų206139.2 Ų139.290%0.90473%0.728SS**  trans-159.861.7170.5-132.9-88.4000111.9N173N173-F175 VanDerWaalsContact C-N 3.29Å; N173-F175 PolarHBondContact O-N 3.34Å
176A38.5Very low39Very low89 Ų89143 Ų14374%0.73674%0.738SS**  trans-156.791.6160.800000107.1
177E33Very low38Very low167 Ų167145.2 Ų145.278%0.7876%0.755SS**  99.8103.990.4-166.2163.3-147.400109.2T179E177-T179 PolarHBondContact O-N 3.44Å
178Y33.6Very low36.9Very low238 Ų238145.8 Ų145.893%0.93376%0.763SS**SBendtrans-66.384.5165.8-75-91.4000108.9
179T34.4Very low36.2Very low88 Ų88148 Ų14854%0.5477%0.768SS.*  trans-168.5124.8163.6-16.10000105.2E177 Y181E177-T179 PolarHBondContact O-N 3.44Å; T179-Y181 HydrophobicContact CG2-CE2 4.3Å
180S32.5Very low35.6Very low87 Ų87149.6 Ų149.661%0.60878%0.776SS**  159.9129.578.8-97.70000108.4
181Y33.5Very low35.2Very low188 Ų188148.4 Ų148.474%0.73778%0.778SS**  trans49.2117.1135.7-53.3-72.4000120.4T179 S183T179-Y181 HydrophobicContact CG2-CE2 4.3Å; Y181-S183 PolarHBondContact O-N 2.82Å
182S29.3Very low34.9Very low106 Ų106146.6 Ų146.674%0.74177%0.774SS**  -4.8115.1121.155.80000115.1
183S36.3Very low34.6Very low100 Ų100147.1 Ų147.170%0.69978%0.781SS**  trans-145.5100.6156.655.90000107.9Y181Y181-S183 PolarHBondContact O-N 2.82Å
184I32.6Very low34.3Very low154 Ų154146.8 Ų146.879%0.7978%0.779SS**  89.7110.188.7-73.2154.3000110.3
185M32.8Very low34.4Very low169 Ų169145 Ų14583%0.83377%0.767SS**  trans-5.9128149.7-63.3-169.5172.500117.4
186K39.8Very low34.4Very low201 Ų201141 Ų14187%0.87476%0.76SS**  trans-123.287.2144.3-76.2-179.1176.8177.90106.3
187T36Very low34.1Very low107 Ų107141.8 Ų141.866%0.65676%0.76SS**  58.9116.592.966.70000116.2
188N33.3Very low34.2Very low162 Ų162140.3 Ų140.387%0.86676%0.757SS**  trans72.4110.1146.5-67.1-8.1000119.9
189K36.9Very low34.4Very low202 Ų202135.5 Ų135.588%0.87875%0.748SS**  -170.1105.893.6-153.3176.5-175.5-167.20113.1
190L34Very low34.6Very low153 Ų153136.1 Ų136.180%0.80176%0.755SS**  trans44.8100.6132.1-142.668.9000121.1
191S38Very low34.9Very low106 Ų106139.8 Ų139.874%0.74177%0.766SS**  79.8152.4121.7-62.90000123.7
192P36.2Very low35Very low115 Ų115135.4 Ų135.475%0.74776%0.761SS**  trans-124156.3-145.139.9-24.3000115.1
193I35.1Very low35.2Very low170 Ų170136.8 Ų136.887%0.87276%0.76SS**  trans-147.5113.5162.8-58-178000110.3
194N28.7Very low35Very low147 Ų147138.2 Ų138.279%0.78677%0.765SS**  trans-90.2170.4149.1-146.816.3000106.2
195P37.1Very low35.3Very low91 Ų91139.5 Ų139.559%0.59177%0.767SS**  cis-145.7-1768.634.4-8.8000116.1
196T30.2Very low35.4Very low122 Ų122136.9 Ų136.975%0.74876%0.763SS**  trans63.7130.2144.441.60000123.3
197S33.6Very low35.6Very low104 Ų104134.5 Ų134.573%0.72776%0.758SS**  trans65110.6140.263.40000120.4
198D34.9Very low35.5Very low137 Ų137136.8 Ų136.873%0.73377%0.766SS**  -170.3120122.4-107.1-27.2000108.8
199N36.5Very low35.7Very low137 Ų137136.6 Ų136.673%0.73377%0.765SS**  52.2116.8102-70.9-30.9000111.9
200S39.8Very low35.6Very low100 Ų100135.8 Ų135.870%0.69976%0.764SS**  173.4121.672.8-51.10000106.8
201I37.4Very low35.5Very low164 Ų164136.7 Ų136.784%0.84177%0.769SS**  87.7144.8100.6-72.5169.6000114.9
202P36.3Very low35.4Very low96 Ų96140.4 Ų140.462%0.62378%0.775SS**  trans-120.7-176.2-138.632.8-13.4000113.9
203N34Very low35Very low135 Ų135138.3 Ų138.372%0.72278%0.775SS**  trans146.3109.4138.1-72.4-21.5000114.5
204T32.3Very low34.9Very low130 Ų130138 Ų13880%0.79877%0.774SS**  11.8123.4124.6420000119
205H38Very low35.1Very low182 Ų182139.4 Ų139.484%0.84377%0.774SS**  trans-123.4128.1159-112.2-73.1000109.1
206P34.4Very low34.9Very low113 Ų113142.2 Ų142.273%0.73478%0.783SS**  trans-114.4135.3152.732.2-20.1000110.4
207I44.2Very low35Very low152 Ų152144.6 Ų144.678%0.77979%0.786SS**PPolyproline II helixtrans-88.5121.8175.8-65.6171.4000107.6
208N35Very low34.9Very low155 Ų155148.6 Ų148.683%0.82979%0.794SS**PPolyproline II helixtrans-88.2121.8169.7-86.3-22000109.1
209D36.4Very low34.6Very low157 Ų157152.3 Ų152.384%0.8480%0.799SS**PPolyproline II helixtrans-86.4134.2164.2-90.5-35.5000111.3
210Q36Very low34.3Very low185 Ų185151.2 Ų151.286%0.86480%0.802SS**PPolyproline II helixtrans-84.5130.3174-75.5-173.62.600111.1
211L30.4Very low33.8Very low173 Ų173151 Ų15191%0.90680%0.8SS**PPolyproline II helixtrans-76.2119.2162.9-88147000111.4
212Q36.7Very low33.6Very low183 Ų183150.3 Ų150.386%0.85580%0.798SS**  trans-142.1118.3146.4-85-179.59.600104.5
213G28.2Very low33.3Very low72 Ų72152.8 Ų152.874%0.74281%0.805SS**  cis92.475.843.400000109.1
214N32.5Very low33.3Very low162 Ų162151.4 Ų151.487%0.86680%0.804SS**  trans-154.1139.7151.9-139.1-4.2000115
215K33Very low33.1Very low178 Ų178152.3 Ų152.377%0.77480%0.804SS**  trans-81.9154.3-176.4-66.3164.2172.5170.60111
216N33.7Very low32.8Very low149 Ų149148.2 Ų148.280%0.79780%0.796SS**  trans161.8104.7134.4-77.6-16.8000109.1
217Q32Very low32.6Very low172 Ų172147.8 Ų147.880%0.80480%0.802SS**  46.7106.9100.4-71.8-170.215.100115
218Q32Very low32.1Very low189 Ų189148.3 Ų148.388%0.88380%0.804SS**  -173.2129.4122.1-110.7167.8-81.900113.7
219Y27Very low31.8Very low214 Ų214145 Ų14584%0.83979%0.794SS**  trans-18.4132.2154.8-60.8-97000117
220S30.5Very low31.6Very low115 Ų115144.8 Ų144.880%0.80479%0.792SS**  176.8138.3109-108.40000112.2
221S29.5Very low31.2Very low94 Ų94142.6 Ų142.666%0.65779%0.791SS**  trans-36.2139.4160.848.20000114.2
222N33.5Very low31.3Very low151 Ų151139.1 Ų139.181%0.80779%0.787SS**  178.1130.3118.1-83.9-17.2000111.8
223L30.8Very low30.9Very low147 Ų147135.6 Ų135.677%0.7778%0.783SS**  trans-56150.1161.4-151.370.6000109.3
224P33.8Very low31.1Very low106 Ų106139.7 Ų139.769%0.68879%0.786SS**  -146.9139.1100.131.4-12.6000114.9S226P224-S226 PolarHBondContact O-N 3.3Å
225N27.9Very low31Very low149 Ų149137.2 Ų137.280%0.79778%0.779SS**  trans-63.7115.2155.3-77.1-25.4000108.6
226S32.4Very low31.1Very low97 Ų97135.6 Ų135.668%0.67878%0.778SS**  trans-106.990.8169.1-64.40000109.1P224 I228P224-S226 PolarHBondContact O-N 3.3Å; S226-I228 PolarHBondContact O-N 3.28Å
227A29.7Very low31Very low104 Ų104133.2 Ų133.286%0.8677%0.773SS**  trans-74.8111.9155.900000107.1
228I33.7Very low31.3Very low162 Ų162135.5 Ų135.583%0.83178%0.776SS**  trans-100.9110173.1-61.6178.7000108S226S226-I228 PolarHBondContact O-N 3.28Å
229S27.7Very low31.2Very low87 Ų87131.5 Ų131.561%0.60877%0.769SS**  trans-93145.1168.485.30000110
230L31.9Very low31.5Very low151 Ų151127.8 Ų127.879%0.79177%0.769SS**  trans73.6100.3143.6-61162.7000118.5
231V28.5Very low31.8Very low140 Ų140127.9 Ų127.985%0.84877%0.769SS**  34.8113.5118.2179.40000116.6
232A32.6Very low32.3Very low99 Ų99129 Ų12982%0.81878%0.778SS**  trans-141.4128.3149.300000110.7
233S28.9Very low32.5Very low110 Ų110128.7 Ų128.777%0.76978%0.775SS**  trans-55.3143.8178.244.10000116.7
234I32.5Very low33.5Very low157 Ų157127.3 Ų127.381%0.80578%0.775SS**  trans-139.3122.8150.9-54.8178.3000108.3
235P29.3Very low34.1Very low111 Ų111127.6 Ų127.672%0.72178%0.777SS**  trans-94.3133172.934.1-25.3000109.9
236N35.9Very low34.8Very low144 Ų144127.3 Ų127.377%0.7778%0.78SS**  trans-128119.3159.8-95.7-4.1000109.7
237S30.2Very low35.6Very low99 Ų99130.9 Ų130.969%0.69279%0.788SS**  trans-85.3127.8-175.441.60000112.2
238Y38.4Very low36.4Very low220 Ų220131.3 Ų131.386%0.86378%0.782SS**  trans-146.6141.8150.3-62-75000109.6
239S31.5Very low36.9Very low104 Ų104130.9 Ų130.973%0.72778%0.78SS**  trans-90.8163-152.3-49.50000115.5
240T33.3Very low37.5Very low136 Ų136131.4 Ų131.483%0.83478%0.784SS**  trans73.9130.9155.775.10000115.7
241S35.6Very low38.3Very low117 Ų117133.5 Ų133.582%0.81879%0.786SS**  cis-161.2169.726.947.60000110.5
242S39.9Very low38.7Very low119 Ų119135.3 Ų135.383%0.83279%0.79SS**  trans-57.5142.1-157.446.60000120.9
