A0A087YHB1_POEFO Loading...

Cytochrome c oxidase assembly protein COX16 homolog, mitochondrial

AlphaFold DB , UniProt , Accession A0A087YHB1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 116 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
1M52.7Low74.8Confident209 Ų209115.9 Ų115.9100%1.0362%0.616SS**  0105.80-149.9164.3-176.700106.1
2T78.6Confident74.5Confident85 Ų85118.9 Ų118.952%0.52162%0.62SS.*  trans-93.1153.7-156.541.70000112.4E4 E5T2-E4 PolarHBondContact O-N 2.8Å; T2-E5 PolarHBondContact O-N 3.21Å; T2-E5 VanDerWaalsContact O-N 3.13Å
3T76.9Confident74.4Confident107 Ų107115.3 Ų115.366%0.65661%0.611SS**Hα-helixtrans-55.2-29.4178.5450000113.6E5 H6 V7T3-E5 VanDerWaalsContact C-N 3.32Å; T3-E5 PolarHBondContact O-N 3.41Å; T3-H6 PolarHBondContact O-N 3.45Å; T3-V7 WeakPolarHBondContact O-CG2 3.24Å; T3-V7 PolarHBondContact O-N 3.38Å; T3-V7 VanDerWaalsContact O-N 3.14Å
4E75.9Confident74.6Confident139 Ų139118.5 Ų118.565%0.6561%0.611SS**Hα-helixtrans-61.5-35.9177.5-63.4-59.2123.900113T2 V7 A8T2-E4 PolarHBondContact O-N 2.8Å; E4-V7 PolarHBondContact O-N 3Å; E4-A8 WeakPolarHBondContact O-CB 3.46Å; E4-A8 PolarHBondContact O-N 3.28Å
5E78.3Confident74.6Confident119 Ų119121.3 Ų121.356%0.55662%0.616SS**Hα-helixtrans-73.5-35.6-179.9-61.9-153.6150.500112T2 T3 A8 E9T2-E5 PolarHBondContact O-N 3.21Å; T2-E5 VanDerWaalsContact O-N 3.13Å; T3-E5 VanDerWaalsContact C-N 3.32Å; T3-E5 PolarHBondContact O-N 3.41Å; E5-A8 PolarHBondContact O-N 3.01Å; E5-E9 WeakPolarHBondContact O-CB 3.02Å; E5-E9 PolarHBondContact O-N 3.35Å
6H75.9Confident74.7Confident114 Ų114118.3 Ų118.353%0.52861%0.606SS.*Hα-helixtrans-65.8-40.7174.2-78.965.9000111.6T3 E9 V10T3-H6 PolarHBondContact O-N 3.45Å; H6-E9 PolarHBondContact O-N 2.93Å; H6-V10 WeakPolarHBondContact O-CB 3.47Å; H6-V10 VanDerWaalsContact O-CG2 3.26Å; H6-V10 WeakPolarHBondContact O-CG2 3.44Å; H6-V10 PolarHBondContact O-N 3.34Å
7V78.9Confident74.7Confident78 Ų78116.4 Ų116.447%0.47360%0.597SS.*Hα-helixtrans-65.4-43.9176.9173.20000110.3T3 E4 E9 V10 M11T3-V7 WeakPolarHBondContact O-CG2 3.24Å; T3-V7 PolarHBondContact O-N 3.38Å; T3-V7 VanDerWaalsContact O-N 3.14Å; E4-V7 PolarHBondContact O-N 3Å; V7-E9 PolarHBondContact O-N 3.43Å; V7-V10 PolarHBondContact O-N 3.31Å; V7-M11 HydrophobicContact CG1-CG 4.43Å; V7-M11 HydrophobicContact CG1-SD 3.92Å; V7-M11 WeakPolarHBondContact O-CB 3.43Å; V7-M11 VanDerWaalsContact O-CG 3.27Å; V7-M11 WeakPolarHBondContact O-CG 3.47Å; V7-M11 PolarHBondContact O-N 2.98Å
8A76.1Confident74.7Confident57 Ų57115.7 Ų115.747%0.47159%0.591SS.*Hα-helixtrans-62-41.3176.800000112.3E4 E5 M11 F12E4-A8 WeakPolarHBondContact O-CB 3.46Å; E4-A8 PolarHBondContact O-N 3.28Å; E5-A8 PolarHBondContact O-N 3.01Å; A8-M11 PolarHBondContact O-N 2.98Å; A8-F12 VanDerWaalsContact O-CB 3.29Å; A8-F12 WeakPolarHBondContact O-CB 3.36Å; A8-F12 PolarHBondContact O-N 2.88Å
9E78.4Confident75.1Confident136 Ų136121.1 Ų121.164%0.63660%0.603SS**Hα-helixtrans-65.7-43.6178.4-165.9179.2-168.500112E5 H6 V7 F12 S13E5-E9 WeakPolarHBondContact O-CB 3.02Å; E5-E9 PolarHBondContact O-N 3.35Å; H6-E9 PolarHBondContact O-N 2.93Å; V7-E9 PolarHBondContact O-N 3.43Å; E9-F12 PolarHBondContact O-N 2.66Å; E9-S13 WeakPolarHBondContact O-CB 3.38Å; E9-S13 PolarHBondContact O-N 3.07Å
10V79Confident75.5Confident102 Ų102119.5 Ų119.562%0.61860%0.597SS**Hα-helixtrans-63.6-44.8176170.20000111.3H6 V7 F12 S13 W14H6-V10 WeakPolarHBondContact O-CB 3.47Å; H6-V10 VanDerWaalsContact O-CG2 3.26Å; H6-V10 WeakPolarHBondContact O-CG2 3.44Å; H6-V10 PolarHBondContact O-N 3.34Å; V7-V10 PolarHBondContact O-N 3.31Å; V10-F12 PolarHBondContact O-N 2.9Å; V10-S13 PolarHBondContact O-N 3.37Å; V10-W14 WeakPolarHBondContact O-CB 3.5Å; V10-W14 PolarHBondContact O-N 3.36Å
11M72.2Confident75.9Confident129 Ų129121.7 Ų121.764%0.63560%0.603SS**Hα-helixtrans-65.2-38.1177.8-72-179.869.900112.4V7 A8 W14 K15V7-M11 HydrophobicContact CG1-CG 4.43Å; V7-M11 HydrophobicContact CG1-SD 3.92Å; V7-M11 WeakPolarHBondContact O-CB 3.43Å; V7-M11 VanDerWaalsContact O-CG 3.27Å; V7-M11 WeakPolarHBondContact O-CG 3.47Å; V7-M11 PolarHBondContact O-N 2.98Å; A8-M11 PolarHBondContact O-N 2.98Å; M11-W14 PolarHBondContact O-N 3.49Å; M11-K15 PolarHBondContact O-N 2.92Å; M11-K15 VanDerWaalsContact O-N 3.12Å
12F70.9Confident77.5Confident152 Ų152117.2 Ų117.267%0.66759%0.587SS**Hα-helixtrans-68-42.4176.5-176.2-99.3000112A8 E9 V10 W14 K15 T16A8-F12 VanDerWaalsContact O-CB 3.29Å; A8-F12 WeakPolarHBondContact O-CB 3.36Å; A8-F12 PolarHBondContact O-N 2.88Å; E9-F12 PolarHBondContact O-N 2.66Å; V10-F12 PolarHBondContact O-N 2.9Å; F12-W14 VanDerWaalsContact C-N 3.34Å; F12-W14 PolarHBondContact O-N 2.93Å; F12-K15 PolarHBondContact O-N 3.48Å; F12-T16 PolarHBondContact O-N 2.98Å; F12-T16 VanDerWaalsContact O-N 3.08Å; F12-T16 PolarHBondContact O-OG1 2.96Å
13S73.3Confident78Confident72 Ų72115.2 Ų115.250%0.50358%0.575SS.*Hα-helixtrans-61.3-42.6174.2-175.70000111.4E9 V10 K15 T16 L17E9-S13 WeakPolarHBondContact O-CB 3.38Å; E9-S13 PolarHBondContact O-N 3.07Å; V10-S13 PolarHBondContact O-N 3.37Å; S13-K15 PolarHBondContact O-N 3.32Å; S13-T16 PolarHBondContact O-N 3.49Å; S13-L17 WeakPolarHBondContact O-CB 3.35Å; S13-L17 PolarHBondContact O-N 2.68Å
14W77.1Confident78.4Confident160 Ų160116.2 Ų116.261%0.60657%0.57SS**Hα-helixtrans-59.9-44.8176.1-173.2-98.6000113V10 M11 F12 T16 L17 Q18V10-W14 WeakPolarHBondContact O-CB 3.5Å; V10-W14 PolarHBondContact O-N 3.36Å; M11-W14 PolarHBondContact O-N 3.49Å; F12-W14 VanDerWaalsContact C-N 3.34Å; F12-W14 PolarHBondContact O-N 2.93Å; W14-T16 VanDerWaalsContact C-N 3.29Å; W14-T16 PolarHBondContact O-N 3.34Å; W14-L17 PolarHBondContact O-N 2.98Å; W14-Q18 WeakPolarHBondContact O-CG 3.26Å; W14-Q18 PolarHBondContact O-N 3.11Å
15K75.1Confident79.1Confident160 Ų160117 Ų11770%0.69657%0.568SS**Hα-helixtrans-66-33.6178.7-146.7174.6-171.4179.40112.1M11 F12 S13M11-K15 PolarHBondContact O-N 2.92Å; M11-K15 VanDerWaalsContact O-N 3.12Å; F12-K15 PolarHBondContact O-N 3.48Å; S13-K15 PolarHBondContact O-N 3.32Å
