G4VGA1_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession G4VGA1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 146 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
1M50Low50.1Low206 Ų206123.9 Ų123.9100%1.01562%0.615SS**  0-31.10-14316189.900113.1I3 V4M1-I3 PolarHBondContact O-N 3.37Å; M1-V4 PolarHBondContact O-N 3.33Å
2L40.7Very low51Low115 Ų115120.4 Ų120.460%0.60261%0.606SS**Hα-helixtrans-60.7-36.7178.9-93.2142.5000116.2V4 L5 F6 E103L2-V4 VanDerWaalsContact C-N 3.31Å; L2-V4 PolarHBondContact O-N 3.43Å; L2-L5 WeakPolarHBondContact O-CB 3.34Å; L2-L5 PolarHBondContact O-N 3.42Å; L2-L5 VanDerWaalsContact O-N 3.16Å; L2-F6 PolarHBondContact O-N 3.33Å; L2-E103 WeakPolarHBondContact CD1-OE1 3.42Å
3I49.2Very low51.6Low139 Ų139118.8 Ų118.871%0.71360%0.598SS**Hα-helixtrans-63.1-37.9-179.9-61.8169.4000111.4M1 L5 F6 V7M1-I3 PolarHBondContact O-N 3.37Å; I3-L5 VanDerWaalsContact C-N 3.34Å; I3-F6 PolarHBondContact O-N 2.9Å; I3-V7 HydrophobicContact CG2-CG2 4.49Å; I3-V7 WeakPolarHBondContact O-CG2 3.15Å; I3-V7 PolarHBondContact O-N 2.93Å
4V44.3Very low51.8Low105 Ų105119.9 Ų119.964%0.63660%0.6SS**Hα-helixtrans-67.1-38.6177.2179.70000110.8M1 L2 K8M1-V4 PolarHBondContact O-N 3.33Å; L2-V4 VanDerWaalsContact C-N 3.31Å; L2-V4 PolarHBondContact O-N 3.43Å; V4-K8 WeakPolarHBondContact O-CB 3.22Å; V4-K8 PolarHBondContact O-N 3.14Å
5L49.4Very low52.2Low109 Ų109123.9 Ų123.957%0.57161%0.605SS**Hα-helixtrans-62.1-46.1174.4-93.5152.7000111.1L2 I3 K8 T9L2-L5 WeakPolarHBondContact O-CB 3.34Å; L2-L5 PolarHBondContact O-N 3.42Å; L2-L5 VanDerWaalsContact O-N 3.16Å; I3-L5 VanDerWaalsContact C-N 3.34Å; L5-K8 WeakPolarHBondContact O-CB 3.39Å; L5-K8 PolarHBondContact O-N 3.21Å; L5-T9 PolarHBondContact O-N 3.36Å; L5-T9 PolarHBondContact O-OG1 3.04Å
6F49.6Very low52.7Low140 Ų140121.9 Ų121.961%0.61459%0.594SS**Hα-helixtrans-66.9-38.6-178.6-151-91.9000113.3L2 I3 K8 T9 R10L2-F6 PolarHBondContact O-N 3.33Å; I3-F6 PolarHBondContact O-N 2.9Å; F6-K8 VanDerWaalsContact C-N 3.35Å; F6-T9 WeakPolarHBondContact CA-OG1 3.37Å; F6-T9 PolarHBondContact O-N 3.28Å; F6-T9 PolarHBondContact O-OG1 2.91Å; F6-R10 HydrophobicContact CE1-CG 4.43Å; F6-R10 PolarHBondContact O-N 3.44Å
7V51.1Low52.9Low79 Ų79120.1 Ų120.148%0.47959%0.587SS.*Hα-helixtrans-65.5-40.9172.8173.60000110.3I3 R10 I11I3-V7 HydrophobicContact CG2-CG2 4.49Å; I3-V7 WeakPolarHBondContact O-CG2 3.15Å; I3-V7 PolarHBondContact O-N 2.93Å; V7-R10 PolarHBondContact O-N 3.31Å; V7-I11 HydrophobicContact CG1-CD1 3.78Å; V7-I11 WeakPolarHBondContact O-CD1 3.38Å; V7-I11 VanDerWaalsContact O-CG1 3.24Å; V7-I11 WeakPolarHBondContact O-CG1 3.21Å; V7-I11 PolarHBondContact O-N 2.96Å
8K51.4Low53.1Low146 Ų146121.5 Ų121.564%0.63559%0.589SS**Hα-helixtrans-60.6-49.7174.5-122.6175.6178.8178.60110.9V4 L5 F6 R10 I11 T12V4-K8 WeakPolarHBondContact O-CB 3.22Å; V4-K8 PolarHBondContact O-N 3.14Å; L5-K8 WeakPolarHBondContact O-CB 3.39Å; L5-K8 PolarHBondContact O-N 3.21Å; F6-K8 VanDerWaalsContact C-N 3.35Å; K8-R10 PolarHBondContact O-N 3.42Å; K8-I11 PolarHBondContact O-N 3.47Å; K8-T12 PolarHBondContact O-N 3.46Å; K8-T12 PolarHBondContact O-OG1 2.91Å
9T56.4Low53.4Low72 Ų72122.5 Ų122.544%0.44259%0.586SS.*Hα-helixtrans-62.7-41.5179.514.40000112.6L5 F6 I11 T12 I13L5-T9 PolarHBondContact O-N 3.36Å; L5-T9 PolarHBondContact O-OG1 3.04Å; F6-T9 WeakPolarHBondContact CA-OG1 3.37Å; F6-T9 PolarHBondContact O-N 3.28Å; F6-T9 PolarHBondContact O-OG1 2.91Å; T9-I11 VanDerWaalsContact C-N 3.32Å; T9-I11 PolarHBondContact O-N 3.28Å; T9-T12 PolarHBondContact O-N 3.13Å; T9-I13 WeakPolarHBondContact O-CB 3.09Å; T9-I13 VanDerWaalsContact O-CG1 3.25Å; T9-I13 WeakPolarHBondContact O-CG1 3.34Å; T9-I13 PolarHBondContact O-N 3.47Å