243L38.3Very low38.8Very low144 Ų144138.8 Ų138.875%0.75480%0.795SS**  trans-69174.1179.4-78.589.8000116.6P245L243-P245 HydrophobicContact CD2-CB 4.24Å
244P52.3Low39.2Very low118 Ų118136.4 Ų136.477%0.76679%0.788SS**  -119156.19836.3-33.5000113.5
245P44.7Very low39.6Very low112 Ų112135.9 Ų135.973%0.72779%0.792SS**  trans-86.5134.2-167.434.1-31.7000112.1L243L243-P245 HydrophobicContact CD2-CB 4.24Å
246V43.7Very low39.9Very low143 Ų143135.8 Ų135.887%0.86779%0.791SS**  trans-110.3134.1173179.50000109.4
247M48.9Very low40Very low171 Ų171136.4 Ų136.484%0.84279%0.793SS**  trans-66.8147.8-172.2-70.3-165.4-73.900113.8
248P46.5Very low40.6Very low113 Ų113137.9 Ų137.973%0.73480%0.798SS**  trans-69.7135.2176.926.7-32.1000112.7S250P248-S250 VanDerWaalsContact C-N 3.32Å; P248-S250 PolarHBondContact O-N 3.19Å
249I44.3Very low40.4Very low153 Ų153132.4 Ų132.479%0.78578%0.783SS**SBendtrans-76.577.2179.6-55.8171000109.6
250S40.7Very low40.7Very low99 Ų99140 Ų14069%0.69280%0.796SS**  trans-127.722.2175.348.30000114.1P248P248-S250 VanDerWaalsContact C-N 3.32Å; P248-S250 PolarHBondContact O-N 3.19Å
251K47.2Very low41.2Very low194 Ų194137.1 Ų137.184%0.84378%0.782SS**  trans-13518.3-175.9-75.2-169179.3179.20118.1
252L39Very low41.6Very low179 Ų179137.5 Ų137.594%0.93777%0.77SS**  trans-112.368.5171.3-97.982.4000111.6
253N34.6Very low41.8Very low172 Ų172137.7 Ų137.792%0.9277%0.767SS**  trans-114.4104.4158.8-16338.8000106.9
254G36.5Very low41.7Very low59 Ų59139.7 Ų139.761%0.60877%0.765SS**SBendtrans142.6116173.800000114.2
255T40.3Very low41.2Very low147 Ų147140.2 Ų140.290%0.90276%0.762SS**  trans91.5136.1157.272.20000118.8
256P37.2Very low41.1Very low108 Ų108139 Ų13970%0.70176%0.756SS**  trans-102.1169.1-164.243.4-34.6000112.1
257I36.5Very low40.9Very low157 Ų157141.6 Ų141.681%0.80576%0.756SS**  trans70.693.4162.3-48.9158.9000115.3
258V43.1Very low40.7Very low131 Ų131141.5 Ų141.579%0.79475%0.754SS**  trans-147.1140.8145-176.30000109.9
259N33.6Very low40.4Very low105 Ų105140.1 Ų140.156%0.56175%0.751SS**  trans-45.1136.5-168.3-81.8-29000117.9S261N259-S261 PolarHBondContact O-N 3.36Å
260R38.6Very low40.1Very low262 Ų262141.8 Ų141.899%0.98976%0.756SS**THydrogen-bonded Turntrans-61.63.6174.2-159.9175.6-160.71677.8115.3
261S44.7Very low40.1Very low77 Ų77143.8 Ų143.854%0.53876%0.764SS.*THydrogen-bonded Turntrans-120.6-7.1-16937.20000115.1N259N259-S261 PolarHBondContact O-N 3.36Å
262E42.1Very low39.6Very low124 Ų124139.9 Ų139.958%0.57976%0.757SS**SBendtrans-101.9-16.6-171.8-70.2-179.9-176.300114.8Y264E262-Y264 VanDerWaalsContact C-N 3.28Å; E262-Y264 PolarHBondContact O-N 3.05Å
263V45.8Very low39.7Very low124 Ų124138.4 Ų138.475%0.75275%0.75SS**THydrogen-bonded Turntrans-79.9-9.6-179.6-176.90000112.8
264Y35.4Very low40.1Very low185 Ų185141.8 Ų141.873%0.72575%0.75SS**THydrogen-bonded Turntrans-82.6-16.3178.4-158.3-100000113.7E262E262-Y264 VanDerWaalsContact C-N 3.28Å; E262-Y264 PolarHBondContact O-N 3.05Å
265N41Very low40.6Very low129 Ų129144.2 Ų144.269%0.6975%0.753SS**SBendtrans-104.2-5.5-172.1-75.8-24.6000115.1
266S42.5Very low41Very low88 Ų88141.6 Ų141.662%0.61575%0.746SS**THydrogen-bonded Turntrans-95.75.5-174.761.30000115.5
267F40.8Very low41.3Very low197 Ų197146.1 Ų146.186%0.86476%0.758SS**THydrogen-bonded Turntrans-108.86.4-179.6-103.3-85.7000115.1
268Q43.4Very low41.7Very low169 Ų169146.9 Ų146.979%0.7976%0.758SS**SBendtrans-114.67.1-178.3-71.8-16631.500115.4
269A40.4Very low41.9Very low83 Ų83147.8 Ų147.869%0.68676%0.758SS**SBendtrans-102.84.1-170.600000116.4
270E38.5Very low42.5Very low188 Ų188151.7 Ų151.788%0.87977%0.773SS**SBendtrans-120.554.8-177.9-77.2-173.9154.500113
271T40.9Very low42.9Very low142 Ų142147 Ų14787%0.87177%0.765SS**  trans-157.350.4160.4-24.20000112
272T36.3Very low43.2Very low111 Ų111152.2 Ų152.268%0.68178%0.779SS**  trans-110.6129.8171.8-43.70000107.6
273N40.9Very low43.7Very low149 Ų149151.4 Ų151.480%0.79779%0.793SS**SBendtrans107.937.2173.5-48.9-27.6000118.1
274R43.7Very low43.7Very low242 Ų242150.5 Ų150.591%0.91379%0.792SS**SBendtrans-15150.3161.4-75.7-158.7174.5158.6-0.3114.8
275T46.3Very low44.3Very low110 Ų110146.6 Ų146.668%0.67578%0.784SS**  trans-157.327.2173.432.60000114.1
276A50.5Low45Very low93 Ų93146 Ų14677%0.76979%0.787SS**THydrogen-bonded Turntrans-83.4-8.7179.300000114.6
277E42.9Very low45.4Very low202 Ų202147.3 Ų147.394%0.94479%0.787SS**THydrogen-bonded Turntrans-108.58.9-177.6-68.5-174.6150.800114.4
278Q43.5Very low46.2Very low173 Ų173141.4 Ų141.481%0.80877%0.767SS**SBendtrans-11321.4-179.7-138.6168.449.700113.9
279L49.1Very low47.1Very low150 Ų150136.7 Ų136.779%0.78575%0.752SS**  trans-102.523.9-164.4-118.2151.9000115.5
280Q45.9Very low48.1Very low187 Ų187137.6 Ų137.687%0.87475%0.745SS**SBendtrans-130.28.9-174.1-150.4163.417.100117
281I47.3Very low49.6Very low163 Ų163131.2 Ų131.284%0.83672%0.717SS**SBendtrans-119.78.5-176.9-40.7179.7000113.7
282F49.3Very low51Low187 Ų187127.5 Ų127.582%0.8269%0.691SS**  trans-11217-172.2-118.4-92.4000116.3S284F282-S284 PolarHBondContact O-N 3.18Å
283A52.8Low52.7Low107 Ų107127.1 Ų127.188%0.88468%0.682SS**  trans-91.520.7-168.800000116.5
284S46Very low54Low105 Ų105123.4 Ų123.473%0.73466%0.66SS**SBendtrans-143.456.2-174.2670000115.4F282F282-S284 PolarHBondContact O-N 3.18Å
285N48.9Very low55.4Low104 Ų104113.6 Ų113.656%0.55663%0.626SS**  trans-174.9107.1146.8-118.2-1.8000111.7L287 V288N285-L287 PolarHBondContact O-N 3.28Å; N285-V288 HydrophobicContact CB-CB 4.18Å; N285-V288 HydrophobicContact CB-CG2 3.83Å; N285-V288 PolarHBondContact O-N 3.49Å
286P55.4Low57Low115 Ų115115.9 Ų115.975%0.74762%0.623SS**Hα-helixtrans-68-14.8-18025.9-32.5000114.1S289P286-S289 PolarHBondContact O-OG 3.46Å
287L51Low58Low116 Ų116116.7 Ų116.761%0.60761%0.611SS**Hα-helixtrans-80-37.8178-154.2177.3000111.6N285 S289 L290 I291N285-L287 PolarHBondContact O-N 3.28Å; L287-S289 VanDerWaalsContact C-N 3.32Å; L287-S289 PolarHBondContact O-N 3.06Å; L287-L290 PolarHBondContact O-N 3.37Å; L287-I291 HydrophobicContact CD2-CD1 3.51Å; L287-I291 HydrophobicContact CD2-CG1 4.15Å; L287-I291 PolarHBondContact O-N 3.22Å
288V57.8Low59.3Low74 Ų74110.6 Ų110.645%0.44858%0.579SS.*Hα-helixtrans-69.7-31.6-177.4177.20000111.3N285 L290 D292N285-V288 HydrophobicContact CB-CB 4.18Å; N285-V288 HydrophobicContact CB-CG2 3.83Å; N285-V288 PolarHBondContact O-N 3.49Å; V288-L290 PolarHBondContact O-N 3.34Å; V288-D292 WeakPolarHBondContact O-CB 2.65Å; V288-D292 PolarHBondContact O-N 2.9Å
289S60.9Low60.9Low69 Ų69105.5 Ų105.548%0.48356%0.557SS.*Hα-helixtrans-67.1-33.2176.6510000113.6P286 L287 Q293P286-S289 PolarHBondContact O-OG 3.46Å; L287-S289 VanDerWaalsContact C-N 3.32Å; L287-S289 PolarHBondContact O-N 3.06Å; S289-Q293 VanDerWaalsContact O-CB 3.23Å; S289-Q293 WeakPolarHBondContact O-CB 3.21Å; S289-Q293 PolarHBondContact O-N 2.96Å
290L62.4Low62.3Low103 Ų103100.8 Ų100.854%0.53954%0.54SS..Hα-helixtrans-72.2-43.8-179.8-169.870.8000110.9L287 V288 Q293 E294L287-L290 PolarHBondContact O-N 3.37Å; V288-L290 PolarHBondContact O-N 3.34Å; L290-Q293 PolarHBondContact O-N 3.45Å; L290-E294 WeakPolarHBondContact O-CG 3.36Å; L290-E294 PolarHBondContact O-N 2.96Å
291I69.3Low63.6Low54 Ų5492.9 Ų92.928%0.27751%0.507SS..Hα-helixtrans-62.9-46.9176.5-66171.7000110.4L162 I166 L287 Q293 E294 V295L162-I291 HydrophobicContact CD2-CG2 4.08Å; I166-I291 HydrophobicContact CD1-CG2 3.88Å; L287-I291 HydrophobicContact CD2-CD1 3.51Å; L287-I291 HydrophobicContact CD2-CG1 4.15Å; L287-I291 PolarHBondContact O-N 3.22Å; I291-Q293 VanDerWaalsContact C-N 3.29Å; I291-Q293 PolarHBondContact O-N 3.38Å; I291-E294 PolarHBondContact O-N 3Å; I291-V295 HydrophobicContact CG2-CG2 4.36Å; I291-V295 VanDerWaalsContact O-CG2 3.29Å; I291-V295 WeakPolarHBondContact O-CG2 3.44Å; I291-V295 PolarHBondContact O-N 2.98Å