16T76.4Confident79.8Confident73 Ų73112.9 Ų112.945%0.44856%0.558SS.*Hα-helixtrans-72.8-40.8175.6-53.70000111.3F12 S13 W14 R19F12-T16 PolarHBondContact O-N 2.98Å; F12-T16 VanDerWaalsContact O-N 3.08Å; F12-T16 PolarHBondContact O-OG1 2.96Å; S13-T16 PolarHBondContact O-N 3.49Å; W14-T16 VanDerWaalsContact C-N 3.29Å; W14-T16 PolarHBondContact O-N 3.34Å; T16-R19 VanDerWaalsContact O-CB 3.25Å; T16-R19 WeakPolarHBondContact O-CB 3.48Å; T16-R19 PolarHBondContact O-N 3.3Å; T16-R19 VanDerWaalsContact O-N 3.16Å
17L74.7Confident80.5Confident86 Ų86110.9 Ų110.945%0.4555%0.553SS.*Hα-helixtrans-66.4-39178.2-169.864.9000112.4S13 W14 R19 N20 V23S13-L17 WeakPolarHBondContact O-CB 3.35Å; S13-L17 PolarHBondContact O-N 2.68Å; W14-L17 PolarHBondContact O-N 2.98Å; L17-R19 PolarHBondContact O-N 3.36Å; L17-N20 PolarHBondContact O-N 3.36Å; L17-V23 HydrophobicContact CD1-CG2 4.2Å; L17-V23 HydrophobicContact CG-CG1 4.36Å; L17-V23 HydrophobicContact CG-CG2 4.48Å
18Q74.9Confident81.2Confident105 Ų105110.3 Ų110.349%0.49155%0.551SS.*THydrogen-bonded Turntrans-67.8-14.3174-74.5-171.3-36.400114W14 N20W14-Q18 WeakPolarHBondContact O-CG 3.26Å; W14-Q18 PolarHBondContact O-N 3.11Å; Q18-N20 VanDerWaalsContact C-N 3.33Å
19R80.7Confident82Confident217 Ų217113.9 Ų113.982%0.81956%0.56SS**THydrogen-bonded Turntrans-77.5-20.5178.7-150.4171.299.9139.52112.6T16 L17T16-R19 VanDerWaalsContact O-CB 3.25Å; T16-R19 WeakPolarHBondContact O-CB 3.48Å; T16-R19 PolarHBondContact O-N 3.3Å; T16-R19 VanDerWaalsContact O-N 3.16Å; L17-R19 PolarHBondContact O-N 3.36Å
20N83.5Confident82.7Confident90 Ų90112.4 Ų112.448%0.48156%0.556SS.*SBendtrans-75.8125.7178.1-73.8-12.9000111L17 Q18 T22 V23 K24L17-N20 PolarHBondContact O-N 3.36Å; Q18-N20 VanDerWaalsContact C-N 3.33Å; N20-T22 VanDerWaalsContact C-N 3.27Å; N20-T22 PolarHBondContact O-N 3.24Å; N20-V23 HydrophobicContact CB-CB 4.46Å; N20-V23 HydrophobicContact CB-CG2 4.14Å; N20-V23 PolarHBondContact O-N 3.1Å; N20-V23 VanDerWaalsContact O-N 3.1Å; N20-K24 PolarHBondContact O-N 3.38Å
21K83.5Confident83.5Confident166 Ų166113 Ų11372%0.72256%0.555SS**Hα-helixtrans-57.1-40.2-177.5-63.2-179.9-177.4179.50111.9V23 K24 Y25K21-V23 PolarHBondContact O-N 3.23Å; K21-K24 PolarHBondContact O-N 2.88Å; K21-Y25 HydrophobicContact CB-CD2 4.35Å; K21-Y25 HydrophobicContact CB-CE2 4.36Å; K21-Y25 WeakPolarHBondContact O-CD2 3.15Å; K21-Y25 PolarHBondContact O-N 2.93Å
22T87.1Confident84.4Confident115 Ų115113.1 Ų113.171%0.70656%0.557SS**Hα-helixtrans-61.3-40.2176.922.80000113.3N20 G26N20-T22 VanDerWaalsContact C-N 3.27Å; N20-T22 PolarHBondContact O-N 3.24Å; T22-G26 WeakPolarHBondContact O-CA 3.14Å; T22-G26 PolarHBondContact O-N 3.23Å
23V88.4Confident85.5Confident43 Ų43109.9 Ų109.926%0.26155%0.55SS..Hα-helixtrans-73.6-43.4177.3-178.90000110.2L17 N20 K21 Y25 V27L17-V23 HydrophobicContact CD1-CG2 4.2Å; L17-V23 HydrophobicContact CG-CG1 4.36Å; L17-V23 HydrophobicContact CG-CG2 4.48Å; N20-V23 HydrophobicContact CB-CB 4.46Å; N20-V23 HydrophobicContact CB-CG2 4.14Å; N20-V23 PolarHBondContact O-N 3.1Å; N20-V23 VanDerWaalsContact O-N 3.1Å; K21-V23 PolarHBondContact O-N 3.23Å; V23-Y25 VanDerWaalsContact C-N 3.31Å; V23-Y25 PolarHBondContact O-N 3.19Å; V23-V27 HydrophobicContact CG1-CG2 3.72Å; V23-V27 WeakPolarHBondContact O-CB 3.14Å; V23-V27 VanDerWaalsContact O-CG2 3.29Å; V23-V27 WeakPolarHBondContact O-CG2 3.41Å; V23-V27 PolarHBondContact O-N 2.9Å
24K86.3Confident86.4Confident128 Ų128111 Ų11156%0.55755%0.549SS*.Hα-helixtrans-59.2-38.2-179.5-174.1176.9179.9-179.60113.2N20 K21 P28N20-K24 PolarHBondContact O-N 3.38Å; K21-K24 PolarHBondContact O-N 2.88Å; K24-P28 WeakPolarHBondContact O-CD 3.41Å; K24-P28 VanDerWaalsContact O-CG 3.31Å; K24-P28 WeakPolarHBondContact O-CG 3.37Å
25Y90.9Very high87.2Confident155 Ų155105.4 Ų105.461%0.60854%0.541SS*.Hα-helixtrans-100.7-28.3-179.4-60.2-66000113.4K21 V23 M29K21-Y25 HydrophobicContact CB-CD2 4.35Å; K21-Y25 HydrophobicContact CB-CE2 4.36Å; K21-Y25 WeakPolarHBondContact O-CD2 3.15Å; K21-Y25 PolarHBondContact O-N 2.93Å; V23-Y25 VanDerWaalsContact C-N 3.31Å; V23-Y25 PolarHBondContact O-N 3.19Å; Y25-M29 PolarHBondContact O-N 3.23Å
26G91.8Very high87.9Confident33 Ų3399.1 Ų99.134%0.3452%0.522SS..Hα-helixtrans-76.9-37-179.400000113.6T22 M29 L30T22-G26 WeakPolarHBondContact O-CA 3.14Å; T22-G26 PolarHBondContact O-N 3.23Å; G26-M29 PolarHBondContact O-N 3.18Å; G26-L30 WeakPolarHBondContact O-CB 3.42Å; G26-L30 PolarHBondContact O-N 3.3Å
27V91.9Very high88.4Confident72 Ų7299.6 Ų99.644%0.43653%0.529SS..Hα-helixtrans-63.6-47.2178.2172.60000111.7V23 M29 L30 L31V23-V27 HydrophobicContact CG1-CG2 3.72Å; V23-V27 WeakPolarHBondContact O-CB 3.14Å; V23-V27 VanDerWaalsContact O-CG2 3.29Å; V23-V27 WeakPolarHBondContact O-CG2 3.41Å; V23-V27 PolarHBondContact O-N 2.9Å; V27-M29 VanDerWaalsContact C-N 3.31Å; V27-M29 PolarHBondContact O-N 3.24Å; V27-L30 PolarHBondContact O-N 3.38Å; V27-L31 HydrophobicContact CG1-CD1 3.91Å; V27-L31 HydrophobicContact CG1-CG 4.34Å; V27-L31 WeakPolarHBondContact O-CB 3.27Å; V27-L31 VanDerWaalsContact O-CG 3.3Å; V27-L31 WeakPolarHBondContact O-CG 3.47Å; V27-L31 PolarHBondContact O-N 3.43Å
28P93.1Very high89Confident66 Ų66102.4 Ų102.443%0.42954%0.537SS..Hα-helixtrans-59.6-38.2173.5-25.434.9000113.6K24 L32K24-P28 WeakPolarHBondContact O-CD 3.41Å; K24-P28 VanDerWaalsContact O-CG 3.31Å; K24-P28 WeakPolarHBondContact O-CG 3.37Å; P28-L32 WeakPolarHBondContact O-CB 3.28Å; P28-L32 PolarHBondContact O-N 3.35Å
29M93.6Very high89.4Confident132 Ų13299.3 Ų99.365%0.6553%0.533SS*.Hα-helixtrans-65.8-45.6177.3-171.7-165.9-177.200111.6Y25 G26 V27 L32 V33Y25-M29 PolarHBondContact O-N 3.23Å; G26-M29 PolarHBondContact O-N 3.18Å; V27-M29 VanDerWaalsContact C-N 3.31Å; V27-M29 PolarHBondContact O-N 3.24Å; M29-L32 WeakPolarHBondContact O-CB 3.45Å; M29-L32 PolarHBondContact O-N 2.99Å; M29-V33 WeakPolarHBondContact O-CG2 3.22Å; M29-V33 PolarHBondContact O-N 2.94Å