10R47.5Very low53.2Low171 Ų171122.1 Ų122.165%0.64558%0.584SS**Hα-helixtrans-60-41.7174.7-92.8-133.9-173.5-158.15.9112.5F6 V7 K8 H14F6-R10 HydrophobicContact CE1-CG 4.43Å; F6-R10 PolarHBondContact O-N 3.44Å; V7-R10 PolarHBondContact O-N 3.31Å; K8-R10 PolarHBondContact O-N 3.42Å; R10-H14 VanDerWaalsContact O-CB 3.3Å; R10-H14 WeakPolarHBondContact O-CB 3.33Å; R10-H14 PolarHBondContact O-N 2.58Å
11I60.9Low53.3Low81 Ų81120.6 Ų120.642%0.41558%0.582SS.*Hα-helixtrans-67-41.1178.2-67166.2000110.5V7 K8 T9 H14 R15V7-I11 HydrophobicContact CG1-CD1 3.78Å; V7-I11 WeakPolarHBondContact O-CD1 3.38Å; V7-I11 VanDerWaalsContact O-CG1 3.24Å; V7-I11 WeakPolarHBondContact O-CG1 3.21Å; V7-I11 PolarHBondContact O-N 2.96Å; K8-I11 PolarHBondContact O-N 3.47Å; T9-I11 VanDerWaalsContact C-N 3.32Å; T9-I11 PolarHBondContact O-N 3.28Å; I11-H14 PolarHBondContact O-N 3.5Å; I11-R15 WeakPolarHBondContact O-CG 3.41Å; I11-R15 PolarHBondContact O-N 3.2Å
12T61.5Low53.6Low82 Ų82113.9 Ų113.950%0.50355%0.553SS.*Hα-helixtrans-65.2-46.8178.6-38.10000111.4K8 T9 H14 R15 E16K8-T12 PolarHBondContact O-N 3.46Å; K8-T12 PolarHBondContact O-OG1 2.91Å; T9-T12 PolarHBondContact O-N 3.13Å; T12-H14 VanDerWaalsContact C-N 3.33Å; T12-H14 PolarHBondContact O-N 3.2Å; T12-R15 PolarHBondContact O-N 2.81Å; T12-E16 PolarHBondContact O-N 2.79Å
13I58.7Low54.4Low99 Ų99113.3 Ų113.351%0.50855%0.547SS..Hα-helixtrans-63.2-41.8178.5-66167.7000110.5T9 R15 E16 I17T9-I13 WeakPolarHBondContact O-CB 3.09Å; T9-I13 VanDerWaalsContact O-CG1 3.25Å; T9-I13 WeakPolarHBondContact O-CG1 3.34Å; T9-I13 PolarHBondContact O-N 3.47Å; I13-R15 VanDerWaalsContact C-N 3.32Å; I13-R15 PolarHBondContact O-N 2.91Å; I13-E16 PolarHBondContact O-N 3.33Å; I13-I17 HydrophobicContact CG2-CD1 3.69Å; I13-I17 HydrophobicContact CG2-CG1 4.31Å; I13-I17 WeakPolarHBondContact O-CG1 3.42Å; I13-I17 PolarHBondContact O-N 3.34Å
14H54.1Low54.6Low134 Ų134111.1 Ų111.162%0.6254%0.54SS*.Hα-helixtrans-65.5-36.9178.8-1651.2000112.2R10 I11 T12 K18R10-H14 VanDerWaalsContact O-CB 3.3Å; R10-H14 WeakPolarHBondContact O-CB 3.33Å; R10-H14 PolarHBondContact O-N 2.58Å; I11-H14 PolarHBondContact O-N 3.5Å; T12-H14 VanDerWaalsContact C-N 3.33Å; T12-H14 PolarHBondContact O-N 3.2Å; H14-K18 VanDerWaalsContact O-CB 3.31Å; H14-K18 WeakPolarHBondContact O-CB 3.2Å; H14-K18 PolarHBondContact O-N 2.88Å
15R58.5Low54.9Low181 Ų181108.7 Ų108.768%0.68353%0.527SS*.Hα-helixtrans-65.3-41.4174.1-76.7178.7-178.1177.50.9111.9I11 T12 I13 K18 R19I11-R15 WeakPolarHBondContact O-CG 3.41Å; I11-R15 PolarHBondContact O-N 3.2Å; T12-R15 PolarHBondContact O-N 2.81Å; I13-R15 VanDerWaalsContact C-N 3.32Å; I13-R15 PolarHBondContact O-N 2.91Å; R15-K18 PolarHBondContact O-N 3.18Å; R15-R19 WeakPolarHBondContact O-CB 3.43Å; R15-R19 PolarHBondContact O-N 2.98Å
16E60.6Low55Low91 Ų91108.3 Ų108.343%0.42553%0.525SS..Hα-helixtrans-69.8-41.9-179.1-153.261.5-153.700112T12 I13 K18 R19 Q20T12-E16 PolarHBondContact O-N 2.79Å; I13-E16 PolarHBondContact O-N 3.33Å; E16-K18 VanDerWaalsContact C-N 3.34Å; E16-K18 PolarHBondContact O-N 3.16Å; E16-R19 WeakPolarHBondContact O-CB 3Å; E16-R19 PolarHBondContact O-N 3.36Å; E16-Q20 WeakPolarHBondContact O-CG 3.46Å; E16-Q20 PolarHBondContact O-N 3.45Å