292D71.2Confident65Low63 Ų6386.4 Ų86.434%0.33747%0.473SS..Hα-helixtrans-62.5-37.9177.6-169.351.5000111.5V288 R296V288-D292 WeakPolarHBondContact O-CB 2.65Å; V288-D292 PolarHBondContact O-N 2.9Å; D292-R296 WeakPolarHBondContact O-CB 3.17Å; D292-R296 WeakPolarHBondContact O-CG 3.14Å; D292-R296 PolarHBondContact O-N 3.39Å; D292-R296 IonicContact OD1-CZ 2.76Å; D292-R296 IonicContact OD1-NE 4Å; D292-R296 IonicContact OD1-NH2 2.77Å; D292-R296 IonicContact OD2-CZ 3.31Å; D292-R296 VanDerWaalsContact OD2-CZ 3.28Å; D292-R296 IonicContact OD2-NE 3.21Å; D292-R296 PolarHBondContact OD2-NE 2.91Å; D292-R296 IonicContact OD2-NH2 2.94Å; D292-R296 PolarHBondContact OD2-NH2 3.32Å
293Q71.1Confident66.5Low104 Ų10486 Ų8649%0.48647%0.466SS..Hα-helixtrans-64-45174.8-177.8177.6-18.600112S289 L290 I291 R296 Q297S289-Q293 VanDerWaalsContact O-CB 3.23Å; S289-Q293 WeakPolarHBondContact O-CB 3.21Å; S289-Q293 PolarHBondContact O-N 2.96Å; L290-Q293 PolarHBondContact O-N 3.45Å; I291-Q293 VanDerWaalsContact C-N 3.29Å; I291-Q293 PolarHBondContact O-N 3.38Å; Q293-R296 PolarHBondContact O-N 3.37Å; Q293-Q297 WeakPolarHBondContact O-CB 3.39Å; Q293-Q297 VanDerWaalsContact O-CG 3.3Å; Q293-Q297 WeakPolarHBondContact O-CG 3.46Å; Q293-Q297 PolarHBondContact O-N 3.48Å
294E68.8Low67.8Low71 Ų7185.5 Ų85.533%0.33244%0.442SS..Hα-helixtrans-67.6-40.1178.2-65.8-168.9167.100112.3L290 I291 Q297 R298L290-E294 WeakPolarHBondContact O-CG 3.36Å; L290-E294 PolarHBondContact O-N 2.96Å; I291-E294 PolarHBondContact O-N 3Å; E294-Q297 PolarHBondContact O-N 2.94Å; E294-R298 WeakPolarHBondContact O-CB 3.36Å; E294-R298 VanDerWaalsContact O-CG 3.25Å; E294-R298 WeakPolarHBondContact O-CG 3.28Å; E294-R298 PolarHBondContact O-N 3.35Å; E294-R298 IonicContact OE2-CZ 2.73Å; E294-R298 VanDerWaalsContact OE2-CZ 3.31Å; E294-R298 IonicContact OE2-NH1 2.82Å; E294-R298 PolarHBondContact OE2-NH1 3.05Å; E294-R298 IonicContact OE2-NH2 2.57Å; E294-R298 PolarHBondContact OE2-NH2 2.84Å
295V73.7Confident69.4Low35 Ų3580.7 Ų80.721%0.21241%0.408CS..Hα-helixtrans-60.9-46.1175171.90000110.1L162 I291 Q297 R298 D299L162-V295 HydrophobicContact CD2-CG2 3.68Å; I291-V295 HydrophobicContact CG2-CG2 4.36Å; I291-V295 VanDerWaalsContact O-CG2 3.29Å; I291-V295 WeakPolarHBondContact O-CG2 3.44Å; I291-V295 PolarHBondContact O-N 2.98Å; V295-Q297 PolarHBondContact O-N 2.89Å; V295-R298 PolarHBondContact O-N 2.87Å; V295-D299 PolarHBondContact O-N 3.07Å
296R78.7Confident70.9Confident158 Ų15879.4 Ų79.460%0.59640%0.399SS*.Hα-helixtrans-61.4-41.1175.6-74175.1-166.9-84.7-5.1113.1D292 Q293 R298 D299 A300D292-R296 WeakPolarHBondContact O-CB 3.17Å; D292-R296 WeakPolarHBondContact O-CG 3.14Å; D292-R296 PolarHBondContact O-N 3.39Å; D292-R296 IonicContact OD1-CZ 2.76Å; D292-R296 IonicContact OD1-NE 4Å; D292-R296 IonicContact OD1-NH2 2.77Å; D292-R296 IonicContact OD2-CZ 3.31Å; D292-R296 VanDerWaalsContact OD2-CZ 3.28Å; D292-R296 IonicContact OD2-NE 3.21Å; D292-R296 PolarHBondContact OD2-NE 2.91Å; D292-R296 IonicContact OD2-NH2 2.94Å; D292-R296 PolarHBondContact OD2-NH2 3.32Å; Q293-R296 PolarHBondContact O-N 3.37Å; R296-R298 VanDerWaalsContact C-N 3.33Å; R296-D299 PolarHBondContact O-N 3.12Å; R296-A300 WeakPolarHBondContact O-CB 3.5Å; R296-A300 PolarHBondContact O-N 3.41Å
297Q72.6Confident72.1Confident111 Ų11176.6 Ų76.652%0.51938%0.381SS..Hα-helixtrans-64.2-40.2176.9-76.5179.5-2.700111.5Q293 E294 V295 A300 A301Q293-Q297 WeakPolarHBondContact O-CB 3.39Å; Q293-Q297 VanDerWaalsContact O-CG 3.3Å; Q293-Q297 WeakPolarHBondContact O-CG 3.46Å; Q293-Q297 PolarHBondContact O-N 3.48Å; E294-Q297 PolarHBondContact O-N 2.94Å; V295-Q297 PolarHBondContact O-N 2.89Å; Q297-A300 PolarHBondContact O-N 2.88Å; Q297-A301 PolarHBondContact O-N 3.49Å
298R70.7Confident73.6Confident73 Ų7371.2 Ų71.228%0.27535%0.354SS..Hα-helixtrans-66.5-46.7175.5-70.6173.8-173.8115.77.7111.6E294 V295 R296 A300 A301 I302E294-R298 WeakPolarHBondContact O-CB 3.36Å; E294-R298 VanDerWaalsContact O-CG 3.25Å; E294-R298 WeakPolarHBondContact O-CG 3.28Å; E294-R298 PolarHBondContact O-N 3.35Å; E294-R298 IonicContact OE2-CZ 2.73Å; E294-R298 VanDerWaalsContact OE2-CZ 3.31Å; E294-R298 IonicContact OE2-NH1 2.82Å; E294-R298 PolarHBondContact OE2-NH1 3.05Å; E294-R298 IonicContact OE2-NH2 2.57Å; E294-R298 PolarHBondContact OE2-NH2 2.84Å; V295-R298 PolarHBondContact O-N 2.87Å; R296-R298 VanDerWaalsContact C-N 3.33Å; R298-A300 VanDerWaalsContact C-N 3.3Å; R298-A300 PolarHBondContact O-N 3.28Å; R298-A301 WeakPolarHBondContact O-CB 3.48Å; R298-A301 PolarHBondContact O-N 3.33Å; R298-A301 VanDerWaalsContact O-N 3.08Å; R298-I302 WeakPolarHBondContact O-CG1 3.47Å; R298-I302 PolarHBondContact O-N 2.95Å
299D76.1Confident74.8Confident66 Ų6669 Ų6935%0.35334%0.339SS..Hα-helixtrans-58.9-41.6175.8-78.9-18.9000111.9V295 R296 I302 R303V295-D299 PolarHBondContact O-N 3.07Å; R296-D299 PolarHBondContact O-N 3.12Å; D299-I302 PolarHBondContact O-N 2.88Å; D299-R303 WeakPolarHBondContact O-CB 3.47Å; D299-R303 WeakPolarHBondContact O-CG 3.43Å; D299-R303 PolarHBondContact O-N 2.95Å
300A77.9Confident75.8Confident51 Ų5170.8 Ų70.842%0.42135%0.347SS..Hα-helixtrans-63.7-40.317500000112R296 Q297 R298 R304R296-A300 WeakPolarHBondContact O-CB 3.5Å; R296-A300 PolarHBondContact O-N 3.41Å; Q297-A300 PolarHBondContact O-N 2.88Å; R298-A300 VanDerWaalsContact C-N 3.3Å; R298-A300 PolarHBondContact O-N 3.28Å; A300-R304 WeakPolarHBondContact O-CB 3.23Å; A300-R304 PolarHBondContact O-N 2.92Å
301A73.4Confident76.7Confident21 Ų2170.5 Ų70.517%0.17434%0.343CS..Hα-helixtrans-65.1-43.8175.500000112L155 Q297 R298 R304 V305L155-A301 HydrophobicContact CD1-CB 4.25Å; Q297-A301 PolarHBondContact O-N 3.49Å; R298-A301 WeakPolarHBondContact O-CB 3.48Å; R298-A301 PolarHBondContact O-N 3.33Å; R298-A301 VanDerWaalsContact O-N 3.08Å; A301-R304 PolarHBondContact O-N 3.43Å; A301-V305 WeakPolarHBondContact O-CG2 3.34Å; A301-V305 PolarHBondContact O-N 2.98Å
302I76.1Confident77.3Confident27 Ų2768.4 Ų68.414%0.13833%0.332CS..Hα-helixtrans-61.8-48.8176.9-66.5169.6000110.4L155 R298 D299 R304 V305 E306L155-I302 HydrophobicContact CB-CD1 4.11Å; L155-I302 HydrophobicContact CB-CG1 3.94Å; L155-I302 HydrophobicContact CD1-CG1 3.84Å; R298-I302 WeakPolarHBondContact O-CG1 3.47Å; R298-I302 PolarHBondContact O-N 2.95Å; D299-I302 PolarHBondContact O-N 2.88Å; I302-R304 VanDerWaalsContact C-N 3.26Å; I302-R304 PolarHBondContact O-N 3.47Å; I302-V305 PolarHBondContact O-N 2.86Å; I302-V305 VanDerWaalsContact O-N 3.15Å; I302-E306 HydrophobicContact CG2-CG 4.42Å; I302-E306 WeakPolarHBondContact O-CG 3.23Å; I302-E306 PolarHBondContact O-N 3.37Å
303R81.7Confident77.8Confident178 Ų17866.7 Ų66.767%0.67233%0.329SS*.Hα-helixtrans-59.6-36.3177.4-73.3-179.8-169.1-178.65.3112.6D299 E306 S307D299-R303 WeakPolarHBondContact O-CB 3.47Å; D299-R303 WeakPolarHBondContact O-CG 3.43Å; D299-R303 PolarHBondContact O-N 2.95Å; R303-E306 PolarHBondContact O-N 3.21Å; R303-S307 WeakPolarHBondContact O-CB 3.44Å; R303-S307 PolarHBondContact O-N 2.92Å
304R79.8Confident78.2Confident97 Ų9768.2 Ų68.237%0.36634%0.336SS..Hα-helixtrans-64.7-48.5174.9-173.5-173.5-73.998.51.4111.1S85 E89 A300 A301 I302 E306 S307 T308S85-R304 WeakPolarHBondContact OG-CD 3.46Å; S85-R304 VanDerWaalsContact OG-CZ 3.22Å; S85-R304 PolarHBondContact OG-NE 2.99Å; S85-R304 VanDerWaalsContact OG-NE 3.09Å; S85-R304 PolarHBondContact OG-NH1 3.18Å; E89-R304 IonicContact OE1-NE 3.3Å; E89-R304 PolarHBondContact OE1-NE 2.72Å; A300-R304 WeakPolarHBondContact O-CB 3.23Å; A300-R304 PolarHBondContact O-N 2.92Å; A301-R304 PolarHBondContact O-N 3.43Å; I302-R304 VanDerWaalsContact C-N 3.26Å; I302-R304 PolarHBondContact O-N 3.47Å; R304-E306 VanDerWaalsContact C-N 3.3Å; R304-E306 PolarHBondContact O-N 3.44Å; R304-S307 PolarHBondContact O-N 3.48Å; R304-T308 PolarHBondContact O-N 3.31Å; R304-T308 PolarHBondContact O-OG1 2.81Å