30L93.2Very high89.2Confident105 Ų10594.2 Ų94.255%0.5552%0.522SS..Hα-helixtrans-63.9-42.2178.3-173.373.2000111.3G26 V27 L32 V33 I34G26-L30 WeakPolarHBondContact O-CB 3.42Å; G26-L30 PolarHBondContact O-N 3.3Å; V27-L30 PolarHBondContact O-N 3.38Å; L30-L32 VanDerWaalsContact C-N 3.31Å; L30-L32 PolarHBondContact O-N 2.97Å; L30-V33 PolarHBondContact O-N 3.37Å; L30-I34 HydrophobicContact CD1-CD1 4.17Å; L30-I34 HydrophobicContact CD2-CD1 4.33Å; L30-I34 HydrophobicContact CG-CD1 3.82Å; L30-I34 HydrophobicContact CG-CG1 4.5Å; L30-I34 WeakPolarHBondContact O-CG1 3.36Å; L30-I34 PolarHBondContact O-N 3.24Å
31L94.1Very high88.8Confident113 Ų11396.6 Ų96.659%0.59252%0.524SS*.Hα-helixtrans-61.2-39.1174.5-74.7172.7000111.9V27 G35V27-L31 HydrophobicContact CG1-CD1 3.91Å; V27-L31 HydrophobicContact CG1-CG 4.34Å; V27-L31 WeakPolarHBondContact O-CB 3.27Å; V27-L31 VanDerWaalsContact O-CG 3.3Å; V27-L31 WeakPolarHBondContact O-CG 3.47Å; V27-L31 PolarHBondContact O-N 3.43Å; L31-G35 WeakPolarHBondContact O-CA 3.3Å; L31-G35 PolarHBondContact O-N 3.05Å
32L93Very high88.1Confident133 Ų13394 Ų9470%0.69652%0.515SS*.Hα-helixtrans-66-40.6174.4-95.1166.4000112.5P28 M29 L30 G36P28-L32 WeakPolarHBondContact O-CB 3.28Å; P28-L32 PolarHBondContact O-N 3.35Å; M29-L32 WeakPolarHBondContact O-CB 3.45Å; M29-L32 PolarHBondContact O-N 2.99Å; L30-L32 VanDerWaalsContact C-N 3.31Å; L30-L32 PolarHBondContact O-N 2.97Å; L32-G36 WeakPolarHBondContact O-CA 3.38Å; L32-G36 PolarHBondContact O-N 2.83Å
33V93.1Very high87.1Confident83 Ų8395.6 Ų95.650%0.50351%0.512SS..Hα-helixtrans-66.6-47.9178.9171.70000110.8M29 L30 S37M29-V33 WeakPolarHBondContact O-CG2 3.22Å; M29-V33 PolarHBondContact O-N 2.94Å; L30-V33 PolarHBondContact O-N 3.37Å; V33-S37 WeakPolarHBondContact O-CB 3.24Å; V33-S37 PolarHBondContact O-N 3.33Å; V33-S37 PolarHBondContact O-OG 3.43Å
34I93Very high86Confident95 Ų9597.4 Ų97.449%0.48752%0.523SS..Hα-helixtrans-68.9-47.1179.5-62.8171.1000110.2L30 S37 F38L30-I34 HydrophobicContact CD1-CD1 4.17Å; L30-I34 HydrophobicContact CD2-CD1 4.33Å; L30-I34 HydrophobicContact CG-CD1 3.82Å; L30-I34 HydrophobicContact CG-CG1 4.5Å; L30-I34 WeakPolarHBondContact O-CG1 3.36Å; L30-I34 PolarHBondContact O-N 3.24Å; I34-S37 PolarHBondContact O-N 2.99Å; I34-F38 WeakPolarHBondContact O-CB 3.47Å; I34-F38 PolarHBondContact O-N 3.07Å
35G92.4Very high84.9Confident43 Ų4395.3 Ų95.344%0.44352%0.515SS..Hα-helixtrans-65.4-38.1179.100000113L31 G39L31-G35 WeakPolarHBondContact O-CA 3.3Å; L31-G35 PolarHBondContact O-N 3.05Å; G35-G39 WeakPolarHBondContact O-CA 3.13Å; G35-G39 PolarHBondContact O-N 3.46Å
36G90.1Very high83.6Confident29 Ų2992.8 Ų92.830%0.29951%0.511SS..Hα-helixtrans-66-43.7173.400000112.2L32 F38 G39 L40L32-G36 WeakPolarHBondContact O-CA 3.38Å; L32-G36 PolarHBondContact O-N 2.83Å; G36-F38 PolarHBondContact O-N 3.2Å; G36-G39 PolarHBondContact O-N 3Å; G36-L40 VanDerWaalsContact O-CB 3.32Å; G36-L40 WeakPolarHBondContact O-CB 3.44Å; G36-L40 WeakPolarHBondContact O-CD1 3.29Å; G36-L40 WeakPolarHBondContact O-CG 3.46Å; G36-L40 PolarHBondContact O-N 3.42Å
37S87.1Confident82.3Confident83 Ų8399 Ų9958%0.5852%0.524SS*.Hα-helixtrans-64.6-39.3177.9-57.80000112.3V33 I34V33-S37 WeakPolarHBondContact O-CB 3.24Å; V33-S37 PolarHBondContact O-N 3.33Å; V33-S37 PolarHBondContact O-OG 3.43Å; I34-S37 PolarHBondContact O-N 2.99Å
38F86.9Confident80.6Confident145 Ų145102.8 Ų102.864%0.63653%0.532SS*.Hα-helixtrans-78.2-38.6177.8-132.5-96.6000112.4I34 G36 R41I34-F38 WeakPolarHBondContact O-CB 3.47Å; I34-F38 PolarHBondContact O-N 3.07Å; G36-F38 PolarHBondContact O-N 3.2Å; F38-R41 WeakPolarHBondContact O-CB 3.46Å; F38-R41 PolarHBondContact O-N 3.46Å
39G83.3Confident79Confident39 Ų39103.7 Ų103.740%0.40253%0.533SS..Hα-helixtrans-70.1-41-178.800000113.4G35 G36 R41 F43G35-G39 WeakPolarHBondContact O-CA 3.13Å; G35-G39 PolarHBondContact O-N 3.46Å; G36-G39 PolarHBondContact O-N 3Å; G39-R41 VanDerWaalsContact C-N 3.27Å; G39-R41 PolarHBondContact O-N 3.48Å; G39-F43 WeakPolarHBondContact O-CD2 3.43Å
40L78.1Confident77.4Confident110 Ų11099.7 Ų99.758%0.57652%0.521SS*.Hα-helixtrans-71.3-21.7177.8-72.1163.8000113G36 E42 F43 T44G36-L40 VanDerWaalsContact O-CB 3.32Å; G36-L40 WeakPolarHBondContact O-CB 3.44Å; G36-L40 WeakPolarHBondContact O-CD1 3.29Å; G36-L40 WeakPolarHBondContact O-CG 3.46Å; G36-L40 PolarHBondContact O-N 3.42Å; L40-E42 VanDerWaalsContact C-N 3.3Å; L40-E42 PolarHBondContact O-N 3.08Å; L40-F43 PolarHBondContact O-N 3.27Å; L40-F43 VanDerWaalsContact O-N 3.16Å; L40-T44 WeakPolarHBondContact O-CG2 3.38Å; L40-T44 PolarHBondContact O-N 2.9Å; L40-T44 PolarHBondContact O-OG1 2.93Å
41R73.6Confident75.8Confident141 Ų14199.2 Ų99.253%0.53252%0.516SS..Hα-helixtrans-58-41.2-178.5-173.5177.2178.3177.6-1.3112.3F38 G39 T44 Q45F38-R41 WeakPolarHBondContact O-CB 3.46Å; F38-R41 PolarHBondContact O-N 3.46Å; G39-R41 VanDerWaalsContact C-N 3.27Å; G39-R41 PolarHBondContact O-N 3.48Å; R41-T44 PolarHBondContact O-OG1 3.03Å; R41-Q45 WeakPolarHBondContact O-CG 3.39Å; R41-Q45 PolarHBondContact O-NE2 2.79Å
42E68.5Low74.1Confident112 Ų11299.9 Ų99.952%0.52351%0.514SS..Hα-helixtrans-69.9-41.1176.9-63.7-56.9134.500111.6L40 T44 Q45 I46L40-E42 VanDerWaalsContact C-N 3.3Å; L40-E42 PolarHBondContact O-N 3.08Å; E42-T44 PolarHBondContact O-N 3.36Å; E42-Q45 PolarHBondContact O-N 3.44Å; E42-I46 WeakPolarHBondContact O-CG1 3.44Å
43F67.4Low72.5Confident147 Ų14799.7 Ų99.765%0.64551%0.512SS*.Hα-helixtrans-67.3-32.6179-74.8-78.4000113.7G39 L40 Q45 I46G39-F43 WeakPolarHBondContact O-CD2 3.43Å; L40-F43 PolarHBondContact O-N 3.27Å; L40-F43 VanDerWaalsContact O-N 3.16Å; F43-Q45 VanDerWaalsContact C-N 3.33Å; F43-Q45 PolarHBondContact O-N 3.04Å; F43-I46 HydrophobicContact CD1-CD1 4.26Å
44T64.4Low70.7Confident81 Ų81106.4 Ų106.450%0.49753%0.529SS..Hα-helixtrans-70.8-27.4177.758.60000113.3L40 R41 E42 Y48L40-T44 WeakPolarHBondContact O-CG2 3.38Å; L40-T44 PolarHBondContact O-N 2.9Å; L40-T44 PolarHBondContact O-OG1 2.93Å; R41-T44 PolarHBondContact O-OG1 3.03Å; E42-T44 PolarHBondContact O-N 3.36Å; T44-Y48 WeakPolarHBondContact O-CD2 3.45Å