17I55.4Low55Low91 Ų91103.2 Ų103.247%0.46751%0.512SS..Hα-helixtrans-63.7-42.1174.2-66.3170.1000110.4I13 R19 Q20 V21I13-I17 HydrophobicContact CG2-CD1 3.69Å; I13-I17 HydrophobicContact CG2-CG1 4.31Å; I13-I17 WeakPolarHBondContact O-CG1 3.42Å; I13-I17 PolarHBondContact O-N 3.34Å; I17-R19 VanDerWaalsContact C-N 3.28Å; I17-R19 PolarHBondContact O-N 3Å; I17-Q20 PolarHBondContact O-N 3.48Å; I17-V21 HydrophobicContact CG2-CG2 4.33Å; I17-V21 WeakPolarHBondContact O-CB 3.2Å; I17-V21 VanDerWaalsContact O-CG2 3.27Å; I17-V21 WeakPolarHBondContact O-CG2 3.08Å; I17-V21 PolarHBondContact O-N 2.98Å
18K57Low54.7Low146 Ų146103.6 Ų103.664%0.63551%0.511SS*.Hα-helixtrans-61.2-41.2176.6-168.9175.5-177.6-179.40110.8H14 R15 E16 V21 T22H14-K18 VanDerWaalsContact O-CB 3.31Å; H14-K18 WeakPolarHBondContact O-CB 3.2Å; H14-K18 PolarHBondContact O-N 2.88Å; R15-K18 PolarHBondContact O-N 3.18Å; E16-K18 VanDerWaalsContact C-N 3.34Å; E16-K18 PolarHBondContact O-N 3.16Å; K18-V21 PolarHBondContact O-N 3.45Å; K18-T22 PolarHBondContact O-N 2.99Å; K18-T22 PolarHBondContact O-OG1 3.29Å
19R58.4Low54.6Low141 Ų141101.5 Ų101.553%0.53251%0.51SS..Hα-helixtrans-62.7-48.4176.9-171-179.5175.6164.73.3112R15 E16 I17 V21 T22 E23R15-R19 WeakPolarHBondContact O-CB 3.43Å; R15-R19 PolarHBondContact O-N 2.98Å; E16-R19 WeakPolarHBondContact O-CB 3Å; E16-R19 PolarHBondContact O-N 3.36Å; I17-R19 VanDerWaalsContact C-N 3.28Å; I17-R19 PolarHBondContact O-N 3Å; R19-V21 VanDerWaalsContact C-N 3.34Å; R19-V21 PolarHBondContact O-N 2.89Å; R19-T22 VanDerWaalsContact CA-OG1 3.3Å; R19-T22 WeakPolarHBondContact CA-OG1 3.47Å; R19-T22 PolarHBondContact O-N 2.97Å; R19-T22 PolarHBondContact O-OG1 3.48Å; R19-E23 IonicContact CZ-OE1 3.83Å; R19-E23 IonicContact NE-OE1 2.99Å; R19-E23 PolarHBondContact NE-OE1 3.4Å; R19-E23 IonicContact NH2-OE1 3.8Å; R19-E23 PolarHBondContact O-N 2.8Å
20Q50.1Low54.2Low114 Ų114103.4 Ų103.453%0.53352%0.518SS..Hα-helixtrans-63.1-39.4178.2-71.9-176.21.900112.1E16 I17 E23 V24E16-Q20 WeakPolarHBondContact O-CG 3.46Å; E16-Q20 PolarHBondContact O-N 3.45Å; I17-Q20 PolarHBondContact O-N 3.48Å; Q20-E23 PolarHBondContact O-N 3.29Å; Q20-V24 WeakPolarHBondContact O-CB 3.24Å; Q20-V24 VanDerWaalsContact O-CG2 3.26Å; Q20-V24 WeakPolarHBondContact O-CG2 3.46Å; Q20-V24 PolarHBondContact O-N 3.18Å
21V55.4Low54.1Low91 Ų91100.1 Ų100.155%0.55251%0.512SS*.Hα-helixtrans-65.6-39.5175.1173.90000111.2I17 K18 R19 S25I17-V21 HydrophobicContact CG2-CG2 4.33Å; I17-V21 WeakPolarHBondContact O-CB 3.2Å; I17-V21 VanDerWaalsContact O-CG2 3.27Å; I17-V21 WeakPolarHBondContact O-CG2 3.08Å; I17-V21 PolarHBondContact O-N 2.98Å; K18-V21 PolarHBondContact O-N 3.45Å; R19-V21 VanDerWaalsContact C-N 3.34Å; R19-V21 PolarHBondContact O-N 2.89Å; V21-S25 WeakPolarHBondContact O-CB 3.42Å; V21-S25 PolarHBondContact O-N 3.39Å; V21-S25 PolarHBondContact O-OG 3.48Å
22T56.3Low53Low65 Ų65104.4 Ų104.440%0.39952%0.524SS..Hα-helixtrans-66.1-39.6173.233.40000113K18 R19 S25 I26K18-T22 PolarHBondContact O-N 2.99Å; K18-T22 PolarHBondContact O-OG1 3.29Å; R19-T22 VanDerWaalsContact CA-OG1 3.3Å; R19-T22 WeakPolarHBondContact CA-OG1 3.47Å; R19-T22 PolarHBondContact O-N 2.97Å; R19-T22 PolarHBondContact O-OG1 3.48Å; T22-S25 VanDerWaalsContact CA-OG 3.26Å; T22-S25 WeakPolarHBondContact CA-OG 3.31Å; T22-S25 PolarHBondContact O-N 3.15Å; T22-S25 PolarHBondContact O-OG 3.3Å; T22-S25 VanDerWaalsContact O-OG 3.11Å; T22-I26 WeakPolarHBondContact O-CB 3.41Å; T22-I26 WeakPolarHBondContact O-CD1 3.25Å; T22-I26 WeakPolarHBondContact O-CG1 3.41Å; T22-I26 PolarHBondContact O-N 3.38Å