305V79.6Confident78.7Confident4 Ų465.7 Ų65.72%0.02433%0.325CS..Hα-helixtrans-59-42.8176.3171.80000110.8I88 L148 K152 A301 I302 T308 I309I88-V305 HydrophobicContact CD1-CG2 4.38Å; L148-V305 HydrophobicContact CB-CG1 4.1Å; L148-V305 HydrophobicContact CD2-CG1 4.29Å; K152-V305 HydrophobicContact CB-CG1 4.31Å; A301-V305 WeakPolarHBondContact O-CG2 3.34Å; A301-V305 PolarHBondContact O-N 2.98Å; I302-V305 PolarHBondContact O-N 2.86Å; I302-V305 VanDerWaalsContact O-N 3.15Å; V305-T308 PolarHBondContact O-N 3.29Å; V305-I309 HydrophobicContact CG1-CD1 3.72Å; V305-I309 HydrophobicContact CG1-CG1 4.34Å; V305-I309 VanDerWaalsContact O-CG1 3.26Å; V305-I309 WeakPolarHBondContact O-CG1 3.37Å; V305-I309 PolarHBondContact O-N 3.32Å
306E80.7Confident79Confident78 Ų7866.9 Ų66.936%0.36433%0.326SS..Hα-helixtrans-61.6-44.4175.2-72-175.7151.300112.3K152 I302 R303 R304 T308 I309 V310K152-E306 HydrophobicContact CD-CG 4.5Å; K152-E306 VanDerWaalsContact CE-OE1 3.25Å; K152-E306 WeakPolarHBondContact CE-OE1 3.33Å; K152-E306 IonicContact NZ-OE1 3.93Å; K152-E306 PolarHBondContact NZ-OE1 3.35Å; I302-E306 HydrophobicContact CG2-CG 4.42Å; I302-E306 WeakPolarHBondContact O-CG 3.23Å; I302-E306 PolarHBondContact O-N 3.37Å; R303-E306 PolarHBondContact O-N 3.21Å; R304-E306 VanDerWaalsContact C-N 3.3Å; R304-E306 PolarHBondContact O-N 3.44Å; E306-T308 PolarHBondContact O-N 3Å; E306-I309 PolarHBondContact O-N 3.42Å; E306-V310 VanDerWaalsContact O-CG2 3.28Å; E306-V310 WeakPolarHBondContact O-CG2 3.49Å; E306-V310 PolarHBondContact O-N 2.81Å
307S81.5Confident79.1Confident55 Ų5565.3 Ų65.339%0.38533%0.325SS..Hα-helixtrans-61-44174.9-170.10000111.9R303 R304 V310 Q311R303-S307 WeakPolarHBondContact O-CB 3.44Å; R303-S307 PolarHBondContact O-N 2.92Å; R304-S307 PolarHBondContact O-N 3.48Å; S307-V310 PolarHBondContact O-N 3.05Å; S307-Q311 WeakPolarHBondContact O-CB 3.38Å; S307-Q311 VanDerWaalsContact O-CG 3.3Å; S307-Q311 WeakPolarHBondContact O-CG 3.3Å; S307-Q311 PolarHBondContact O-N 3.03Å; S307-Q311 PolarHBondContact OG-NE2 3.36Å; S307-Q311 VanDerWaalsContact OG-NE2 3.13Å
308T81.7Confident79.1Confident4 Ų464.4 Ų64.43%0.02532%0.321CS..Hα-helixtrans-63.6-42.6176.9-61.20000111.7I88 Q92 F144 L148 R304 V305 E306 V310 Q311 L312I88-T308 HydrophobicContact CG2-CG2 4.2Å; Q92-T308 HydrophobicContact CB-CG2 4.25Å; Q92-T308 HydrophobicContact CG-CG2 4.18Å; Q92-T308 PolarHBondContact OE1-OG1 3.14Å; F144-T308 HydrophobicContact CE1-CG2 4.02Å; F144-T308 HydrophobicContact CZ-CG2 4.24Å; L148-T308 HydrophobicContact CD1-CG2 3.75Å; R304-T308 PolarHBondContact O-N 3.31Å; R304-T308 PolarHBondContact O-OG1 2.81Å; V305-T308 PolarHBondContact O-N 3.29Å; E306-T308 PolarHBondContact O-N 3Å; T308-V310 VanDerWaalsContact C-N 3.34Å; T308-V310 PolarHBondContact O-N 3.17Å; T308-Q311 PolarHBondContact O-N 2.93Å; T308-L312 VanDerWaalsContact O-CB 3.22Å; T308-L312 WeakPolarHBondContact O-CB 3.3Å; T308-L312 PolarHBondContact O-N 2.97Å
309I82Confident79.4Confident26 Ų2661 Ų6113%0.13331%0.308CS..Hα-helixtrans-61.2-43.5175.8-69.5165.3000110.6L148 E149 V305 E306 L312 G313L148-I309 HydrophobicContact CB-CD1 4.08Å; L148-I309 HydrophobicContact CB-CG1 3.96Å; L148-I309 HydrophobicContact CD1-CG1 4.01Å; E149-I309 HydrophobicContact CG-CD1 4.48Å; V305-I309 HydrophobicContact CG1-CD1 3.72Å; V305-I309 HydrophobicContact CG1-CG1 4.34Å; V305-I309 VanDerWaalsContact O-CG1 3.26Å; V305-I309 WeakPolarHBondContact O-CG1 3.37Å; V305-I309 PolarHBondContact O-N 3.32Å; E306-I309 PolarHBondContact O-N 3.42Å; I309-L312 PolarHBondContact O-N 3.4Å; I309-G313 PolarHBondContact O-N 3.4Å
310V83.8Confident78.9Confident108 Ų10859.6 Ų59.666%0.65530%0.303SS*.Hα-helixtrans-66-46.4178.8171.70000111.4E306 S307 T308 L312 G313E306-V310 VanDerWaalsContact O-CG2 3.28Å; E306-V310 WeakPolarHBondContact O-CG2 3.49Å; E306-V310 PolarHBondContact O-N 2.81Å; S307-V310 PolarHBondContact O-N 3.05Å; T308-V310 VanDerWaalsContact C-N 3.34Å; T308-V310 PolarHBondContact O-N 3.17Å; V310-L312 VanDerWaalsContact C-N 3.31Å; V310-L312 PolarHBondContact O-N 2.96Å; V310-G313 WeakPolarHBondContact O-CA 3.44Å; V310-G313 PolarHBondContact O-N 2.99Å
311Q79.8Confident78.5Confident96 Ų9661.3 Ų61.345%0.44931%0.309SS..Hα-helixtrans-62.1-39.3177.1-72178.438.900111.9S307 T308 G313S307-Q311 WeakPolarHBondContact O-CB 3.38Å; S307-Q311 VanDerWaalsContact O-CG 3.3Å; S307-Q311 WeakPolarHBondContact O-CG 3.3Å; S307-Q311 PolarHBondContact O-N 3.03Å; S307-Q311 PolarHBondContact OG-NE2 3.36Å; S307-Q311 VanDerWaalsContact OG-NE2 3.13Å; T308-Q311 PolarHBondContact O-N 2.93Å; Q311-G313 PolarHBondContact O-N 2.87Å
312L81.5Confident78.1Confident10 Ų1061.1 Ų61.15%0.05231%0.305CS..Hα-helixtrans-70.8-18.5174.8-163.667.9000112.4I95 V141 F144 T308 I309 V310 E314 I315 Y316I95-L312 HydrophobicContact CD1-CD1 4.41Å; I95-L312 HydrophobicContact CG2-CD1 3.79Å; V141-L312 HydrophobicContact CG1-CD1 4.02Å; V141-L312 HydrophobicContact CG1-CD2 4.11Å; V141-L312 HydrophobicContact CG1-CG 3.92Å; F144-L312 HydrophobicContact CB-CD2 4.42Å; F144-L312 HydrophobicContact CD1-CD2 3.53Å; F144-L312 HydrophobicContact CE1-CD2 4.25Å; F144-L312 HydrophobicContact CG-CD2 4.37Å; T308-L312 VanDerWaalsContact O-CB 3.22Å; T308-L312 WeakPolarHBondContact O-CB 3.3Å; T308-L312 PolarHBondContact O-N 2.97Å; I309-L312 PolarHBondContact O-N 3.4Å; V310-L312 VanDerWaalsContact C-N 3.31Å; V310-L312 PolarHBondContact O-N 2.96Å; L312-E314 PolarHBondContact O-N 3.09Å; L312-I315 HydrophobicContact CD1-CB 4.43Å; L312-I315 HydrophobicContact CD1-CD1 4.38Å; L312-I315 PolarHBondContact O-N 3Å; L312-Y316 VanDerWaalsContact O-CB 3.3Å; L312-Y316 WeakPolarHBondContact O-CB 3.38Å; L312-Y316 PolarHBondContact O-N 3.43Å
313G82Confident77.2Confident27 Ų2762.2 Ų62.228%0.27831%0.313SS..Hα-helixtrans-58.1-42.1176.900000113I309 V310 Q311 Y316 Q317I309-G313 PolarHBondContact O-N 3.4Å; V310-G313 WeakPolarHBondContact O-CA 3.44Å; V310-G313 PolarHBondContact O-N 2.99Å; Q311-G313 PolarHBondContact O-N 2.87Å; G313-Y316 WeakPolarHBondContact O-CB 2.83Å; G313-Y316 PolarHBondContact O-N 3.12Å; G313-Q317 WeakPolarHBondContact O-CG 3.4Å; G313-Q317 PolarHBondContact O-N 3.09Å
314E79.4Confident76.3Confident137 Ų13761.9 Ų61.964%0.6432%0.319SS*.Hα-helixtrans-64.9-43.2177.5-66.7-172168.100112.1L312 Y316 Q317 Q318L312-E314 PolarHBondContact O-N 3.09Å; E314-Y316 VanDerWaalsContact C-N 3.31Å; E314-Q317 PolarHBondContact O-N 3.46Å; E314-Q318 PolarHBondContact O-N 2.9Å
315I80.5Confident75.2Confident17 Ų1764.7 Ų64.79%0.08734%0.336CS..Hα-helixtrans-63.9-41.3175.8-65.8178.2000109.8I95 M96 V141 L312 Q318 F319I95-I315 HydrophobicContact CG2-CD1 4.42Å; I95-I315 HydrophobicContact CG2-CG2 4.47Å; M96-I315 HydrophobicContact CG-CD1 4.08Å; V141-I315 HydrophobicContact CG1-CG2 4.49Å; V141-I315 HydrophobicContact CG2-CG2 4.25Å; L312-I315 HydrophobicContact CD1-CB 4.43Å; L312-I315 HydrophobicContact CD1-CD1 4.38Å; L312-I315 PolarHBondContact O-N 3Å; I315-Q318 WeakPolarHBondContact O-CB 3.08Å; I315-Q318 PolarHBondContact O-N 3.08Å; I315-F319 HydrophobicContact CG2-CD2 3.74Å; I315-F319 HydrophobicContact CG2-CE2 3.23Å; I315-F319 HydrophobicContact CG2-CZ 4.23Å; I315-F319 WeakPolarHBondContact O-CD2 3.44Å; I315-F319 PolarHBondContact O-N 3.25Å
316Y78.8Confident73.8Confident61 Ų6166.6 Ų66.624%0.23935%0.345CS..Hα-helixtrans-63.4-40.2178-179.7-91.4000112.4V141 L312 G313 E314 Q318 F319 S320V141-Y316 HydrophobicContact CG1-CD2 4.31Å; L312-Y316 VanDerWaalsContact O-CB 3.3Å; L312-Y316 WeakPolarHBondContact O-CB 3.38Å; L312-Y316 PolarHBondContact O-N 3.43Å; G313-Y316 WeakPolarHBondContact O-CB 2.83Å; G313-Y316 PolarHBondContact O-N 3.12Å; E314-Y316 VanDerWaalsContact C-N 3.31Å; Y316-Q318 VanDerWaalsContact C-N 3.25Å; Y316-Q318 PolarHBondContact O-N 3.49Å; Y316-F319 CarbonylContact O-C 3.57Å; Y316-F319 WeakPolarHBondContact O-CA 3.37Å; Y316-F319 PolarHBondContact O-N 3.26Å; Y316-S320 WeakPolarHBondContact O-CB 3.5Å; Y316-S320 PolarHBondContact O-N 2.99Å