45Q63.3Low69Low84 Ų84109.8 Ų109.839%0.39354%0.54SS..Hα-helixtrans-73.9-35178.5-68.6174.234.500112R41 E42 F43 R47 Y48 D49R41-Q45 WeakPolarHBondContact O-CG 3.39Å; R41-Q45 PolarHBondContact O-NE2 2.79Å; E42-Q45 PolarHBondContact O-N 3.44Å; F43-Q45 VanDerWaalsContact C-N 3.33Å; F43-Q45 PolarHBondContact O-N 3.04Å; Q45-R47 PolarHBondContact O-N 2.81Å; Q45-R47 VanDerWaalsContact O-N 3.13Å; Q45-Y48 PolarHBondContact O-N 2.96Å; Q45-Y48 VanDerWaalsContact O-N 3.07Å; Q45-D49 PolarHBondContact O-N 3.44Å
46I64.2Low67.3Low103 Ų103116.6 Ų116.653%0.52855%0.552SS.*Hα-helixtrans-56-35.2179.7-63170.9000111.8E42 F43 A50E42-I46 WeakPolarHBondContact O-CG1 3.44Å; F43-I46 HydrophobicContact CD1-CD1 4.26Å; I46-A50 WeakPolarHBondContact O-CB 3.46Å; I46-A50 PolarHBondContact O-N 3.06Å
47R63.2Low65.7Low162 Ų162119.7 Ų119.761%0.61156%0.561SS**Hα-helixtrans-70.1-36.2-178.5-154.3-179.274119.32.3112.5Q45 Q51Q45-R47 PolarHBondContact O-N 2.81Å; Q45-R47 VanDerWaalsContact O-N 3.13Å; R47-Q51 PolarHBondContact O-N 3.36Å
48Y57.8Low64.5Low152 Ų152120.6 Ų120.660%0.59656%0.56SS**Hα-helixtrans-76.1-39.9177.7-73-73.6000111.5T44 Q45 Q51 K52T44-Y48 WeakPolarHBondContact O-CD2 3.45Å; Q45-Y48 PolarHBondContact O-N 2.96Å; Q45-Y48 VanDerWaalsContact O-N 3.07Å; Y48-Q51 PolarHBondContact O-N 2.97Å; Y48-K52 VanDerWaalsContact O-CB 3.29Å; Y48-K52 WeakPolarHBondContact O-CB 3.38Å; Y48-K52 PolarHBondContact O-N 3.28Å
49D59.8Low63.3Low85 Ų85118.3 Ų118.346%0.45556%0.56SS.*Hα-helixtrans-68.4-39.7176.8-75.2-25000112.1Q45 Q51 K52 I53Q45-D49 PolarHBondContact O-N 3.44Å; D49-Q51 PolarHBondContact O-N 3.18Å; D49-K52 PolarHBondContact O-N 2.96Å; D49-I53 VanDerWaalsContact O-CG1 3.27Å; D49-I53 WeakPolarHBondContact O-CG1 3.48Å; D49-I53 PolarHBondContact O-N 3.16Å
50A59.9Low62.3Low48 Ų48119.7 Ų119.740%0.39756%0.563SS.*Hα-helixtrans-63.7-39173.600000112.5I46 R54I46-A50 WeakPolarHBondContact O-CB 3.46Å; I46-A50 PolarHBondContact O-N 3.06Å; A50-R54 WeakPolarHBondContact O-CG 3.48Å; A50-R54 PolarHBondContact O-N 3.42Å
51Q59Low61.5Low95 Ų95118.4 Ų118.444%0.44456%0.556SS.*Hα-helixtrans-69.9-35.5173.3-81.2-170.5-62.900112.6R47 Y48 D49 I53 R54 K55R47-Q51 PolarHBondContact O-N 3.36Å; Y48-Q51 PolarHBondContact O-N 2.97Å; D49-Q51 PolarHBondContact O-N 3.18Å; Q51-I53 VanDerWaalsContact C-N 3.35Å; Q51-R54 PolarHBondContact O-N 3.48Å; Q51-K55 WeakPolarHBondContact O-CB 3.4Å; Q51-K55 WeakPolarHBondContact O-CG 3.46Å; Q51-K55 PolarHBondContact O-N 3.14Å
52K58.3Low60.9Low128 Ų128116.8 Ų116.856%0.55756%0.555SS**Hα-helixtrans-66.8-36.5176.6-171.3174.6178.9-176.50111.7Y48 D49 R56Y48-K52 VanDerWaalsContact O-CB 3.29Å; Y48-K52 WeakPolarHBondContact O-CB 3.38Å; Y48-K52 PolarHBondContact O-N 3.28Å; D49-K52 PolarHBondContact O-N 2.96Å; K52-R56 VanDerWaalsContact O-CG 3.23Å; K52-R56 WeakPolarHBondContact O-CG 3.29Å; K52-R56 PolarHBondContact O-N 3.14Å
53I58.2Low60.5Low128 Ų128115.1 Ų115.166%0.65656%0.56SS**Hα-helixtrans-68.3-41.2172.3-66.6164.2000111D49 Q51 K55 R56D49-I53 VanDerWaalsContact O-CG1 3.27Å; D49-I53 WeakPolarHBondContact O-CG1 3.48Å; D49-I53 PolarHBondContact O-N 3.16Å; Q51-I53 VanDerWaalsContact C-N 3.35Å; I53-K55 VanDerWaalsContact C-N 3.34Å; I53-K55 PolarHBondContact O-N 3.4Å; I53-R56 PolarHBondContact O-N 3.25Å
54R56.6Low60.3Low224 Ų224116.4 Ų116.485%0.84557%0.565SS**Hα-helixtrans-71.3-24.1176.2-68.8-173.9100.8-173.36.7114.4A50 Q51A50-R54 WeakPolarHBondContact O-CG 3.48Å; A50-R54 PolarHBondContact O-N 3.42Å; Q51-R54 PolarHBondContact O-N 3.48Å
55K56.8Low60.2Low166 Ų166116.6 Ų116.672%0.72257%0.566SS**Hα-helixtrans-85-17.7175.5-78.7-172.8177.6-171.30113.8Q51 I53 L57Q51-K55 WeakPolarHBondContact O-CB 3.4Å; Q51-K55 WeakPolarHBondContact O-CG 3.46Å; Q51-K55 PolarHBondContact O-N 3.14Å; I53-K55 VanDerWaalsContact C-N 3.34Å; I53-K55 PolarHBondContact O-N 3.4Å; K55-L57 PolarHBondContact O-N 3.15Å
56R57.5Low60.4Low186 Ų186115.9 Ų115.970%0.70257%0.565SS**SBendtrans-71.291.8165.1-68.2-99.9-179.4134.8-3105.5K52 I53 D58K52-R56 VanDerWaalsContact O-CG 3.23Å; K52-R56 WeakPolarHBondContact O-CG 3.29Å; K52-R56 PolarHBondContact O-N 3.14Å; I53-R56 PolarHBondContact O-N 3.25Å; R56-D58 PolarHBondContact O-N 3.14Å
57L55.5Low60.5Low94 Ų94114.3 Ų114.349%0.49257%0.568SS.*  trans-48.9138168.3-85.7138.1000107.8K55 L61 E62K55-L57 PolarHBondContact O-N 3.15Å; L57-L61 HydrophobicContact CD2-CB 3.96Å; L57-L61 HydrophobicContact CD2-CD1 4.48Å; L57-E62 HydrophobicContact CB-CG 3.53Å; L57-E62 HydrophobicContact CD1-CG 4.23Å; L57-E62 HydrophobicContact CG-CG 4.43Å
58D62.1Low60.6Low103 Ų103114 Ų11455%0.55157%0.573SS**  trans-51.5128172.1-145.2-36.8000107.4R56 S60 L61 E62R56-D58 PolarHBondContact O-N 3.14Å; D58-S60 PolarHBondContact O-N 3.26Å; D58-L61 HydrophobicContact CB-CD1 3.97Å; D58-L61 HydrophobicContact CB-CG 4.46Å; D58-L61 WeakPolarHBondContact O-CA 3.23Å; D58-L61 WeakPolarHBondContact O-CB 3.27Å; D58-L61 PolarHBondContact O-N 3.33Å; D58-E62 PolarHBondContact O-N 2.91Å
59P62.5Low61.1Low97 Ų97113.3 Ų113.363%0.6357%0.573SS**Hα-helixtrans-55.6-20.2-175.815.7-30000113.4A63P59-A63 WeakPolarHBondContact O-CB 3.42Å; P59-A63 PolarHBondContact O-N 3.28Å
60S61.9Low61.6Low68 Ų68114.3 Ų114.348%0.47658%0.575SS.*Hα-helixtrans-69.4-27.6170.965.10000114.8D58 K64D58-S60 PolarHBondContact O-N 3.26Å; S60-K64 WeakPolarHBondContact O-CG 3.18Å
61L60.5Low62.1Low83 Ų83114.2 Ų114.244%0.43558%0.575SS.*Hα-helixtrans-86.8-38.2176.6-77160.2000111.7L57 D58 A63 K64 V65L57-L61 HydrophobicContact CD2-CB 3.96Å; L57-L61 HydrophobicContact CD2-CD1 4.48Å; D58-L61 HydrophobicContact CB-CD1 3.97Å; D58-L61 HydrophobicContact CB-CG 4.46Å; D58-L61 WeakPolarHBondContact O-CA 3.23Å; D58-L61 WeakPolarHBondContact O-CB 3.27Å; D58-L61 PolarHBondContact O-N 3.33Å; L61-A63 VanDerWaalsContact C-N 3.31Å; L61-A63 PolarHBondContact O-N 3.01Å; L61-K64 WeakPolarHBondContact O-CB 3.41Å; L61-K64 PolarHBondContact O-N 3.12Å; L61-K64 VanDerWaalsContact O-N 3.12Å; L61-V65 WeakPolarHBondContact O-CG2 3.36Å; L61-V65 PolarHBondContact O-N 3.47Å