23E55.9Low52Low103 Ų103104 Ų10448%0.48152%0.523SS..Hα-helixtrans-68.2-39.5177.9-74.7172.9-170.700111.7R19 Q20 I26 G27R19-E23 IonicContact CZ-OE1 3.83Å; R19-E23 IonicContact NE-OE1 2.99Å; R19-E23 PolarHBondContact NE-OE1 3.4Å; R19-E23 IonicContact NH2-OE1 3.8Å; R19-E23 PolarHBondContact O-N 2.8Å; Q20-E23 PolarHBondContact O-N 3.29Å; E23-I26 PolarHBondContact O-N 3.14Å; E23-G27 PolarHBondContact O-N 2.91Å
24V53.9Low51.2Low93 Ų93104.3 Ų104.356%0.56453%0.529SS*.Hα-helixtrans-68.3-38.1174.7172.60000111.6Q20 G27 L28Q20-V24 WeakPolarHBondContact O-CB 3.24Å; Q20-V24 VanDerWaalsContact O-CG2 3.26Å; Q20-V24 WeakPolarHBondContact O-CG2 3.46Å; Q20-V24 PolarHBondContact O-N 3.18Å; V24-G27 PolarHBondContact O-N 3.45Å; V24-L28 HydrophobicContact CG1-CD1 4.03Å; V24-L28 WeakPolarHBondContact O-CB 3.39Å; V24-L28 PolarHBondContact O-N 3.42Å
25S50.4Low50.6Low53 Ų53104.7 Ų104.737%0.37154%0.535SS..Hα-helixtrans-72.8-33.9176.946.20000112.8V21 T22 L28 V29V21-S25 WeakPolarHBondContact O-CB 3.42Å; V21-S25 PolarHBondContact O-N 3.39Å; V21-S25 PolarHBondContact O-OG 3.48Å; T22-S25 VanDerWaalsContact CA-OG 3.26Å; T22-S25 WeakPolarHBondContact CA-OG 3.31Å; T22-S25 PolarHBondContact O-N 3.15Å; T22-S25 PolarHBondContact O-OG 3.3Å; T22-S25 VanDerWaalsContact O-OG 3.11Å; S25-L28 PolarHBondContact O-N 3.47Å; S25-V29 VanDerWaalsContact O-CB 3.32Å; S25-V29 WeakPolarHBondContact O-CB 3.26Å; S25-V29 WeakPolarHBondContact O-CG2 3.42Å; S25-V29 PolarHBondContact O-N 2.96Å
26I52.7Low49.2Very low101 Ų101102.7 Ų102.752%0.51854%0.537SS..Hα-helixtrans-68.2-39.6169.9-66.1161.6000110.5T22 E23 V29 N30T22-I26 WeakPolarHBondContact O-CB 3.41Å; T22-I26 WeakPolarHBondContact O-CD1 3.25Å; T22-I26 WeakPolarHBondContact O-CG1 3.41Å; T22-I26 PolarHBondContact O-N 3.38Å; E23-I26 PolarHBondContact O-N 3.14Å; I26-V29 PolarHBondContact O-N 2.79Å; I26-N30 WeakPolarHBondContact O-CB 3.42Å; I26-N30 PolarHBondContact O-N 3.21Å
27G48.6Very low48.2Very low33 Ų33106.3 Ų106.334%0.3455%0.552SS.*Hα-helixtrans-59.8-44.117300000112.5E23 V24 N30 I31E23-G27 PolarHBondContact O-N 2.91Å; V24-G27 PolarHBondContact O-N 3.45Å; G27-N30 PolarHBondContact O-N 2.95Å; G27-I31 VanDerWaalsContact O-CD1 3.26Å; G27-I31 WeakPolarHBondContact O-CD1 3.5Å; G27-I31 WeakPolarHBondContact O-CG1 3.26Å; G27-I31 PolarHBondContact O-N 2.9Å
28L45.1Very low47Very low87 Ų87107 Ų10746%0.45556%0.561SS.*Hα-helixtrans-68.1-43.9175.5-100.5143.6000112.5V24 S25 N30 I31 Y32V24-L28 HydrophobicContact CG1-CD1 4.03Å; V24-L28 WeakPolarHBondContact O-CB 3.39Å; V24-L28 PolarHBondContact O-N 3.42Å; S25-L28 PolarHBondContact O-N 3.47Å; L28-N30 PolarHBondContact O-N 3.45Å; L28-I31 PolarHBondContact O-N 3.06Å; L28-Y32 HydrophobicContact CD2-CD2 4.36Å; L28-Y32 HydrophobicContact CD2-CE2 3.84Å; L28-Y32 WeakPolarHBondContact O-CD2 3.17Å; L28-Y32 PolarHBondContact O-N 2.92Å; L28-Y32 VanDerWaalsContact O-N 3.16Å
29V50.1Low45.8Very low103 Ų103107 Ų10762%0.62457%0.568SS**Hα-helixtrans-67.3-25.2177.5172.90000111.8S25 I26 P33S25-V29 VanDerWaalsContact O-CB 3.32Å; S25-V29 WeakPolarHBondContact O-CB 3.26Å; S25-V29 WeakPolarHBondContact O-CG2 3.42Å; S25-V29 PolarHBondContact O-N 2.96Å; I26-V29 PolarHBondContact O-N 2.79Å; V29-P33 WeakPolarHBondContact O-CD 3.43Å
30N46.4Very low44.7Very low112 Ų112106.3 Ų106.360%0.59958%0.579SS**Hα-helixtrans-78.9-18170.8-91.3-11.4000114I26 G27 L28 V34I26-N30 WeakPolarHBondContact O-CB 3.42Å; I26-N30 PolarHBondContact O-N 3.21Å; G27-N30 PolarHBondContact O-N 2.95Å; L28-N30 PolarHBondContact O-N 3.45Å; N30-V34 WeakPolarHBondContact O-CG2 3.41Å