317Q80.8Confident72.6Confident124 Ų12467.3 Ų67.358%0.57935%0.351SS*.Hα-helixtrans-59.3-38.9177-70.5-60.5-16.800111.9G313 E314 F319G313-Q317 WeakPolarHBondContact O-CG 3.4Å; G313-Q317 PolarHBondContact O-N 3.09Å; E314-Q317 PolarHBondContact O-N 3.46Å; Q317-F319 PolarHBondContact O-N 3.5Å
318Q74.1Confident71.2Confident93 Ų9371.1 Ų71.144%0.43537%0.367SS..Hα-helixtrans-63.5-28175.2-611796.800112.8E314 I315 Y316E314-Q318 PolarHBondContact O-N 2.9Å; I315-Q318 WeakPolarHBondContact O-CB 3.08Å; I315-Q318 PolarHBondContact O-N 3.08Å; Y316-Q318 VanDerWaalsContact C-N 3.25Å; Y316-Q318 PolarHBondContact O-N 3.49Å
319F75.9Confident69.8Low1 Ų175.7 Ų75.70%0.00439%0.391CS..Hα-helixtrans-93.8-31.3-178.8-67.7-51000113.5K102 L137 S138 V141 I315 Y316 Q317 T321 L322 V323K102-F319 HydrophobicContact CD-CE1 3.87Å; K102-F319 HydrophobicContact CD-CZ 4.15Å; L137-F319 HydrophobicContact CB-CZ 4.38Å; L137-F319 HydrophobicContact CD2-CE1 4.25Å; L137-F319 HydrophobicContact CD2-CE2 4.38Å; L137-F319 HydrophobicContact CD2-CZ 3.54Å; L137-F319 HydrophobicContact CG-CE1 4.29Å; L137-F319 HydrophobicContact CG-CE2 4.09Å; L137-F319 HydrophobicContact CG-CZ 3.59Å; S138-F319 WeakPolarHBondContact OG-CB 3.5Å; V141-F319 HydrophobicContact CB-CD2 4.27Å; V141-F319 HydrophobicContact CB-CE2 4.47Å; V141-F319 HydrophobicContact CG1-CD2 4.27Å; V141-F319 HydrophobicContact CG2-CD2 4.03Å; V141-F319 HydrophobicContact CG2-CE2 3.74Å; I315-F319 HydrophobicContact CG2-CD2 3.74Å; I315-F319 HydrophobicContact CG2-CE2 3.23Å; I315-F319 HydrophobicContact CG2-CZ 4.23Å; I315-F319 WeakPolarHBondContact O-CD2 3.44Å; I315-F319 PolarHBondContact O-N 3.25Å; Y316-F319 CarbonylContact O-C 3.57Å; Y316-F319 WeakPolarHBondContact O-CA 3.37Å; Y316-F319 PolarHBondContact O-N 3.26Å; Q317-F319 PolarHBondContact O-N 3.5Å; F319-T321 VanDerWaalsContact C-N 3.28Å; F319-T321 PolarHBondContact O-N 2.71Å; F319-L322 CarbonylContact O-C 3.58Å; F319-L322 WeakPolarHBondContact O-CA 3.28Å; F319-L322 WeakPolarHBondContact O-CB 3.3Å; F319-L322 PolarHBondContact O-N 3.12Å; F319-V323 WeakPolarHBondContact O-CG2 3.31Å; F319-V323 PolarHBondContact O-N 2.88Å
320S65.7Low68.2Low36 Ų3677.6 Ų77.625%0.25240%0.403SS..Hα-helixtrans-61.2-38.1-178.5-170.80000111.8Y316 L322 Q324Y316-S320 WeakPolarHBondContact O-CB 3.5Å; Y316-S320 PolarHBondContact O-N 2.99Å; S320-L322 VanDerWaalsContact C-N 3.34Å; S320-Q324 WeakPolarHBondContact O-CB 3.36Å; S320-Q324 PolarHBondContact O-N 3.04Å
321T69.8Low66.8Low88 Ų8879.1 Ų79.154%0.5441%0.407SS..Hα-helixtrans-69.3-3717457.40000111.2F319 E325F319-T321 VanDerWaalsContact C-N 3.28Å; F319-T321 PolarHBondContact O-N 2.71Å; T321-E325 WeakPolarHBondContact O-CB 3.24Å; T321-E325 PolarHBondContact O-N 3.31Å
322L64Low65.7Low16 Ų1681.8 Ų81.88%0.08441%0.413CS..Hα-helixtrans-71.1-41.7-177.4-166.1146.2000112.5E134 F319 S320 E325 Q326E134-L322 HydrophobicContact CB-CD2 4.48Å; E134-L322 WeakPolarHBondContact OE2-CD1 3.47Å; F319-L322 CarbonylContact O-C 3.58Å; F319-L322 WeakPolarHBondContact O-CA 3.28Å; F319-L322 WeakPolarHBondContact O-CB 3.3Å; F319-L322 PolarHBondContact O-N 3.12Å; S320-L322 VanDerWaalsContact C-N 3.34Å; L322-E325 PolarHBondContact O-N 2.86Å; L322-Q326 HydrophobicContact CD2-CG 4.41Å; L322-Q326 HydrophobicContact CG-CG 4.39Å; L322-Q326 VanDerWaalsContact O-CB 3.23Å; L322-Q326 WeakPolarHBondContact O-CB 3.19Å; L322-Q326 WeakPolarHBondContact O-CG 3.26Å; L322-Q326 PolarHBondContact O-N 3.5Å
323V58.3Low64.6Low50 Ų5087.4 Ų87.430%0.30344%0.442SS..Hα-helixtrans-68.4-36.2177.7174.40000111.6S138 F319 E325 N327S138-V323 WeakPolarHBondContact OG-CG2 3.45Å; F319-V323 WeakPolarHBondContact O-CG2 3.31Å; F319-V323 PolarHBondContact O-N 2.88Å; V323-E325 VanDerWaalsContact C-N 3.34Å; V323-N327 PolarHBondContact O-N 3.01Å
324Q62.4Low63.4Low172 Ų17291.2 Ų91.280%0.80446%0.456SS*.Hα-helixtrans-73-29.2179.6-166.1166.35.700112.4S320S320-Q324 WeakPolarHBondContact O-CB 3.36Å; S320-Q324 PolarHBondContact O-N 3.04Å
325E57.8Low62.7Low156 Ų15686.1 Ų86.173%0.72944%0.436SS*.Hα-helixtrans-89.6-28.1179.8-165.7173.7-173.100113.3T321 L322 V323T321-E325 WeakPolarHBondContact O-CB 3.24Å; T321-E325 PolarHBondContact O-N 3.31Å; L322-E325 PolarHBondContact O-N 2.86Å; V323-E325 VanDerWaalsContact C-N 3.34Å
326Q49.9Very low61.8Low43 Ų4389 Ų8920%0.20145%0.449CS..Hα-helixtrans-111.2-4.3-168.5-60.5-175.410.400116.4L322 D328 L329L322-Q326 HydrophobicContact CD2-CG 4.41Å; L322-Q326 HydrophobicContact CG-CG 4.39Å; L322-Q326 VanDerWaalsContact O-CB 3.23Å; L322-Q326 WeakPolarHBondContact O-CB 3.19Å; L322-Q326 WeakPolarHBondContact O-CG 3.26Å; L322-Q326 PolarHBondContact O-N 3.5Å; Q326-D328 PolarHBondContact O-N 2.68Å; Q326-L329 PolarHBondContact O-N 3.02Å
327N54.7Low61.3Low93 Ų9389.6 Ų89.650%0.49746%0.459SS..THydrogen-bonded Turntrans-56.7-26-178.7-139.322000112.6V323V323-N327 PolarHBondContact O-N 3.01Å
328D53.1Low60.8Low135 Ų13588.1 Ų88.172%0.72246%0.455SS*.THydrogen-bonded Turntrans-89.1-18.5179.6-128.7-0.3000113.9Q326Q326-D328 PolarHBondContact O-N 2.68Å
329L51.7Low60.6Low101 Ų10186.8 Ų86.853%0.52945%0.451SS..THydrogen-bonded Turntrans-88-26.6-170.6-137151.1000112.6Q326Q326-L329 PolarHBondContact O-N 3.02Å
330V49Very low60.5Low65 Ų6589.4 Ų89.439%0.39447%0.467SS..THydrogen-bonded Turntrans-85.8-22.2-178.2178.10000113I131I131-V330 HydrophobicContact CG2-CG2 3.62Å
331L53.9Low61.1Low141 Ų14193.8 Ų93.874%0.73848%0.483SS*.THydrogen-bonded Turntrans-95.6-14.2179.4-73.9167.5000114.1I333L331-I333 VanDerWaalsContact C-N 3.3Å; L331-I333 PolarHBondContact O-N 2.94Å
332R57.2Low61.5Low152 Ų15295 Ų9557%0.57448%0.484SS*.  trans-89.469.1-177.9-148.5173.7-175.2-130.9-2.3111.1D334 S335R332-D334 PolarHBondContact O-N 3.04Å; R332-S335 PolarHBondContact O-N 3.02Å; R332-S335 VanDerWaalsContact O-N 3.08Å; R332-S335 PolarHBondContact O-OG 3.29Å
333I58.3Low62.3Low128 Ų12896.7 Ų96.766%0.65649%0.493SS*.Hα-helixtrans-47.3-30.1173.1-60.5173.2000110.9L331 T337L331-I333 VanDerWaalsContact C-N 3.3Å; L331-I333 PolarHBondContact O-N 2.94Å; I333-T337 PolarHBondContact O-N 3.3Å; I333-T337 PolarHBondContact O-OG1 3.49Å; I333-T337 VanDerWaalsContact O-OG1 3.09Å
334D57Low63.4Low106 Ų10699.3 Ų99.357%0.56751%0.505SS*.Hα-helixtrans-65.4-38.6-178.8-57.2-23.9000113.8R332 Q336 T337 D338R332-D334 PolarHBondContact O-N 3.04Å; D334-Q336 PolarHBondContact O-N 2.99Å; D334-Q336 VanDerWaalsContact O-N 3.16Å; D334-T337 WeakPolarHBondContact O-CA 3.33Å; D334-T337 VanDerWaalsContact O-CB 3.25Å; D334-T337 WeakPolarHBondContact O-CB 3.45Å; D334-T337 PolarHBondContact O-N 3.31Å; D334-D338 PolarHBondContact O-N 3.16Å
335S64.1Low64.5Low31 Ų3194.8 Ų94.822%0.21749%0.492CS..Hα-helixtrans-65.5-26.5-175.668.30000113.3R332 N339R332-S335 PolarHBondContact O-N 3.02Å; R332-S335 VanDerWaalsContact O-N 3.08Å; R332-S335 PolarHBondContact O-OG 3.29Å; S335-N339 PolarHBondContact O-ND2 3.41Å
336Q61Low65.7Low76 Ų7692.7 Ų92.736%0.35548%0.482SS..Hα-helixtrans-81-29174.6-57.5-166.2-2700111.3D334 V340D334-Q336 PolarHBondContact O-N 2.99Å; D334-Q336 VanDerWaalsContact O-N 3.16Å; Q336-V340 WeakPolarHBondContact O-CG2 3.36Å; Q336-V340 PolarHBondContact O-N 2.95Å
337T67.8Low67.3Low74 Ų7493.3 Ų93.345%0.45450%0.495SS..Hα-helixtrans-68-40.8174.8-53.40000111.1I333 D334 N339 V340 E341I333-T337 PolarHBondContact O-N 3.3Å; I333-T337 PolarHBondContact O-OG1 3.49Å; I333-T337 VanDerWaalsContact O-OG1 3.09Å; D334-T337 WeakPolarHBondContact O-CA 3.33Å; D334-T337 VanDerWaalsContact O-CB 3.25Å; D334-T337 WeakPolarHBondContact O-CB 3.45Å; D334-T337 PolarHBondContact O-N 3.31Å; T337-N339 VanDerWaalsContact C-N 3.31Å; T337-N339 PolarHBondContact O-N 2.8Å; T337-V340 CarbonylContact O-C 3.53Å; T337-V340 WeakPolarHBondContact O-CA 3.49Å; T337-V340 WeakPolarHBondContact O-CB 3.25Å; T337-V340 PolarHBondContact O-N 3.5Å; T337-E341 PolarHBondContact O-N 2.91Å