62E61.4Low62.9Low107 Ų107114 Ų11450%0.558%0.58SS.*Hα-helixtrans-62.3-39.4172.2-72.3-177.817100111.4L57 D58 K64 V65L57-E62 HydrophobicContact CB-CG 3.53Å; L57-E62 HydrophobicContact CD1-CG 4.23Å; L57-E62 HydrophobicContact CG-CG 4.43Å; D58-E62 PolarHBondContact O-N 2.91Å; E62-K64 PolarHBondContact O-N 3.47Å; E62-V65 CarbonylContact O-C 3.34Å; E62-V65 PolarHBondContact O-N 2.97Å; E62-V65 VanDerWaalsContact O-N 3.14Å
63A61.1Low63.9Low77 Ų77112.2 Ų112.264%0.63658%0.575SS**THydrogen-bonded Turntrans-63.4-25.8174.500000113.5P59 L61P59-A63 WeakPolarHBondContact O-CB 3.42Å; P59-A63 PolarHBondContact O-N 3.28Å; L61-A63 VanDerWaalsContact C-N 3.31Å; L61-A63 PolarHBondContact O-N 3.01Å
64K62.7Low65.3Low173 Ų173111.8 Ų111.875%0.75257%0.573SS**THydrogen-bonded Turntrans-82.1-31.8174.2-73.6177.6179.8-177.30112.3S60 L61 E62 N66S60-K64 WeakPolarHBondContact O-CG 3.18Å; L61-K64 WeakPolarHBondContact O-CB 3.41Å; L61-K64 PolarHBondContact O-N 3.12Å; L61-K64 VanDerWaalsContact O-N 3.12Å; E62-K64 PolarHBondContact O-N 3.47Å; K64-N66 VanDerWaalsContact C-N 3.31Å; K64-N66 PolarHBondContact O-N 3.2Å
65V62.3Low66.5Low85 Ų85107.7 Ų107.752%0.51556%0.564SS.*  trans-93.966.2178-173.50000108.9L61 E62 A67L61-V65 WeakPolarHBondContact O-CG2 3.36Å; L61-V65 PolarHBondContact O-N 3.47Å; E62-V65 CarbonylContact O-C 3.34Å; E62-V65 PolarHBondContact O-N 2.97Å; E62-V65 VanDerWaalsContact O-N 3.14Å; V65-A67 PolarHBondContact O-N 3.41Å; V65-A67 VanDerWaalsContact O-N 3.14Å
66N67.5Low68Low69 Ų69104.6 Ų104.637%0.36955%0.552SS.*  trans-76.2102.3172.4-156.1-45.6000107.8K64 E68 K69 Q70K64-N66 VanDerWaalsContact C-N 3.31Å; K64-N66 PolarHBondContact O-N 3.2Å; N66-E68 PolarHBondContact O-N 3.05Å; N66-E68 VanDerWaalsContact O-N 3.14Å; N66-K69 HydrophobicContact CB-CB 4.28Å; N66-K69 HydrophobicContact CB-CD 4Å; N66-K69 HydrophobicContact CB-CG 4Å; N66-K69 WeakPolarHBondContact O-CB 3.47Å; N66-K69 PolarHBondContact O-N 3.2Å; N66-Q70 PolarHBondContact O-N 3.22Å; N66-Q70 VanDerWaalsContact O-N 3.15Å
67A66.3Low69.3Low70 Ų70100 Ų10058%0.57954%0.539SS*.Hα-helixtrans-56-32.1-171.400000113.3V65 Q70 A71V65-A67 PolarHBondContact O-N 3.41Å; V65-A67 VanDerWaalsContact O-N 3.14Å; A67-Q70 PolarHBondContact O-N 2.96Å; A67-A71 PolarHBondContact O-N 3.37Å
68E64.9Low70.8Confident155 Ų155102.3 Ų102.372%0.72454%0.542SS*.Hα-helixtrans-65.1-42.5175.2-63.1-178.7174.800111.9N66 Q70 A71 V72N66-E68 PolarHBondContact O-N 3.05Å; N66-E68 VanDerWaalsContact O-N 3.14Å; E68-Q70 VanDerWaalsContact C-N 3.26Å; E68-Q70 PolarHBondContact O-N 3.07Å; E68-A71 PolarHBondContact O-N 2.91Å; E68-V72 WeakPolarHBondContact O-CG2 3.33Å; E68-V72 PolarHBondContact O-N 3.17Å
69K68.5Low72Confident138 Ų138101.4 Ų101.460%0.653%0.534SS*.Hα-helixtrans-64.5-35.4175.2-64.1-173.4-179.5-178.40111.3N66 V72 I73N66-K69 HydrophobicContact CB-CB 4.28Å; N66-K69 HydrophobicContact CB-CD 4Å; N66-K69 HydrophobicContact CB-CG 4Å; N66-K69 WeakPolarHBondContact O-CB 3.47Å; N66-K69 PolarHBondContact O-N 3.2Å; K69-V72 PolarHBondContact O-N 3.42Å; K69-I73 WeakPolarHBondContact O-CB 3.45Å; K69-I73 VanDerWaalsContact O-CD1 3.29Å; K69-I73 WeakPolarHBondContact O-CD1 3.46Å; K69-I73 WeakPolarHBondContact O-CG1 3.38Å; K69-I73 PolarHBondContact O-N 3.42Å
70Q71.1Confident73.2Confident106 Ų106100.9 Ų100.950%0.49552%0.522SS..Hα-helixtrans-69.7-37.1-179.8-157.1165.311.800112N66 A67 E68 I73 L74N66-Q70 PolarHBondContact O-N 3.22Å; N66-Q70 VanDerWaalsContact O-N 3.15Å; A67-Q70 PolarHBondContact O-N 2.96Å; E68-Q70 VanDerWaalsContact C-N 3.26Å; E68-Q70 PolarHBondContact O-N 3.07Å; Q70-I73 PolarHBondContact O-N 2.86Å; Q70-L74 WeakPolarHBondContact O-CB 3.06Å; Q70-L74 VanDerWaalsContact O-CG 3.22Å; Q70-L74 WeakPolarHBondContact O-CG 3.47Å; Q70-L74 PolarHBondContact O-N 3.46Å
71A69.8Low74.2Confident47 Ų47102.8 Ų102.839%0.38853%0.526SS..Hα-helixtrans-63.2-46.6173.100000111.9A67 E68 I73 L74 E75A67-A71 PolarHBondContact O-N 3.37Å; E68-A71 PolarHBondContact O-N 2.91Å; A71-I73 VanDerWaalsContact C-N 3.33Å; A71-I73 PolarHBondContact O-N 2.9Å; A71-L74 PolarHBondContact O-N 2.74Å; A71-L74 VanDerWaalsContact O-N 3.16Å; A71-E75 PolarHBondContact O-N 2.92Å
72V74.5Confident75.3Confident91 Ų91104.8 Ų104.855%0.55253%0.531SS*.Hα-helixtrans-60.6-42176.3174.80000111.5E68 K69 E75 E76E68-V72 WeakPolarHBondContact O-CG2 3.33Å; E68-V72 PolarHBondContact O-N 3.17Å; K69-V72 PolarHBondContact O-N 3.42Å; V72-E75 PolarHBondContact O-N 3.07Å; V72-E76 WeakPolarHBondContact O-CB 3.37Å; V72-E76 PolarHBondContact O-N 3.23Å
73I81.1Confident76.2Confident90 Ų90106.8 Ų106.846%0.46254%0.541SS..Hα-helixtrans-63.8-40.8176-68.4161.6000111.1K69 Q70 A71 E76 E77K69-I73 WeakPolarHBondContact O-CB 3.45Å; K69-I73 VanDerWaalsContact O-CD1 3.29Å; K69-I73 WeakPolarHBondContact O-CD1 3.46Å; K69-I73 WeakPolarHBondContact O-CG1 3.38Å; K69-I73 PolarHBondContact O-N 3.42Å; Q70-I73 PolarHBondContact O-N 2.86Å; A71-I73 VanDerWaalsContact C-N 3.33Å; A71-I73 PolarHBondContact O-N 2.9Å; I73-E76 PolarHBondContact O-N 2.97Å; I73-E77 HydrophobicContact CG2-CG 4.25Å; I73-E77 WeakPolarHBondContact O-CB 3.34Å; I73-E77 VanDerWaalsContact O-CG 3.3Å; I73-E77 WeakPolarHBondContact O-CG 3.32Å; I73-E77 PolarHBondContact O-N 2.72Å
74L85.7Confident77.2Confident118 Ų118107.1 Ų107.162%0.61853%0.531SS*.Hα-helixtrans-65-40.3179.4-75.5166.9000112.3Q70 A71 Y78Q70-L74 WeakPolarHBondContact O-CB 3.06Å; Q70-L74 VanDerWaalsContact O-CG 3.22Å; Q70-L74 WeakPolarHBondContact O-CG 3.47Å; Q70-L74 PolarHBondContact O-N 3.46Å; A71-L74 PolarHBondContact O-N 2.74Å; A71-L74 VanDerWaalsContact O-N 3.16Å; L74-Y78 VanDerWaalsContact O-CB 3.28Å; L74-Y78 WeakPolarHBondContact O-CB 3.36Å; L74-Y78 PolarHBondContact O-N 3.33Å
75E82.9Confident77.8Confident138 Ų138105.8 Ų105.865%0.64553%0.527SS*.Hα-helixtrans-65.6-42.1174.8-71176.6-177.100111.7A71 V72 Y78 E79A71-E75 PolarHBondContact O-N 2.92Å; V72-E75 PolarHBondContact O-N 3.07Å; E75-Y78 WeakPolarHBondContact O-CB 3.49Å; E75-Y78 PolarHBondContact O-N 3.49Å; E75-E79 PolarHBondContact O-N 3.34Å