31I46.4Very low43.9Very low102 Ų102108 Ų10852%0.52359%0.591SS.*Hα-helixtrans-85-32.5175.9-63158.9000110.8G27 L28 V34 L35G27-I31 VanDerWaalsContact O-CD1 3.26Å; G27-I31 WeakPolarHBondContact O-CD1 3.5Å; G27-I31 WeakPolarHBondContact O-CG1 3.26Å; G27-I31 PolarHBondContact O-N 2.9Å; L28-I31 PolarHBondContact O-N 3.06Å; I31-V34 PolarHBondContact O-N 3.35Å; I31-L35 HydrophobicContact CG2-CD1 4.44Å
32Y38.3Very low42.5Very low171 Ų171111.7 Ų111.767%0.67160%0.601SS**THydrogen-bonded Turntrans-66.1-31.4-177.5-92.1-78.7000116.8L28L28-Y32 HydrophobicContact CD2-CD2 4.36Å; L28-Y32 HydrophobicContact CD2-CE2 3.84Å; L28-Y32 WeakPolarHBondContact O-CD2 3.17Å; L28-Y32 PolarHBondContact O-N 2.92Å; L28-Y32 VanDerWaalsContact O-N 3.16Å
33P40.1Very low41.7Very low74 Ų74115.3 Ų115.348%0.48162%0.623SS.*THydrogen-bonded Turntrans-86.6-14.5175.930.8-33.3000113.4V29V29-P33 WeakPolarHBondContact O-CD 3.43Å
34V41.4Very low41.1Very low105 Ų105115.4 Ų115.464%0.63663%0.633SS**G310 helixtrans-79.8-20.3178.9-179.70000112N30 I31 N36N30-V34 WeakPolarHBondContact O-CG2 3.41Å; I31-V34 PolarHBondContact O-N 3.35Å; V34-N36 VanDerWaalsContact C-N 3.26Å; V34-N36 PolarHBondContact O-N 2.85Å
35L40.7Very low40.1Very low142 Ų142118.8 Ų118.874%0.74365%0.647SS**G310 helixtrans-83.73.6174.5-78.9162000113.9I31I31-L35 HydrophobicContact CG2-CD1 4.44Å
36N30.8Very low39.9Very low138 Ų138124.4 Ų124.474%0.73867%0.671SS**G310 helixtrans-104.717.4-179.3-14222.6000114V34V34-N36 VanDerWaalsContact C-N 3.26Å; V34-N36 PolarHBondContact O-N 2.85Å
37F38.2Very low39Very low167 Ų167126.9 Ų126.973%0.73268%0.682SS**  trans-96.594.8166.3-76.8-80.8000108.8
38T31Very low38.3Very low107 Ų107131.5 Ų131.566%0.65671%0.706SS**  34.1117.6129.453.50000116.4
39D32.4Very low38Very low144 Ų144132.9 Ų132.977%0.7772%0.718SS**SBendtrans31.8112.7138.1-61.9-40.5000117
40T34.9Very low37.5Very low127 Ų127131.2 Ų131.278%0.77972%0.716SS**  trans65.1114.5154.562.70000115.8
41I32.6Very low36.9Very low151 Ų151134.5 Ų134.577%0.77473%0.732SS**  trans156.9110.8141.1-80.3156.8000110.6
42H26.7Very low36.4Very low167 Ų167132.7 Ų132.777%0.77374%0.739SS**  trans72.398.9148.8-67.9-106.4000121.6
43V38.7Very low36.5Very low141 Ų141130 Ų13086%0.85574%0.739SS**  trans-61.7125.6134-179.70000106.2
44P43.5Very low36.9Very low106 Ų106131.8 Ų131.869%0.68875%0.749SS**  -152.9-168.360.935.5-10.9000115.2
45L34Very low37.2Very low164 Ų164136.3 Ų136.386%0.85976%0.76SS**  trans110.656.7156.5-144.893.8000118.1
46I45.3Very low37.7Very low171 Ų171134.4 Ų134.488%0.87775%0.75SS**SBendtrans-132.697.5152.5-54.3177.5000110.4
47M33.2Very low38.7Very low153 Ų153132.6 Ų132.675%0.75474%0.74SS**  trans58.4118.2144.5-142.8125.299.900121.2T49M47-T49 PolarHBondContact O-N 3.31Å
48P34.5Very low39.4Very low129 Ų129129.8 Ų129.884%0.83874%0.737SS**SBendtrans-88.478.5176.436.8-30.9000110.9
49T38.9Very low40.6Very low116 Ų116128.7 Ų128.771%0.71273%0.734SS**  trans-153.518.117020.70000113.6M47 L51M47-T49 PolarHBondContact O-N 3.31Å; T49-L51 PolarHBondContact O-N 3.05Å
50A39.6Very low41.7Very low69 Ų69126.5 Ų126.557%0.5772%0.722SS**  trans-8896.4174.600000110.3G52 V53A50-G52 VanDerWaalsContact C-N 3.35Å; A50-G52 PolarHBondContact O-N 3.11Å; A50-V53 HydrophobicContact CB-CG2 3.4Å; A50-V53 VanDerWaalsContact CB-CG2 3.4Å