338D71.2Confident68.8Low94 Ų9494.1 Ų94.150%0.50350%0.495SS..Hα-helixtrans-56.8-44177.8-65.1-22.6000112.4D334 V340 E341 M342D334-D338 PolarHBondContact O-N 3.16Å; D338-V340 VanDerWaalsContact C-N 3.33Å; D338-V340 PolarHBondContact O-N 2.92Å; D338-E341 PolarHBondContact O-N 3.5Å; D338-M342 PolarHBondContact O-N 3.12Å
339N70.5Confident70.4Confident65 Ų6590.1 Ų90.135%0.34848%0.481SS..Hα-helixtrans-68.4-34.8178-73.1-72.1000112.5K124 S335 T337 N343K124-N339 VanDerWaalsContact NZ-CB 3.28Å; S335-N339 PolarHBondContact O-ND2 3.41Å; T337-N339 VanDerWaalsContact C-N 3.31Å; T337-N339 PolarHBondContact O-N 2.8Å; N339-N343 PolarHBondContact O-N 3.3Å; N339-N343 VanDerWaalsContact O-N 3.12Å
340V72.6Confident72Confident55 Ų5591.2 Ų91.233%0.33348%0.484SS..Hα-helixtrans-69-41.2175.61700000109.7Q336 T337 D338 M342 N343 I344Q336-V340 WeakPolarHBondContact O-CG2 3.36Å; Q336-V340 PolarHBondContact O-N 2.95Å; T337-V340 CarbonylContact O-C 3.53Å; T337-V340 WeakPolarHBondContact O-CA 3.49Å; T337-V340 WeakPolarHBondContact O-CB 3.25Å; T337-V340 PolarHBondContact O-N 3.5Å; D338-V340 VanDerWaalsContact C-N 3.33Å; D338-V340 PolarHBondContact O-N 2.92Å; V340-M342 PolarHBondContact O-N 3.47Å; V340-N343 PolarHBondContact O-N 3.28Å; V340-I344 HydrophobicContact CG1-CD1 3.58Å; V340-I344 HydrophobicContact CG1-CG1 4.26Å; V340-I344 WeakPolarHBondContact O-CB 3.32Å; V340-I344 WeakPolarHBondContact O-CG1 3.32Å; V340-I344 PolarHBondContact O-N 3.47Å
341E78.5Confident73.7Confident128 Ų12892.8 Ų92.860%0.59849%0.489SS*.Hα-helixtrans-59.8-45.2174.5-174.9176.4177.800111.3T337 D338 N343 I344 S345T337-E341 PolarHBondContact O-N 2.91Å; D338-E341 PolarHBondContact O-N 3.5Å; E341-N343 PolarHBondContact O-N 2.81Å; E341-I344 PolarHBondContact O-N 3.27Å; E341-S345 VanDerWaalsContact O-CB 3.32Å; E341-S345 WeakPolarHBondContact O-CB 3.34Å; E341-S345 PolarHBondContact O-N 3.35Å
342M79.5Confident75.3Confident115 Ų11589.8 Ų89.857%0.56747%0.473SS*.Hα-helixtrans-59.2-47.3175.8-175.9173.764.400111.8D338 V340 I344 S345 E346D338-M342 PolarHBondContact O-N 3.12Å; V340-M342 PolarHBondContact O-N 3.47Å; M342-I344 PolarHBondContact O-N 2.86Å; M342-S345 WeakPolarHBondContact O-CB 3.45Å; M342-S345 PolarHBondContact O-N 3.35Å; M342-E346 PolarHBondContact O-N 3.19Å
343N80.1Confident76.5Confident51 Ų5187.1 Ų87.127%0.27347%0.474SS..Hα-helixtrans-65.4-37.4178.3-71.9-8.3000112.3N339 V340 E341 E346 A347N339-N343 PolarHBondContact O-N 3.3Å; N339-N343 VanDerWaalsContact O-N 3.12Å; V340-N343 PolarHBondContact O-N 3.28Å; E341-N343 PolarHBondContact O-N 2.81Å; N343-E346 PolarHBondContact O-N 2.81Å; N343-A347 WeakPolarHBondContact O-CB 3.21Å; N343-A347 PolarHBondContact O-N 3.31Å
344I82.1Confident77.7Confident105 Ų10586.8 Ų86.854%0.53847%0.468SS..Hα-helixtrans-66.9-41.8175.4-70.9168.3000110.3V340 E341 M342 E346 A347 H348V340-I344 HydrophobicContact CG1-CD1 3.58Å; V340-I344 HydrophobicContact CG1-CG1 4.26Å; V340-I344 WeakPolarHBondContact O-CB 3.32Å; V340-I344 WeakPolarHBondContact O-CG1 3.32Å; V340-I344 PolarHBondContact O-N 3.47Å; E341-I344 PolarHBondContact O-N 3.27Å; M342-I344 PolarHBondContact O-N 2.86Å; I344-E346 VanDerWaalsContact C-N 3.34Å; I344-A347 PolarHBondContact O-N 3.49Å; I344-H348 WeakPolarHBondContact O-CB 3.41Å; I344-H348 PolarHBondContact O-N 2.96Å
345S84.3Confident78.9Confident77 Ų7787 Ų8754%0.53847%0.467SS..Hα-helixtrans-61.7-42.5176.6-173.70000111.4E341 M342 H348 A349E341-S345 VanDerWaalsContact O-CB 3.32Å; E341-S345 WeakPolarHBondContact O-CB 3.34Å; E341-S345 PolarHBondContact O-N 3.35Å; M342-S345 WeakPolarHBondContact O-CB 3.45Å; M342-S345 PolarHBondContact O-N 3.35Å; S345-H348 PolarHBondContact O-N 3.25Å; S345-A349 PolarHBondContact O-N 2.86Å
346E84Confident79.7Confident111 Ų11194.6 Ų94.652%0.51949%0.491SS..Hα-helixtrans-65.1-45.3174.3-170-179.6175.100111.9M342 N343 I344 H348 A349 Q350M342-E346 PolarHBondContact O-N 3.19Å; N343-E346 PolarHBondContact O-N 2.81Å; I344-E346 VanDerWaalsContact C-N 3.34Å; E346-H348 VanDerWaalsContact C-N 3.29Å; E346-H348 PolarHBondContact O-N 3.38Å; E346-A349 WeakPolarHBondContact O-CB 3.45Å; E346-A349 PolarHBondContact O-N 2.94Å; E346-Q350 WeakPolarHBondContact O-CG 3.49Å; E346-Q350 PolarHBondContact O-N 2.79Å
347A83.3Confident80.6Confident57 Ų57100.3 Ų100.347%0.47151%0.509SS..Hα-helixtrans-60.9-39175.500000111.8N343 I344 Q350 L351N343-A347 WeakPolarHBondContact O-CB 3.21Å; N343-A347 PolarHBondContact O-N 3.31Å; I344-A347 PolarHBondContact O-N 3.49Å; A347-Q350 PolarHBondContact O-N 3.24Å; A347-L351 WeakPolarHBondContact O-CB 3.41Å; A347-L351 PolarHBondContact O-N 2.91Å
348H85.9Confident80.9Confident109 Ų10999.6 Ų99.651%0.50550%0.502SS..Hα-helixtrans-65.6-42.7175.1-176.4-101.9000111.5I344 S345 E346 Q350 L351 L352I344-H348 WeakPolarHBondContact O-CB 3.41Å; I344-H348 PolarHBondContact O-N 2.96Å; S345-H348 PolarHBondContact O-N 3.25Å; E346-H348 VanDerWaalsContact C-N 3.29Å; E346-H348 PolarHBondContact O-N 3.38Å; H348-Q350 VanDerWaalsContact C-N 3.33Å; H348-Q350 PolarHBondContact O-N 3.47Å; H348-L351 WeakPolarHBondContact O-CB 3.49Å; H348-L351 PolarHBondContact O-N 2.91Å; H348-L352 WeakPolarHBondContact O-CG 3.38Å; H348-L352 PolarHBondContact O-N 3.23Å
349A87.1Confident81.2Confident52 Ų5298.9 Ų98.943%0.4350%0.504SS..Hα-helixtrans-58.9-44.517400000111.5S345 E346 L352 V353S345-A349 PolarHBondContact O-N 2.86Å; E346-A349 WeakPolarHBondContact O-CB 3.45Å; E346-A349 PolarHBondContact O-N 2.94Å; A349-L352 PolarHBondContact O-N 3.19Å; A349-V353 WeakPolarHBondContact O-CG2 3.4Å; A349-V353 PolarHBondContact O-N 3.26Å
350Q84.1Confident81.2Confident124 Ų12499 Ų9958%0.57951%0.514SS*.Hα-helixtrans-65.7-39175.9-68.3-175.412.600112.6E346 A347 H348 L352 V353 F354E346-Q350 WeakPolarHBondContact O-CG 3.49Å; E346-Q350 PolarHBondContact O-N 2.79Å; A347-Q350 PolarHBondContact O-N 3.24Å; H348-Q350 VanDerWaalsContact C-N 3.33Å; H348-Q350 PolarHBondContact O-N 3.47Å; Q350-L352 VanDerWaalsContact C-N 3.33Å; Q350-L352 PolarHBondContact O-N 2.89Å; Q350-V353 WeakPolarHBondContact O-CB 3.28Å; Q350-V353 PolarHBondContact O-N 3.43Å; Q350-F354 PolarHBondContact O-N 3.37Å
351L85.1Confident81.3Confident98 Ų98102.9 Ų102.951%0.51353%0.529SS..Hα-helixtrans-61.8-41.7174.9-166.8101.2000111.1A347 H348 V353 F354 M355A347-L351 WeakPolarHBondContact O-CB 3.41Å; A347-L351 PolarHBondContact O-N 2.91Å; H348-L351 WeakPolarHBondContact O-CB 3.49Å; H348-L351 PolarHBondContact O-N 2.91Å; L351-V353 VanDerWaalsContact C-N 3.35Å; L351-F354 PolarHBondContact O-N 3.36Å; L351-M355 WeakPolarHBondContact O-CB 3.38Å; L351-M355 VanDerWaalsContact O-CG 3.28Å; L351-M355 WeakPolarHBondContact O-CG 3.48Å; L351-M355 PolarHBondContact O-N 2.95Å
352L87.1Confident81.4Confident77 Ų77105.4 Ų105.440%0.40353%0.533SS..Hα-helixtrans-63.8-40.2175.5-71.4178.7000111.9H348 A349 Q350 M355 R356H348-L352 WeakPolarHBondContact O-CG 3.38Å; H348-L352 PolarHBondContact O-N 3.23Å; A349-L352 PolarHBondContact O-N 3.19Å; Q350-L352 VanDerWaalsContact C-N 3.33Å; Q350-L352 PolarHBondContact O-N 2.89Å; L352-M355 PolarHBondContact O-N 2.88Å; L352-R356 WeakPolarHBondContact O-CG 3.41Å; L352-R356 PolarHBondContact O-N 3.49Å
353V83.9Confident81.4Confident96 Ų96101.5 Ų101.558%0.58252%0.522SS*.Hα-helixtrans-61.1-45.1173.2172.50000110.6A349 Q350 L351 R356 R357A349-V353 WeakPolarHBondContact O-CG2 3.4Å; A349-V353 PolarHBondContact O-N 3.26Å; Q350-V353 WeakPolarHBondContact O-CB 3.28Å; Q350-V353 PolarHBondContact O-N 3.43Å; L351-V353 VanDerWaalsContact C-N 3.35Å; V353-R356 PolarHBondContact O-N 3.13Å; V353-R357 PolarHBondContact O-N 3.49Å