76E87.3Confident78.4Confident102 Ų102107.6 Ų107.648%0.47753%0.533SS..Hα-helixtrans-63.1-45.9176.6-166.3-165.8141.400111.8V72 I73 Y78 E79 K80V72-E76 WeakPolarHBondContact O-CB 3.37Å; V72-E76 PolarHBondContact O-N 3.23Å; I73-E76 PolarHBondContact O-N 2.97Å; E76-Y78 VanDerWaalsContact C-N 3.29Å; E76-Y78 PolarHBondContact O-N 3.5Å; E76-E79 PolarHBondContact O-N 3.47Å; E76-K80 WeakPolarHBondContact O-CG 3.44Å; E76-K80 PolarHBondContact O-N 3.16Å; E76-K80 VanDerWaalsContact O-N 3.08Å; E76-K80 VanDerWaalsContact OE1-CE 3.24Å; E76-K80 WeakPolarHBondContact OE1-CE 3.41Å; E76-K80 IonicContact OE1-NZ 2.83Å; E76-K80 PolarHBondContact OE1-NZ 3.41Å
77E86.5Confident78.9Confident90 Ų90112 Ų11242%0.42156%0.557SS.*Hα-helixtrans-65-34.5175.5-70.1-61.3126.300111.8I73 K80 L81I73-E77 HydrophobicContact CG2-CG 4.25Å; I73-E77 WeakPolarHBondContact O-CB 3.34Å; I73-E77 VanDerWaalsContact O-CG 3.3Å; I73-E77 WeakPolarHBondContact O-CG 3.32Å; I73-E77 PolarHBondContact O-N 2.72Å; E77-K80 PolarHBondContact O-N 3.02Å; E77-K80 IonicContact OE1-NZ 2.79Å; E77-K80 PolarHBondContact OE1-NZ 3.24Å; E77-L81 VanDerWaalsContact O-CG 3.27Å; E77-L81 WeakPolarHBondContact O-CG 3.33Å; E77-L81 PolarHBondContact O-N 3.43Å
78Y86.6Confident79.5Confident142 Ų142116.4 Ų116.456%0.55757%0.565SS**Hα-helixtrans-64.7-47.3175.2173.9-97000112.4L74 E75 E76 K80 L81 K82L74-Y78 VanDerWaalsContact O-CB 3.28Å; L74-Y78 WeakPolarHBondContact O-CB 3.36Å; L74-Y78 PolarHBondContact O-N 3.33Å; E75-Y78 WeakPolarHBondContact O-CB 3.49Å; E75-Y78 PolarHBondContact O-N 3.49Å; E76-Y78 VanDerWaalsContact C-N 3.29Å; E76-Y78 PolarHBondContact O-N 3.5Å; Y78-K80 VanDerWaalsContact C-N 3.33Å; Y78-K80 PolarHBondContact O-N 2.99Å; Y78-L81 PolarHBondContact O-N 3.31Å; Y78-K82 HydrophobicContact CE1-CD 4.08Å; Y78-K82 WeakPolarHBondContact O-CB 3.5Å; Y78-K82 PolarHBondContact O-N 3.13Å
79E87.9Confident80.1Confident83 Ų83118.4 Ų118.439%0.38857%0.566SS.*Hα-helixtrans-64.2-38.4177.3-71.2-64149.400111.2E75 E76 L81 K82 E83E75-E79 PolarHBondContact O-N 3.34Å; E76-E79 PolarHBondContact O-N 3.47Å; E79-L81 PolarHBondContact O-N 3.5Å; E79-K82 PolarHBondContact O-N 3.47Å; E79-K82 IonicContact OE1-NZ 2.81Å; E79-K82 PolarHBondContact OE1-NZ 3.4Å; E79-K82 IonicContact OE2-NZ 3.05Å; E79-K82 PolarHBondContact OE2-NZ 2.76Å; E79-E83 WeakPolarHBondContact O-CG 3.21Å; E79-E83 PolarHBondContact O-N 3.26Å
80K86.3Confident80.5Confident87 Ų87117.4 Ų117.438%0.37856%0.562SS.*Hα-helixtrans-56.9-47.3171.2-71.7173-166.61610112E76 E77 Y78 K82 E83 I84E76-K80 WeakPolarHBondContact O-CG 3.44Å; E76-K80 PolarHBondContact O-N 3.16Å; E76-K80 VanDerWaalsContact O-N 3.08Å; E76-K80 VanDerWaalsContact OE1-CE 3.24Å; E76-K80 WeakPolarHBondContact OE1-CE 3.41Å; E76-K80 IonicContact OE1-NZ 2.83Å; E76-K80 PolarHBondContact OE1-NZ 3.41Å; E77-K80 PolarHBondContact O-N 3.02Å; E77-K80 IonicContact OE1-NZ 2.79Å; E77-K80 PolarHBondContact OE1-NZ 3.24Å; Y78-K80 VanDerWaalsContact C-N 3.33Å; Y78-K80 PolarHBondContact O-N 2.99Å; K80-K82 VanDerWaalsContact C-N 3.3Å; K80-K82 PolarHBondContact O-N 3.38Å; K80-E83 PolarHBondContact O-N 3.46Å; K80-I84 WeakPolarHBondContact O-CG1 3.19Å; K80-I84 PolarHBondContact O-N 3.1Å
81L83.3Confident81Confident107 Ų107119.4 Ų119.456%0.5658%0.576SS**Hα-helixtrans-66.3-32.5-179.5-72.6174.2000112.9E77 Y78 E79 I84E77-L81 VanDerWaalsContact O-CG 3.27Å; E77-L81 WeakPolarHBondContact O-CG 3.33Å; E77-L81 PolarHBondContact O-N 3.43Å; Y78-L81 PolarHBondContact O-N 3.31Å; E79-L81 PolarHBondContact O-N 3.5Å; L81-I84 HydrophobicContact CD2-CD1 3.98Å; L81-I84 PolarHBondContact O-N 2.96Å
82K83.3Confident81.4Confident125 Ų125122.1 Ų122.154%0.54358%0.583SS.*Hα-helixtrans-72.2-30.3177.6-179.5-176.8162.9-153.30112.7Y78 E79 K80 I84Y78-K82 HydrophobicContact CE1-CD 4.08Å; Y78-K82 WeakPolarHBondContact O-CB 3.5Å; Y78-K82 PolarHBondContact O-N 3.13Å; E79-K82 PolarHBondContact O-N 3.47Å; E79-K82 IonicContact OE1-NZ 2.81Å; E79-K82 PolarHBondContact OE1-NZ 3.4Å; E79-K82 IonicContact OE2-NZ 3.05Å; E79-K82 PolarHBondContact OE2-NZ 2.76Å; K80-K82 VanDerWaalsContact C-N 3.3Å; K80-K82 PolarHBondContact O-N 3.38Å; K82-I84 VanDerWaalsContact C-N 3.3Å
83E81.6Confident81.8Confident149 Ų149123.4 Ų123.470%0.69658%0.578SS**Hα-helixtrans-75.7-16.7173-71.2179.7177.300113.2E79 K80 H85E79-E83 WeakPolarHBondContact O-CG 3.21Å; E79-E83 PolarHBondContact O-N 3.26Å; K80-E83 PolarHBondContact O-N 3.46Å; E83-H85 PolarHBondContact O-N 2.79Å
84I81.2Confident81.9Confident84 Ų84121.7 Ų121.743%0.43158%0.582SS.*SBendtrans-74.2121.2177.3-65.6168000109.9K80 L81 K82 L86K80-I84 WeakPolarHBondContact O-CG1 3.19Å; K80-I84 PolarHBondContact O-N 3.1Å; L81-I84 HydrophobicContact CD2-CD1 3.98Å; L81-I84 PolarHBondContact O-N 2.96Å; K82-I84 VanDerWaalsContact C-N 3.3Å; I84-L86 HydrophobicContact CG2-CD2 4.42Å; I84-L86 PolarHBondContact O-N 3.05Å
85H74.9Confident82Confident145 Ų145118.7 Ų118.767%0.67157%0.57SS**  trans-6991.3170.5-69.4-70.9000110.9E83 D87 E88E83-H85 PolarHBondContact O-N 2.79Å; H85-D87 PolarHBondContact O-N 2.88Å; H85-E88 PolarHBondContact O-N 2.94Å
86L74.9Confident82.3Confident124 Ų124117.6 Ų117.665%0.64956%0.56SS**G310 helixtrans-63.6-21.7179.4-66.9168.4000113.3I84 E88 W89I84-L86 HydrophobicContact CG2-CD2 4.42Å; I84-L86 PolarHBondContact O-N 3.05Å; L86-E88 VanDerWaalsContact C-N 3.26Å; L86-E88 PolarHBondContact O-N 3.45Å; L86-W89 VanDerWaalsContact O-CB 3.26Å; L86-W89 WeakPolarHBondContact O-CB 3.31Å; L86-W89 PolarHBondContact O-N 3.28Å
87D78.4Confident82.5Confident162 Ų162119 Ų11987%0.86658%0.578SS**G310 helixtrans-68.9-23-178.4-60.4-37.5000113.1H85H85-D87 PolarHBondContact O-N 2.88Å
88E77.9Confident82.5Confident161 Ų161124.2 Ų124.275%0.75259%0.594SS**G310 helixtrans-95.77.1177.6-66.3-176.7-17200113.1H85 L86 K90H85-E88 PolarHBondContact O-N 2.94Å; L86-E88 VanDerWaalsContact C-N 3.26Å; L86-E88 PolarHBondContact O-N 3.45Å; E88-K90 PolarHBondContact O-N 2.94Å; E88-K90 VanDerWaalsContact O-N 3.1Å