51L33.9Very low42.7Very low181 Ų181130.6 Ų130.695%0.94872%0.724SS**THydrogen-bonded Turntrans-48.1101.6154.9-90.6148.9000108.4T49T49-L51 PolarHBondContact O-N 3.05Å
52G35.6Very low43.8Very low64 Ų64131.2 Ų131.266%0.6672%0.721SS**THydrogen-bonded Turntrans57.771.3168.400000115.8A50 V54A50-G52 VanDerWaalsContact C-N 3.35Å; A50-G52 PolarHBondContact O-N 3.11Å; G52-V54 PolarHBondContact O-N 3.4Å
53V40.7Very low45.3Very low113 Ų113124.9 Ų124.969%0.68569%0.694SS**  trans-7087.7156.8-170.60000107.7A50 K55A50-V53 HydrophobicContact CB-CG2 3.4Å; A50-V53 VanDerWaalsContact CB-CG2 3.4Å; V53-K55 PolarHBondContact O-N 2.99Å
54V49.5Very low46.2Very low113 Ų113124.4 Ų124.469%0.68568%0.68SS**  trans-66102.5166.41790000106.3G52 L56G52-V54 PolarHBondContact O-N 3.4Å; V54-L56 VanDerWaalsContact C-N 3.27Å; V54-L56 PolarHBondContact O-N 3.06Å
55K46.7Very low47.1Very low199 Ų199124.4 Ų124.487%0.86567%0.674SS**  trans-61.894.3165.9-87.9-178173.5178.50107.5V53 D57V53-K55 PolarHBondContact O-N 2.99Å; K55-D57 PolarHBondContact O-N 2.95Å; K55-D57 VanDerWaalsContact O-N 3.13Å
56L51.7Low48.5Very low102 Ų102121.3 Ų121.353%0.53466%0.658SS.*  trans-67.5108.1169.6-96.3125.7000107.8V54 T58 V63V54-L56 VanDerWaalsContact C-N 3.27Å; V54-L56 PolarHBondContact O-N 3.06Å; L56-T58 PolarHBondContact O-N 2.98Å; L56-V63 HydrophobicContact CD2-CB 4.3Å; L56-V63 HydrophobicContact CD2-CG1 3.43Å; L56-V63 VanDerWaalsContact CD2-CG1 3.43Å; L56-V63 HydrophobicContact CD2-CG2 3.83Å
57D50.7Low49.3Very low100 Ų100119.4 Ų119.454%0.53564%0.643SS.*  trans-64.6102176.1-163.2-18.3000109.2K55 S59 N60K55-D57 PolarHBondContact O-N 2.95Å; K55-D57 VanDerWaalsContact O-N 3.13Å; D57-S59 PolarHBondContact O-N 3.41Å; D57-S59 VanDerWaalsContact O-N 3.08Å; D57-S59 WeakPolarHBondContact OD1-CB 3.36Å; D57-S59 PolarHBondContact OD1-N 3.05Å; D57-S59 PolarHBondContact OD1-OG 3.17Å; D57-S59 PolarHBondContact OD2-OG 3.31Å; D57-N60 PolarHBondContact O-N 3.27Å
58T54.4Low50.8Low108 Ų108117.3 Ų117.366%0.66363%0.634SS**THydrogen-bonded Turntrans-67.1-4.6-177.348.30000113.4L56 N60 K64L56-T58 PolarHBondContact O-N 2.98Å; T58-N60 VanDerWaalsContact C-N 3.33Å; T58-K64 VanDerWaalsContact O-CE 3.29Å; T58-K64 WeakPolarHBondContact O-CE 3.47Å
59S54.8Low52.1Low85 Ų85113.7 Ų113.759%0.59461%0.612SS**THydrogen-bonded Turntrans-75.9-20.8173.167.70000112.8D57 R61D57-S59 PolarHBondContact O-N 3.41Å; D57-S59 VanDerWaalsContact O-N 3.08Å; D57-S59 WeakPolarHBondContact OD1-CB 3.36Å; D57-S59 PolarHBondContact OD1-N 3.05Å; D57-S59 PolarHBondContact OD1-OG 3.17Å; D57-S59 PolarHBondContact OD2-OG 3.31Å; S59-R61 PolarHBondContact O-N 3.4Å
60N56.7Low53.5Low97 Ų97113 Ų11352%0.51960%0.603SS.*  trans-76.1112.2-177.8-102.2-29.9000111.7D57 T58 F62 V63 K64D57-N60 PolarHBondContact O-N 3.27Å; T58-N60 VanDerWaalsContact C-N 3.33Å; N60-F62 PolarHBondContact O-N 3.05Å; N60-V63 HydrophobicContact CB-CG2 4.08Å; N60-V63 PolarHBondContact O-N 3.43Å; N60-K64 PolarHBondContact O-N 3.06Å
61R54.9Low54.8Low214 Ų214115.6 Ų115.681%0.80860%0.604SS**Hα-helixtrans-51.1-29.8178.3-158176.1-172.2175.31.9112.8S59 L65S59-R61 PolarHBondContact O-N 3.4Å; R61-L65 PolarHBondContact O-N 3.32Å; R61-L65 VanDerWaalsContact O-N 3.12Å
62F55.1Low56.4Low164 Ų164111.4 Ų111.472%0.71959%0.585SS**Hα-helixtrans-67.4-40.3177.9-150-92.7000113.2N60 L65 L66N60-F62 PolarHBondContact O-N 3.05Å; F62-L65 PolarHBondContact O-N 3.5Å; F62-L66 PolarHBondContact O-N 3.25Å