354F82.4Confident81.3Confident121 Ų121105 Ų10553%0.53154%0.54SS..Hα-helixtrans-64.5-42.5176.9-178.4-109.7000112.7Q350 L351 R356 R357 I358Q350-F354 PolarHBondContact O-N 3.37Å; L351-F354 PolarHBondContact O-N 3.36Å; F354-R356 PolarHBondContact O-N 3.47Å; F354-R357 WeakPolarHBondContact O-CB 3.18Å; F354-R357 PolarHBondContact O-N 3.38Å; F354-R357 VanDerWaalsContact O-N 3.13Å; F354-I358 HydrophobicContact CD1-CD1 3.81Å; F354-I358 HydrophobicContact CD1-CG1 4.48Å; F354-I358 HydrophobicContact CE1-CD1 3.15Å; F354-I358 HydrophobicContact CE1-CG1 4.14Å; F354-I358 HydrophobicContact CE2-CD1 4Å; F354-I358 HydrophobicContact CE2-CG1 4.27Å; F354-I358 HydrophobicContact CG-CD1 4.48Å; F354-I358 HydrophobicContact CZ-CD1 3.29Å; F354-I358 HydrophobicContact CZ-CG1 4.04Å; F354-I358 PolarHBondContact O-N 3.42Å
355M82.3Confident81.2Confident112 Ų112105.5 Ų105.555%0.55254%0.543SS*.Hα-helixtrans-62.7-41176.1-76.2-70.5-101.900111.6L351 L352 R357 I358 S359L351-M355 WeakPolarHBondContact O-CB 3.38Å; L351-M355 VanDerWaalsContact O-CG 3.28Å; L351-M355 WeakPolarHBondContact O-CG 3.48Å; L351-M355 PolarHBondContact O-N 2.95Å; L352-M355 PolarHBondContact O-N 2.88Å; M355-R357 VanDerWaalsContact C-N 3.34Å; M355-R357 PolarHBondContact O-N 2.93Å; M355-I358 PolarHBondContact O-N 3.05Å; M355-S359 WeakPolarHBondContact O-CB 3.38Å; M355-S359 PolarHBondContact O-N 3Å
356R81.7Confident81.3Confident189 Ų189106.4 Ų106.471%0.71354%0.541SS*.Hα-helixtrans-61.6-41.7171.8-75.6-179.6-173.3160.63.2111.6L352 V353 F354 S359 A360L352-R356 WeakPolarHBondContact O-CG 3.41Å; L352-R356 PolarHBondContact O-N 3.49Å; V353-R356 PolarHBondContact O-N 3.13Å; F354-R356 PolarHBondContact O-N 3.47Å; R356-S359 PolarHBondContact O-N 3.5Å; R356-A360 VanDerWaalsContact O-CB 3.26Å; R356-A360 WeakPolarHBondContact O-CB 3.49Å; R356-A360 PolarHBondContact O-N 3Å
357R79.5Confident81.4Confident196 Ų196108.1 Ų108.174%0.7455%0.547SS*.Hα-helixtrans-63.6-46.1178-163.3178.2-160.9-175.75.7112.4V353 F354 M355 Q361V353-R357 PolarHBondContact O-N 3.49Å; F354-R357 WeakPolarHBondContact O-CB 3.18Å; F354-R357 PolarHBondContact O-N 3.38Å; F354-R357 VanDerWaalsContact O-N 3.13Å; M355-R357 VanDerWaalsContact C-N 3.34Å; M355-R357 PolarHBondContact O-N 2.93Å; R357-Q361 PolarHBondContact O-N 3.42Å
358I75Confident81.6Confident59 Ų59108.2 Ų108.230%0.30355%0.547SS..Hα-helixtrans-65.5-45.1176-73.5-177.8000111.1F354 M355 A360 Q361 R362F354-I358 HydrophobicContact CD1-CD1 3.81Å; F354-I358 HydrophobicContact CD1-CG1 4.48Å; F354-I358 HydrophobicContact CE1-CD1 3.15Å; F354-I358 HydrophobicContact CE1-CG1 4.14Å; F354-I358 HydrophobicContact CE2-CD1 4Å; F354-I358 HydrophobicContact CE2-CG1 4.27Å; F354-I358 HydrophobicContact CG-CD1 4.48Å; F354-I358 HydrophobicContact CZ-CD1 3.29Å; F354-I358 HydrophobicContact CZ-CG1 4.04Å; F354-I358 PolarHBondContact O-N 3.42Å; M355-I358 PolarHBondContact O-N 3.05Å; I358-A360 VanDerWaalsContact C-N 3.33Å; I358-A360 PolarHBondContact O-N 3.32Å; I358-Q361 PolarHBondContact O-N 2.87Å; I358-R362 PolarHBondContact O-N 3.25Å
359S75.7Confident81.8Confident79 Ų79108.6 Ų108.655%0.55255%0.548SS*.Hα-helixtrans-62.2-42.6-179.6-170.40000111.2M355 R356 Q361 R362 G363M355-S359 WeakPolarHBondContact O-CB 3.38Å; M355-S359 PolarHBondContact O-N 3Å; R356-S359 PolarHBondContact O-N 3.5Å; S359-Q361 VanDerWaalsContact C-N 3.29Å; S359-Q361 PolarHBondContact O-N 3.34Å; S359-R362 WeakPolarHBondContact O-CB 3.44Å; S359-R362 PolarHBondContact O-N 3.21Å; S359-R362 VanDerWaalsContact O-N 3.15Å; S359-G363 PolarHBondContact O-N 3.12Å
360A71.7Confident82Confident68 Ų68111 Ų11156%0.56255%0.553SS**Hα-helixtrans-59.9-37.8175.200000112.6R356 I358 R362 G363 L364R356-A360 VanDerWaalsContact O-CB 3.26Å; R356-A360 WeakPolarHBondContact O-CB 3.49Å; R356-A360 PolarHBondContact O-N 3Å; I358-A360 VanDerWaalsContact C-N 3.33Å; I358-A360 PolarHBondContact O-N 3.32Å; A360-R362 VanDerWaalsContact C-N 3.31Å; A360-R362 PolarHBondContact O-N 3.25Å; A360-G363 WeakPolarHBondContact O-CA 3.26Å; A360-G363 PolarHBondContact O-N 3.19Å; A360-G363 VanDerWaalsContact O-N 3.12Å; A360-L364 PolarHBondContact O-N 3.42Å
361Q73.5Confident82.4Confident136 Ų136109.6 Ų109.664%0.63655%0.552SS**Hα-helixtrans-68.2-29.2178.7-165.3173.4-000112.8R357 I358 S359 G363 L364 L365R357-Q361 PolarHBondContact O-N 3.42Å; I358-Q361 PolarHBondContact O-N 2.87Å; S359-Q361 VanDerWaalsContact C-N 3.29Å; S359-Q361 PolarHBondContact O-N 3.34Å; Q361-G363 VanDerWaalsContact C-N 3.32Å; Q361-L364 PolarHBondContact O-N 2.9Å; Q361-L365 PolarHBondContact O-N 2.91Å
362R81.4Confident82.8Confident182 Ų182110 Ų11069%0.68755%0.554SS**Hα-helixtrans-65.8-37.3170.6-63.3-179.1179.1-173.1-0.7111.6I358 S359 A360 L364 L365 I366I358-R362 PolarHBondContact O-N 3.25Å; S359-R362 WeakPolarHBondContact O-CB 3.44Å; S359-R362 PolarHBondContact O-N 3.21Å; S359-R362 VanDerWaalsContact O-N 3.15Å; A360-R362 VanDerWaalsContact C-N 3.31Å; A360-R362 PolarHBondContact O-N 3.25Å; R362-L364 VanDerWaalsContact C-N 3.27Å; R362-L364 PolarHBondContact O-N 3.46Å; R362-L365 PolarHBondContact O-N 3.23Å; R362-I366 PolarHBondContact O-N 3.01Å
363G79.2Confident83Confident33 Ų33110.3 Ų110.334%0.3456%0.556SS.*Hα-helixtrans-62.4-32.3173.200000113.2S359 A360 Q361 I366 K367S359-G363 PolarHBondContact O-N 3.12Å; A360-G363 WeakPolarHBondContact O-CA 3.26Å; A360-G363 PolarHBondContact O-N 3.19Å; A360-G363 VanDerWaalsContact O-N 3.12Å; Q361-G363 VanDerWaalsContact C-N 3.32Å; G363-I366 VanDerWaalsContact O-CG2 3.32Å; G363-I366 WeakPolarHBondContact O-CG2 3.43Å; G363-K367 VanDerWaalsContact O-CG 3.29Å; G363-K367 WeakPolarHBondContact O-CG 3.5Å; G363-K367 PolarHBondContact O-N 2.88Å
364L78.9Confident83.5Confident123 Ų123111.4 Ų111.464%0.64456%0.558SS**Hα-helixtrans-74.5-41.7172.8-174136.3000111.7A360 Q361 R362 K367 A368A360-L364 PolarHBondContact O-N 3.42Å; Q361-L364 PolarHBondContact O-N 2.9Å; R362-L364 VanDerWaalsContact C-N 3.27Å; R362-L364 PolarHBondContact O-N 3.46Å; L364-K367 PolarHBondContact O-N 2.88Å; L364-A368 PolarHBondContact O-N 3.41Å
365L80.1Confident84Confident116 Ų116109.6 Ų109.661%0.60756%0.559SS**Hα-helixtrans-64.8-42.8178.7-168.7154.9000112Q361 R362 K367 A368 F369Q361-L365 PolarHBondContact O-N 2.91Å; R362-L365 PolarHBondContact O-N 3.23Å; L365-K367 VanDerWaalsContact C-N 3.3Å; L365-K367 PolarHBondContact O-N 3.34Å; L365-A368 PolarHBondContact O-N 3.15Å; L365-F369 PolarHBondContact O-N 3.35Å
366I84.6Confident84.6Confident96 Ų96111 Ų11149%0.49256%0.562SS.*Hα-helixtrans-62.7-39.1177.9-16077.5000111.2R362 G363 F369 I370R362-I366 PolarHBondContact O-N 3.01Å; G363-I366 VanDerWaalsContact O-CG2 3.32Å; G363-I366 WeakPolarHBondContact O-CG2 3.43Å; I366-F369 PolarHBondContact O-N 3.46Å; I366-I370 HydrophobicContact CG1-CD1 4.44Å; I366-I370 VanDerWaalsContact O-CG1 3.31Å; I366-I370 WeakPolarHBondContact O-CG1 3.3Å; I366-I370 PolarHBondContact O-N 2.94Å
367K87Confident85.1Confident148 Ų148106.3 Ų106.364%0.64355%0.554SS**Hα-helixtrans-62.8-46.5174.4-74.2175.4-179.7-179.40111.2G363 L364 L365 F369 I370 T371G363-K367 VanDerWaalsContact O-CG 3.29Å; G363-K367 WeakPolarHBondContact O-CG 3.5Å; G363-K367 PolarHBondContact O-N 2.88Å; L364-K367 PolarHBondContact O-N 2.88Å; L365-K367 VanDerWaalsContact C-N 3.3Å; L365-K367 PolarHBondContact O-N 3.34Å; K367-F369 VanDerWaalsContact C-N 3.31Å; K367-F369 PolarHBondContact O-N 3.19Å; K367-I370 PolarHBondContact O-N 3.3Å; K367-T371 PolarHBondContact O-N 3.19Å; K367-T371 PolarHBondContact O-OG1 3.46Å; K367-T371 VanDerWaalsContact O-OG1 3.13Å
368A86.8Confident85.8Confident58 Ų58100.5 Ų100.548%0.47954%0.541SS..Hα-helixtrans-60.8-39.2176.900000112.4L364 L365 T371 L372L364-A368 PolarHBondContact O-N 3.41Å; L365-A368 PolarHBondContact O-N 3.15Å; A368-T371 PolarHBondContact O-N 3.41Å; A368-L372 PolarHBondContact O-N 3.44Å