89W79.4Confident82.5Confident197 Ų197119.6 Ų119.675%0.74658%0.577SS**  trans-62.2115.6-176.7-177.8-92.1000111.9L86L86-W89 VanDerWaalsContact O-CB 3.26Å; L86-W89 WeakPolarHBondContact O-CB 3.31Å; L86-W89 PolarHBondContact O-N 3.28Å
90K76.3Confident82.4Confident117 Ų117120 Ų12051%0.50958%0.582SS.*  trans-102.3126.5174.2-73.3-177.9-179.1177.20110.7E88 I92 L112E88-K90 PolarHBondContact O-N 2.94Å; E88-K90 VanDerWaalsContact O-N 3.1Å; K90-I92 PolarHBondContact O-N 3.33Å; K90-L112 HydrophobicContact CD-CD1 4.14Å
91N80.4Confident82.4Confident149 Ų149118.5 Ų118.580%0.79758%0.583SS**  trans-75107.2173.5-173.6-11.5000110.3
92I78.7Confident82.5Confident104 Ų104122.6 Ų122.653%0.53359%0.591SS.*PPolyproline II helixtrans-98120.8175.7-56.2174.5000108.6K90 Q108K90-I92 PolarHBondContact O-N 3.33Å; I92-Q108 HydrophobicContact CG2-CG 4.17Å
93R82.2Confident82.5Confident118 Ų118122.3 Ų122.345%0.44559%0.591SS.*PPolyproline II helixtrans-67.9140.3171.325.1164.3-65.8-142.58110.4E99 Y104R93-E99 VanDerWaalsContact NH2-CD 3.29Å; R93-E99 IonicContact NH2-OE1 2.93Å; R93-E99 PolarHBondContact NH2-OE1 2.77Å; R93-E99 IonicContact NH2-OE2 2.9Å; R93-E99 PolarHBondContact NH2-OE2 2.95Å; R93-Y104 WeakPolarHBondContact CB-OH 3.32Å; R93-Y104 WeakPolarHBondContact CD-OH 3.25Å; R93-Y104 WeakPolarHBondContact CG-OH 3.3Å; R93-Y104 VanDerWaalsContact CZ-CE2 3.45Å; R93-Y104 PolarHBondContact NE-OH 3.08Å; R93-Y104 VanDerWaalsContact NH2-CE2 3.27Å; R93-Y104 WeakPolarHBondContact O-CE1 3.29Å; R93-Y104 PolarHBondContact O-OH 3.22Å
94G85Confident82.6Confident53 Ų53115.9 Ų115.955%0.54656%0.561SS.*PPolyproline II helixtrans-69.2162.6166.500000112.6
95P87.9Confident82.6Confident55 Ų55116.7 Ų116.736%0.35756%0.563SS.*PPolyproline II helixtrans-66.3139.7173.527.9-32.3000110E99 Y104P95-E99 HydrophobicContact CB-CB 4.38Å; P95-Y104 HydrophobicContact CB-CD1 3.84Å; P95-Y104 HydrophobicContact CB-CE1 4.39Å; P95-Y104 HydrophobicContact CB-CG 4.21Å; P95-Y104 HydrophobicContact CG-CD1 4.47Å
96R88Confident83.1Confident116 Ų116116 Ų11644%0.43856%0.56SS.*PPolyproline II helixtrans-68.1157.2170.6-59.1-172.6179108.8-9.4109.9W98 E99R96-W98 HydrophobicContact CB-CD2 3.9Å; R96-W98 HydrophobicContact CB-CE3 4.18Å; R96-W98 HydrophobicContact CB-CG 4.47Å; R96-W98 HydrophobicContact CB-CH2 4.25Å; R96-W98 HydrophobicContact CB-CZ2 3.99Å; R96-W98 HydrophobicContact CB-CZ3 4.33Å; R96-W98 HydrophobicContact CG-CZ2 4.19Å; R96-W98 PolarHBondContact O-N 2.98Å; R96-E99 HydrophobicContact CB-CB 4.34Å; R96-E99 HydrophobicContact CB-CG 3.89Å; R96-E99 HydrophobicContact CG-CG 4.37Å; R96-E99 WeakPolarHBondContact CG-OE2 3.41Å; R96-E99 IonicContact CZ-OE1 3.64Å; R96-E99 PolarHBondContact N-OE2 3.37Å; R96-E99 IonicContact NE-OE1 3.93Å; R96-E99 IonicContact NH1-OE1 2.68Å; R96-E99 PolarHBondContact NH1-OE1 3.05Å; R96-E99 PolarHBondContact O-N 3.31Å
97P90.9Very high83.5Confident131 Ų131115.1 Ų115.185%0.85155%0.553SS**THydrogen-bonded Turntrans-56.2-20.2-179.6-26.934.8000115
98W87.9Confident83.7Confident200 Ų200110 Ų11076%0.75852%0.523SS*.THydrogen-bonded Turntrans-106.73.7178.260.685.4000114R96R96-W98 HydrophobicContact CB-CD2 3.9Å; R96-W98 HydrophobicContact CB-CE3 4.18Å; R96-W98 HydrophobicContact CB-CG 4.47Å; R96-W98 HydrophobicContact CB-CH2 4.25Å; R96-W98 HydrophobicContact CB-CZ2 3.99Å; R96-W98 HydrophobicContact CB-CZ3 4.33Å; R96-W98 HydrophobicContact CG-CZ2 4.19Å; R96-W98 PolarHBondContact O-N 2.98Å
99E85.8Confident83.9Confident45 Ų45111.1 Ų111.121%0.2152%0.521CS..SBendtrans-95.6133.1174-71.6171.8175.700109R93 P95 R96 S101R93-E99 VanDerWaalsContact NH2-CD 3.29Å; R93-E99 IonicContact NH2-OE1 2.93Å; R93-E99 PolarHBondContact NH2-OE1 2.77Å; R93-E99 IonicContact NH2-OE2 2.9Å; R93-E99 PolarHBondContact NH2-OE2 2.95Å; P95-E99 HydrophobicContact CB-CB 4.38Å; R96-E99 HydrophobicContact CB-CB 4.34Å; R96-E99 HydrophobicContact CB-CG 3.89Å; R96-E99 HydrophobicContact CG-CG 4.37Å; R96-E99 WeakPolarHBondContact CG-OE2 3.41Å; R96-E99 IonicContact CZ-OE1 3.64Å; R96-E99 PolarHBondContact N-OE2 3.37Å; R96-E99 IonicContact NE-OE1 3.93Å; R96-E99 IonicContact NH1-OE1 2.68Å; R96-E99 PolarHBondContact NH1-OE1 3.05Å; R96-E99 PolarHBondContact O-N 3.31Å; E99-S101 PolarHBondContact O-N 2.99Å
100D86.8Confident84.2Confident91 Ų91103.8 Ų103.849%0.48750%0.499SS..  trans-64.4123.5173.2-169.1-32.8000109.3R102 E103 Y104D100-R102 PolarHBondContact O-N 3.36Å; D100-R102 PolarHBondContact OD1-N 3.26Å; D100-E103 HydrophobicContact CB-CB 4.45Å; D100-E103 HydrophobicContact CB-CG 4.38Å; D100-Y104 WeakPolarHBondContact O-CB 3.33Å; D100-Y104 PolarHBondContact O-N 2.98Å; D100-Y104 VanDerWaalsContact O-N 3.11Å
101S86.1Confident84.3Confident56 Ų56102 Ų10239%0.39250%0.495SS..Hα-helixtrans-62.6-30.4-177.3-64.50000112.9E99 Q105E99-S101 PolarHBondContact O-N 2.99Å; S101-Q105 WeakPolarHBondContact O-CB 3.43Å; S101-Q105 WeakPolarHBondContact O-CG 3.36Å; S101-Q105 PolarHBondContact O-N 3.42Å; S101-Q105 PolarHBondContact O-NE2 2.79Å
102R84Confident84.2Confident192 Ų19299.5 Ų99.573%0.72548%0.481SS*.Hα-helixtrans-75.5-54.8-177.4-68.2-178.2179174.80.7111.3D100 Y104 Q105 E106D100-R102 PolarHBondContact O-N 3.36Å; D100-R102 PolarHBondContact OD1-N 3.26Å; R102-Y104 PolarHBondContact O-N 2.87Å; R102-Q105 PolarHBondContact O-N 3.44Å; R102-E106 WeakPolarHBondContact O-CG 3.33Å; R102-E106 PolarHBondContact O-N 3.35Å
103E83.9Confident84Confident120 Ų12098.6 Ų98.656%0.56148%0.484SS*.Hα-helixtrans-58.9-39.7178.1-64.7-172.5163.300111.5D100 E106 Q107D100-E103 HydrophobicContact CB-CB 4.45Å; D100-E103 HydrophobicContact CB-CG 4.38Å; E103-E106 PolarHBondContact O-N 3.16Å; E103-Q107 WeakPolarHBondContact O-CG 3.29Å; E103-Q107 PolarHBondContact O-N 3.12Å