63V58.1Low58.1Low33 Ų33113.3 Ų113.320%0.258%0.579CS.*Hα-helixtrans-66.9-41.9178.3177.80000110.3L56 N60 L65 L66 F67L56-V63 HydrophobicContact CD2-CB 4.3Å; L56-V63 HydrophobicContact CD2-CG1 3.43Å; L56-V63 VanDerWaalsContact CD2-CG1 3.43Å; L56-V63 HydrophobicContact CD2-CG2 3.83Å; N60-V63 HydrophobicContact CB-CG2 4.08Å; N60-V63 PolarHBondContact O-N 3.43Å; V63-L65 VanDerWaalsContact C-N 3.33Å; V63-L65 PolarHBondContact O-N 3.21Å; V63-L66 PolarHBondContact O-N 3.49Å; V63-F67 HydrophobicContact CG1-CD2 4.11Å; V63-F67 HydrophobicContact CG1-CE2 4.21Å; V63-F67 WeakPolarHBondContact O-CD2 3.47Å; V63-F67 PolarHBondContact O-N 3.36Å; V63-F67 VanDerWaalsContact O-N 3.08Å
64K59.5Low59.6Low131 Ų131112.9 Ų112.957%0.5757%0.573SS**Hα-helixtrans-60-43.1173.9-71.2-175.4179.51760111.8T58 N60 L66 F67 I68T58-K64 VanDerWaalsContact O-CE 3.29Å; T58-K64 WeakPolarHBondContact O-CE 3.47Å; N60-K64 PolarHBondContact O-N 3.06Å; K64-L66 VanDerWaalsContact C-N 3.33Å; K64-L66 PolarHBondContact O-N 3.11Å; K64-F67 PolarHBondContact O-N 2.99Å; K64-I68 WeakPolarHBondContact O-CD1 3.27Å; K64-I68 VanDerWaalsContact O-CG1 3.25Å; K64-I68 WeakPolarHBondContact O-CG1 3.33Å; K64-I68 PolarHBondContact O-N 3.26Å
65L60.6Low60.5Low107 Ų107111.7 Ų111.756%0.5656%0.562SS**Hα-helixtrans-63.7-38177.9-115.1144.1000112.4R61 F62 V63 I68 S69R61-L65 PolarHBondContact O-N 3.32Å; R61-L65 VanDerWaalsContact O-N 3.12Å; F62-L65 PolarHBondContact O-N 3.5Å; V63-L65 VanDerWaalsContact C-N 3.33Å; V63-L65 PolarHBondContact O-N 3.21Å; L65-I68 PolarHBondContact O-N 3.24Å; L65-S69 WeakPolarHBondContact O-CB 3.29Å; L65-S69 PolarHBondContact O-N 3.43Å; L65-S69 PolarHBondContact O-OG 3.01Å; L65-S69 VanDerWaalsContact O-OG 3.07Å
66L64.2Low61.8Low99 Ų99108.7 Ų108.752%0.51855%0.549SS..Hα-helixtrans-69.1-36.8179-151.2145000112.2F62 V63 K64 S69 L70F62-L66 PolarHBondContact O-N 3.25Å; V63-L66 PolarHBondContact O-N 3.49Å; K64-L66 VanDerWaalsContact C-N 3.33Å; K64-L66 PolarHBondContact O-N 3.11Å; L66-S69 WeakPolarHBondContact CA-OG 3.34Å; L66-S69 PolarHBondContact O-OG 3.36Å; L66-L70 VanDerWaalsContact O-CB 3.27Å; L66-L70 WeakPolarHBondContact O-CB 3.33Å; L66-L70 PolarHBondContact O-N 3.43Å
67F62.8Low62.7Low130 Ų130107 Ų10757%0.5754%0.544SS*.Hα-helixtrans-68.2-41.2171.6-91.8-81.8000112.5V63 K64 L70 Q71V63-F67 HydrophobicContact CG1-CD2 4.11Å; V63-F67 HydrophobicContact CG1-CE2 4.21Å; V63-F67 WeakPolarHBondContact O-CD2 3.47Å; V63-F67 PolarHBondContact O-N 3.36Å; V63-F67 VanDerWaalsContact O-N 3.08Å; K64-F67 PolarHBondContact O-N 2.99Å; F67-L70 PolarHBondContact O-N 3.27Å; F67-Q71 WeakPolarHBondContact O-CB 3.3Å; F67-Q71 PolarHBondContact O-N 3.22Å
68I64Low63.7Low110 Ų110106.3 Ų106.356%0.56454%0.539SS*.Hα-helixtrans-63.3-44.7176.9-67.7163.7000110.3K64 L65 Q71 V72K64-I68 WeakPolarHBondContact O-CD1 3.27Å; K64-I68 VanDerWaalsContact O-CG1 3.25Å; K64-I68 WeakPolarHBondContact O-CG1 3.33Å; K64-I68 PolarHBondContact O-N 3.26Å; L65-I68 PolarHBondContact O-N 3.24Å; I68-Q71 PolarHBondContact O-N 2.87Å; I68-V72 VanDerWaalsContact O-CG2 3.28Å; I68-V72 WeakPolarHBondContact O-CG2 3.4Å; I68-V72 PolarHBondContact O-N 3.42Å
69S61Low64.3Low53 Ų53110.1 Ų110.137%0.37154%0.541SS..Hα-helixtrans-66.3-40.4178.257.50000112L65 L66 Q71 V72 I73L65-S69 WeakPolarHBondContact O-CB 3.29Å; L65-S69 PolarHBondContact O-N 3.43Å; L65-S69 PolarHBondContact O-OG 3.01Å; L65-S69 VanDerWaalsContact O-OG 3.07Å; L66-S69 WeakPolarHBondContact CA-OG 3.34Å; L66-S69 PolarHBondContact O-OG 3.36Å; S69-Q71 VanDerWaalsContact C-N 3.34Å; S69-Q71 PolarHBondContact O-N 3Å; S69-V72 PolarHBondContact O-N 3.43Å; S69-I73 VanDerWaalsContact O-CG1 3.27Å; S69-I73 WeakPolarHBondContact O-CG1 3.36Å; S69-I73 PolarHBondContact O-N 3.42Å