369F89.9Confident86.8Confident117 Ų117103.8 Ų103.851%0.51355%0.553SS.*Hα-helixtrans-66.4-41.1177.4-166.5-106.7000112.4L365 I366 K367 L372 I373L365-F369 PolarHBondContact O-N 3.35Å; I366-F369 PolarHBondContact O-N 3.46Å; K367-F369 VanDerWaalsContact C-N 3.31Å; K367-F369 PolarHBondContact O-N 3.19Å; F369-L372 WeakPolarHBondContact O-CB 3.29Å; F369-L372 PolarHBondContact O-N 3.32Å; F369-I373 HydrophobicContact CD1-CD1 3.67Å; F369-I373 HydrophobicContact CE1-CD1 3.42Å; F369-I373 VanDerWaalsContact CE1-CD1 3.42Å; F369-I373 HydrophobicContact CE1-CG1 4.33Å; F369-I373 HydrophobicContact CZ-CD1 4.12Å; F369-I373 WeakPolarHBondContact O-CG1 3.43Å; F369-I373 PolarHBondContact O-N 3.01Å
370I93Very high87.6Confident104 Ų104102.4 Ų102.453%0.53355%0.546SS..Hα-helixtrans-62.8-44.9174.7-68.3164.7000110.8I366 K367 L372 I373 L374I366-I370 HydrophobicContact CG1-CD1 4.44Å; I366-I370 VanDerWaalsContact O-CG1 3.31Å; I366-I370 WeakPolarHBondContact O-CG1 3.3Å; I366-I370 PolarHBondContact O-N 2.94Å; K367-I370 PolarHBondContact O-N 3.3Å; I370-L372 VanDerWaalsContact C-N 3.32Å; I370-L372 PolarHBondContact O-N 2.98Å; I370-I373 PolarHBondContact O-N 3.29Å; I370-L374 PolarHBondContact O-N 3.02Å
371T91.1Very high88.7Confident94 Ų94108.8 Ų108.858%0.57756%0.556SS**Hα-helixtrans-61.5-39.7176.7-57.90000111.8K367 A368 L374 C375K367-T371 PolarHBondContact O-N 3.19Å; K367-T371 PolarHBondContact O-OG1 3.46Å; K367-T371 VanDerWaalsContact O-OG1 3.13Å; A368-T371 PolarHBondContact O-N 3.41Å; T371-L374 PolarHBondContact O-N 3.4Å; T371-C375 WeakPolarHBondContact O-CB 3.36Å; T371-C375 PolarHBondContact O-N 3.13Å
372L93Very high89.8Confident105 Ų105107.8 Ų107.855%0.5555%0.554SS.*Hα-helixtrans-61.9-48.7175.4-157.3-160.4000111.1A368 F369 I370 L374 C375 F376A368-L372 PolarHBondContact O-N 3.44Å; F369-L372 WeakPolarHBondContact O-CB 3.29Å; F369-L372 PolarHBondContact O-N 3.32Å; I370-L372 VanDerWaalsContact C-N 3.32Å; I370-L372 PolarHBondContact O-N 2.98Å; L372-L374 VanDerWaalsContact C-N 3.33Å; L372-L374 PolarHBondContact O-N 2.97Å; L372-C375 WeakPolarHBondContact O-CB 3.32Å; L372-C375 PolarHBondContact O-N 3.42Å; L372-F376 PolarHBondContact O-N 2.98Å
373I92.9Very high90.4Very high85 Ų85104.1 Ų104.144%0.43655%0.552SS.*Hα-helixtrans-58.8-45.8178.5-70.8169.3000110.8F369 I370 C375 F376 V377F369-I373 HydrophobicContact CD1-CD1 3.67Å; F369-I373 HydrophobicContact CE1-CD1 3.42Å; F369-I373 VanDerWaalsContact CE1-CD1 3.42Å; F369-I373 HydrophobicContact CE1-CG1 4.33Å; F369-I373 HydrophobicContact CZ-CD1 4.12Å; F369-I373 WeakPolarHBondContact O-CG1 3.43Å; F369-I373 PolarHBondContact O-N 3.01Å; I370-I373 PolarHBondContact O-N 3.29Å; I373-C375 VanDerWaalsContact C-N 3.31Å; I373-C375 PolarHBondContact O-N 3.44Å; I373-F376 PolarHBondContact O-N 3Å; I373-V377 HydrophobicContact CG2-CG2 4.47Å; I373-V377 WeakPolarHBondContact O-CG2 3.31Å; I373-V377 PolarHBondContact O-N 3.02Å
374L94.2Very high90.6Very high118 Ų118113.8 Ų113.862%0.61858%0.584SS**Hα-helixtrans-59-44.7177.7-168.695.7000111.3I370 T371 L372 F376 V377 V378I370-L374 PolarHBondContact O-N 3.02Å; T371-L374 PolarHBondContact O-N 3.4Å; L372-L374 VanDerWaalsContact C-N 3.33Å; L372-L374 PolarHBondContact O-N 2.97Å; L374-F376 VanDerWaalsContact C-N 3.34Å; L374-F376 PolarHBondContact O-N 3.4Å; L374-V377 PolarHBondContact O-N 3.35Å; L374-V378 WeakPolarHBondContact O-CG2 3.39Å; L374-V378 PolarHBondContact O-N 2.86Å
375C93Very high91.2Very high83 Ų83113.3 Ų113.356%0.56158%0.581SS**Hα-helixtrans-60.5-42.5176.7-176.90000111.8T371 L372 I373 V378 F379T371-C375 WeakPolarHBondContact O-CB 3.36Å; T371-C375 PolarHBondContact O-N 3.13Å; L372-C375 WeakPolarHBondContact O-CB 3.32Å; L372-C375 PolarHBondContact O-N 3.42Å; I373-C375 VanDerWaalsContact C-N 3.31Å; I373-C375 PolarHBondContact O-N 3.44Å; C375-V378 PolarHBondContact O-N 2.95Å; C375-F379 VanDerWaalsContact O-CB 3.25Å; C375-F379 WeakPolarHBondContact O-CB 3.38Å; C375-F379 PolarHBondContact O-N 2.99Å
376F93.7Very high91.7Very high141 Ų141113.2 Ų113.262%0.61858%0.58SS**Hα-helixtrans-65.1-39.6177.8-166.5-96.6000112.5L372 I373 L374 F379 A380L372-F376 PolarHBondContact O-N 2.98Å; I373-F376 PolarHBondContact O-N 3Å; L374-F376 VanDerWaalsContact C-N 3.34Å; L374-F376 PolarHBondContact O-N 3.4Å; F376-F379 PolarHBondContact O-N 3.19Å; F376-A380 VanDerWaalsContact O-CB 3.3Å; F376-A380 WeakPolarHBondContact O-CB 3.25Å; F376-A380 PolarHBondContact O-N 3.38Å
377V93.9Very high92.1Very high91 Ų91114.1 Ų114.155%0.55258%0.584SS**Hα-helixtrans-64.9-45.4175.8172.80000111.1I373 L374 A380 W381I373-V377 HydrophobicContact CG2-CG2 4.47Å; I373-V377 WeakPolarHBondContact O-CG2 3.31Å; I373-V377 PolarHBondContact O-N 3.02Å; L374-V377 PolarHBondContact O-N 3.35Å; V377-A380 PolarHBondContact O-N 3.42Å; V377-W381 WeakPolarHBondContact O-CB 3.34Å; V377-W381 PolarHBondContact O-N 3.45Å
378V93.9Very high92.4Very high74 Ų74112.1 Ų112.145%0.44858%0.581SS.*Hα-helixtrans-63.7-43.2176.8171.30000110.9L374 C375 W381 I382L374-V378 WeakPolarHBondContact O-CG2 3.39Å; L374-V378 PolarHBondContact O-N 2.86Å; C375-V378 PolarHBondContact O-N 2.95Å; V378-W381 PolarHBondContact O-N 3.24Å; V378-I382 HydrophobicContact CG1-CD1 3.76Å; V378-I382 HydrophobicContact CG1-CG1 4.48Å; V378-I382 WeakPolarHBondContact O-CG1 3.43Å; V378-I382 PolarHBondContact O-N 3.4Å
379F94.2Very high92.8Very high129 Ų129115.5 Ų115.557%0.56659%0.587SS**Hα-helixtrans-62.2-45.2176.7-179-98.5000112C375 F376 W381 I382 V383C375-F379 VanDerWaalsContact O-CB 3.25Å; C375-F379 WeakPolarHBondContact O-CB 3.38Å; C375-F379 PolarHBondContact O-N 2.99Å; F376-F379 PolarHBondContact O-N 3.19Å; F379-W381 VanDerWaalsContact C-N 3.27Å; F379-W381 PolarHBondContact O-N 3.32Å; F379-I382 PolarHBondContact O-N 3.01Å; F379-V383 HydrophobicContact CD1-CG2 4.24Å; F379-V383 HydrophobicContact CD2-CG2 4.46Å; F379-V383 HydrophobicContact CE1-CG2 3.83Å; F379-V383 HydrophobicContact CE2-CG2 4.07Å; F379-V383 HydrophobicContact CZ-CG2 3.74Å; F379-V383 WeakPolarHBondContact O-CG2 3.44Å; F379-V383 PolarHBondContact O-N 3.38Å
380A93.3Very high93Very high50 Ų50115.4 Ų115.441%0.41359%0.592SS.*Hα-helixtrans-63.5-32.8175.900000112.7F376 V377 K384F376-A380 VanDerWaalsContact O-CB 3.3Å; F376-A380 WeakPolarHBondContact O-CB 3.25Å; F376-A380 PolarHBondContact O-N 3.38Å; V377-A380 PolarHBondContact O-N 3.42Å; A380-K384 WeakPolarHBondContact O-CB 3.43Å; A380-K384 PolarHBondContact O-N 2.97Å
381W95.5Very high93Very high202 Ų202116.2 Ų116.277%0.76560%0.597SS**Hα-helixtrans-72.5-32.1174.3-175.378.6000113.1V377 V378 F379V377-W381 WeakPolarHBondContact O-CB 3.34Å; V377-W381 PolarHBondContact O-N 3.45Å; V378-W381 PolarHBondContact O-N 3.24Å; F379-W381 VanDerWaalsContact C-N 3.27Å; F379-W381 PolarHBondContact O-N 3.32Å
382I95.2Very high93.1Very high115 Ų115117.9 Ų117.959%0.5960%0.598SS**Hα-helixtrans-76.8-34.4177.1-72.4166.9000112.3V378 F379V378-I382 HydrophobicContact CG1-CD1 3.76Å; V378-I382 HydrophobicContact CG1-CG1 4.48Å; V378-I382 WeakPolarHBondContact O-CG1 3.43Å; V378-I382 PolarHBondContact O-N 3.4Å; F379-I382 PolarHBondContact O-N 3.01Å
383V93.8Very high93.1Very high105 Ų105119 Ų11964%0.63660%0.602SS**Hα-helixtrans-77.2-23.8-178.7169.70000112.4F379F379-V383 HydrophobicContact CD1-CG2 4.24Å; F379-V383 HydrophobicContact CD2-CG2 4.46Å; F379-V383 HydrophobicContact CE1-CG2 3.83Å; F379-V383 HydrophobicContact CE2-CG2 4.07Å; F379-V383 HydrophobicContact CZ-CG2 3.74Å; F379-V383 WeakPolarHBondContact O-CG2 3.44Å; F379-V383 PolarHBondContact O-N 3.38Å
384K84.1Confident93.2Very high235 Ų235122.1 Ų122.1100%1.02262%0.617SS**  trans-89.70176.9-175.1176.2-179.9167.30110.7A380A380-K384 WeakPolarHBondContact O-CB 3.43Å; A380-K384 PolarHBondContact O-N 2.97Å

Retrieved 384 of 384 residues in 97.7 ms (Link to these results)

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