104Y82.9Confident83.5Confident13 Ų13100.5 Ų100.55%0.05150%0.496CS..Hα-helixtrans-64.7-43.7178.5-177.2-101.1000112.4R93 P95 D100 R102 Q107 Q108R93-Y104 WeakPolarHBondContact CB-OH 3.32Å; R93-Y104 WeakPolarHBondContact CD-OH 3.25Å; R93-Y104 WeakPolarHBondContact CG-OH 3.3Å; R93-Y104 VanDerWaalsContact CZ-CE2 3.45Å; R93-Y104 PolarHBondContact NE-OH 3.08Å; R93-Y104 VanDerWaalsContact NH2-CE2 3.27Å; R93-Y104 WeakPolarHBondContact O-CE1 3.29Å; R93-Y104 PolarHBondContact O-OH 3.22Å; P95-Y104 HydrophobicContact CB-CD1 3.84Å; P95-Y104 HydrophobicContact CB-CE1 4.39Å; P95-Y104 HydrophobicContact CB-CG 4.21Å; P95-Y104 HydrophobicContact CG-CD1 4.47Å; D100-Y104 WeakPolarHBondContact O-CB 3.33Å; D100-Y104 PolarHBondContact O-N 2.98Å; D100-Y104 VanDerWaalsContact O-N 3.11Å; R102-Y104 PolarHBondContact O-N 2.87Å; Y104-Q107 PolarHBondContact O-N 3.3Å; Y104-Q108 HydrophobicContact CD1-CG 4.49Å; Y104-Q108 HydrophobicContact CE1-CG 4.09Å; Y104-Q108 WeakPolarHBondContact O-CG 3.4Å; Y104-Q108 PolarHBondContact O-N 2.89Å
105Q82.8Confident82.5Confident102 Ų102102.8 Ų102.848%0.47750%0.499SS..Hα-helixtrans-64.7-38.4175.3-75.9173.24600112.4S101 R102 Q108 R109S101-Q105 WeakPolarHBondContact O-CB 3.43Å; S101-Q105 WeakPolarHBondContact O-CG 3.36Å; S101-Q105 PolarHBondContact O-N 3.42Å; S101-Q105 PolarHBondContact O-NE2 2.79Å; R102-Q105 PolarHBondContact O-N 3.44Å; Q105-Q108 PolarHBondContact O-N 2.92Å; Q105-R109 WeakPolarHBondContact O-CG 3.34Å; Q105-R109 PolarHBondContact O-N 3.38Å
106E85.4Confident80.9Confident129 Ų129110.9 Ų110.960%0.60353%0.532SS*.Hα-helixtrans-63.9-41.9175.9-73.2174.6-17200111.6R102 E103 Q108 R109 S110R102-E106 WeakPolarHBondContact O-CG 3.33Å; R102-E106 PolarHBondContact O-N 3.35Å; E103-E106 PolarHBondContact O-N 3.16Å; E106-Q108 PolarHBondContact O-N 3.41Å; E106-R109 PolarHBondContact O-N 2.94Å; E106-S110 WeakPolarHBondContact O-CB 3.26Å; E106-S110 PolarHBondContact O-N 2.93Å; E106-S110 PolarHBondContact O-OG 3.47Å
107Q82.6Confident80.5Confident107 Ų107110.6 Ų110.650%0.554%0.537SS..Hα-helixtrans-60.6-45173.3-73.7175.629.600111.8E103 Y104 R109 S110 N111E103-Q107 WeakPolarHBondContact O-CG 3.29Å; E103-Q107 PolarHBondContact O-N 3.12Å; Y104-Q107 PolarHBondContact O-N 3.3Å; Q107-R109 PolarHBondContact O-N 3.49Å; Q107-S110 PolarHBondContact O-N 2.96Å; Q107-S110 PolarHBondContact O-OG 3.44Å; Q107-N111 WeakPolarHBondContact O-CB 3.49Å; Q107-N111 VanDerWaalsContact O-CG 3.27Å; Q107-N111 PolarHBondContact O-N 3.42Å; Q107-N111 PolarHBondContact O-ND2 3.4Å
108Q82.9Confident79.9Confident55 Ų55109.5 Ų109.526%0.25752%0.52SS..Hα-helixtrans-60-45.9176.3-65.4-54.3-54.400111.7I92 Y104 Q105 E106 S110 N111 L112I92-Q108 HydrophobicContact CG2-CG 4.17Å; Y104-Q108 HydrophobicContact CD1-CG 4.49Å; Y104-Q108 HydrophobicContact CE1-CG 4.09Å; Y104-Q108 WeakPolarHBondContact O-CG 3.4Å; Y104-Q108 PolarHBondContact O-N 2.89Å; Q105-Q108 PolarHBondContact O-N 2.92Å; E106-Q108 PolarHBondContact O-N 3.41Å; Q108-S110 PolarHBondContact O-N 3.49Å; Q108-N111 PolarHBondContact O-N 3.03Å; Q108-L112 WeakPolarHBondContact O-CB 3.27Å; Q108-L112 PolarHBondContact O-N 3.13Å
109R82.8Confident79.5Confident183 Ų183104.5 Ų104.569%0.69151%0.507SS*.Hα-helixtrans-61.5-44.2177.8-73.1174.4-176.2-112.12.3112.1Q105 E106 Q107 L112 S113Q105-R109 WeakPolarHBondContact O-CG 3.34Å; Q105-R109 PolarHBondContact O-N 3.38Å; E106-R109 PolarHBondContact O-N 2.94Å; Q107-R109 PolarHBondContact O-N 3.49Å; R109-L112 WeakPolarHBondContact O-CB 3.43Å; R109-L112 PolarHBondContact O-N 3.41Å; R109-S113 PolarHBondContact O-N 3.48Å
110S83.9Confident79.1Confident43 Ų43108 Ų10830%0.30152%0.524SS..Hα-helixtrans-68-33.7-179.9750000113.2E106 Q107 Q108 S113 K114E106-S110 WeakPolarHBondContact O-CB 3.26Å; E106-S110 PolarHBondContact O-N 2.93Å; E106-S110 PolarHBondContact O-OG 3.47Å; Q107-S110 PolarHBondContact O-N 2.96Å; Q107-S110 PolarHBondContact O-OG 3.44Å; Q108-S110 PolarHBondContact O-N 3.49Å; S110-S113 PolarHBondContact O-OG 3.47Å; S110-K114 WeakPolarHBondContact O-CD 3.4Å; S110-K114 VanDerWaalsContact O-CG 3.24Å; S110-K114 WeakPolarHBondContact O-CG 3.36Å; S110-K114 PolarHBondContact O-N 2.92Å
111N79.6Confident78.7Confident79 Ų79109.1 Ų109.142%0.42253%0.527SS..Hα-helixtrans-72.8-36.1175.1-70.5-19.5000111.2Q107 Q108 K114 T115Q107-N111 WeakPolarHBondContact O-CB 3.49Å; Q107-N111 VanDerWaalsContact O-CG 3.27Å; Q107-N111 PolarHBondContact O-N 3.42Å; Q107-N111 PolarHBondContact O-ND2 3.4Å; Q108-N111 PolarHBondContact O-N 3.03Å; N111-K114 PolarHBondContact O-N 2.98Å; N111-T115 PolarHBondContact O-N 3.14Å; N111-T115 PolarHBondContact O-OG1 3.17Å
112L77.4Confident78.2Confident97 Ų97112.6 Ų112.651%0.50854%0.536SS..Hα-helixtrans-63-46.1174-152.487000111.2K90 Q108 R109 K114 T115K90-L112 HydrophobicContact CD-CD1 4.14Å; Q108-L112 WeakPolarHBondContact O-CB 3.27Å; Q108-L112 PolarHBondContact O-N 3.13Å; R109-L112 WeakPolarHBondContact O-CB 3.43Å; R109-L112 PolarHBondContact O-N 3.41Å; L112-K114 VanDerWaalsContact C-N 3.27Å; L112-K114 PolarHBondContact O-N 3.48Å; L112-T115 PolarHBondContact O-N 3.35Å
113S75.3Confident77.7Confident85 Ų85106.9 Ų106.959%0.59452%0.522SS*.Hα-helixtrans-68.3-22.5-179.568.30000114.2R109 S110R109-S113 PolarHBondContact O-N 3.48Å; S110-S113 PolarHBondContact O-OG 3.47Å
114K71.9Confident77.3Confident159 Ų159105.9 Ų105.969%0.69152%0.519SS*.Hα-helixtrans-82.9-16.6175.7-73.4169.5-173.6172.10113.6S110 N111 L112 H116S110-K114 WeakPolarHBondContact O-CD 3.4Å; S110-K114 VanDerWaalsContact O-CG 3.24Å; S110-K114 WeakPolarHBondContact O-CG 3.36Å; S110-K114 PolarHBondContact O-N 2.92Å; N111-K114 PolarHBondContact O-N 2.98Å; L112-K114 VanDerWaalsContact C-N 3.27Å; L112-K114 PolarHBondContact O-N 3.48Å; K114-H116 VanDerWaalsContact C-N 3.29Å
115T64.3Low76.8Confident100 Ų100113.7 Ų113.761%0.61356%0.558SS**  trans-88.80.6-176.4-53.40000111.9N111 L112N111-T115 PolarHBondContact O-N 3.14Å; N111-T115 PolarHBondContact O-OG1 3.17Å; L112-T115 PolarHBondContact O-N 3.35Å
116H52.8Low76.2Confident225 Ų225114.7 Ų114.7100%1.04257%0.566SS**  trans-121.90-174-151-51.2000112K114K114-H116 VanDerWaalsContact C-N 3.29Å

Retrieved 116 of 116 residues in 166.8 ms (Link to these results)