70L68.7Low65.2Low100 Ų100110.1 Ų110.152%0.52453%0.533SS..Hα-helixtrans-61.1-42.9174-17267.5000111.6L66 F67 V72 I73 L74L66-L70 VanDerWaalsContact O-CB 3.27Å; L66-L70 WeakPolarHBondContact O-CB 3.33Å; L66-L70 PolarHBondContact O-N 3.43Å; F67-L70 PolarHBondContact O-N 3.27Å; L70-V72 PolarHBondContact O-N 3.46Å; L70-I73 PolarHBondContact O-N 2.98Å; L70-L74 WeakPolarHBondContact O-CB 3.45Å; L70-L74 PolarHBondContact O-N 3.49Å
71Q67.1Low65.9Low125 Ų125110.1 Ų110.158%0.58453%0.533SS*.Hα-helixtrans-64.7-38.8177.4-168117.21000112.3F67 I68 S69 N75F67-Q71 WeakPolarHBondContact O-CB 3.3Å; F67-Q71 PolarHBondContact O-N 3.22Å; I68-Q71 PolarHBondContact O-N 2.87Å; S69-Q71 VanDerWaalsContact C-N 3.34Å; S69-Q71 PolarHBondContact O-N 3Å; Q71-N75 WeakPolarHBondContact O-CB 3.24Å; Q71-N75 PolarHBondContact O-N 3.41Å; Q71-N75 PolarHBondContact O-ND2 3.42Å
72V68.7Low66.4Low93 Ų93104.8 Ų104.856%0.56452%0.52SS*.Hα-helixtrans-65.3-45.1176.31710000110.8I68 S69 L70 N75 F76I68-V72 VanDerWaalsContact O-CG2 3.28Å; I68-V72 WeakPolarHBondContact O-CG2 3.4Å; I68-V72 PolarHBondContact O-N 3.42Å; S69-V72 PolarHBondContact O-N 3.43Å; L70-V72 PolarHBondContact O-N 3.46Å; V72-N75 PolarHBondContact O-N 2.9Å; V72-F76 WeakPolarHBondContact O-CB 3.27Å; V72-F76 PolarHBondContact O-N 3.22Å
73I70.5Confident67.2Low103 Ų103101.9 Ų101.953%0.52851%0.511SS..Hα-helixtrans-62.9-46.2177.8-67164.3000110.1S69 L70 N75 F76 V77S69-I73 VanDerWaalsContact O-CG1 3.27Å; S69-I73 WeakPolarHBondContact O-CG1 3.36Å; S69-I73 PolarHBondContact O-N 3.42Å; L70-I73 PolarHBondContact O-N 2.98Å; I73-N75 PolarHBondContact O-N 2.72Å; I73-F76 WeakPolarHBondContact O-CB 3.49Å; I73-F76 PolarHBondContact O-N 3.29Å; I73-F76 VanDerWaalsContact O-N 3.15Å; I73-V77 HydrophobicContact CG2-CG2 4.45Å; I73-V77 WeakPolarHBondContact O-CG2 3.31Å; I73-V77 PolarHBondContact O-N 2.71Å
74L71.1Confident67.9Low105 Ų105105.4 Ų105.455%0.5552%0.52SS..Hα-helixtrans-62.1-44.9179.9-164.875.3000111.7L70 F76 V77 I78L70-L74 WeakPolarHBondContact O-CB 3.45Å; L70-L74 PolarHBondContact O-N 3.49Å; L74-F76 VanDerWaalsContact C-N 3.28Å; L74-F76 PolarHBondContact O-N 2.91Å; L74-V77 PolarHBondContact O-N 3.21Å; L74-I78 HydrophobicContact CG-CD1 4.16Å; L74-I78 VanDerWaalsContact O-CG1 3.3Å; L74-I78 WeakPolarHBondContact O-CG1 3.32Å; L74-I78 PolarHBondContact O-N 3.22Å
75N69.1Low68.1Low88 Ų88102.4 Ų102.447%0.47151%0.513SS..Hα-helixtrans-61.5-36.8175.3-90-36.9000112.5Q71 V72 I73 R79Q71-N75 WeakPolarHBondContact O-CB 3.24Å; Q71-N75 PolarHBondContact O-N 3.41Å; Q71-N75 PolarHBondContact O-ND2 3.42Å; V72-N75 PolarHBondContact O-N 2.9Å; I73-N75 PolarHBondContact O-N 2.72Å; N75-R79 WeakPolarHBondContact O-CB 3.43Å; N75-R79 WeakPolarHBondContact O-CG 3.46Å; N75-R79 PolarHBondContact O-N 3.21Å
76F74.2Confident68.3Low135 Ų135101.4 Ų101.459%0.59251%0.507SS*.Hα-helixtrans-66.6-44.9176.6-174.5-105.4000111.8V72 I73 L74 I78 R79 I80V72-F76 WeakPolarHBondContact O-CB 3.27Å; V72-F76 PolarHBondContact O-N 3.22Å; I73-F76 WeakPolarHBondContact O-CB 3.49Å; I73-F76 PolarHBondContact O-N 3.29Å; I73-F76 VanDerWaalsContact O-N 3.15Å; L74-F76 VanDerWaalsContact C-N 3.28Å; L74-F76 PolarHBondContact O-N 2.91Å; F76-I78 PolarHBondContact O-N 3.36Å; F76-R79 PolarHBondContact O-N 2.92Å; F76-I80 HydrophobicContact CD1-CD1 3.78Å; F76-I80 HydrophobicContact CE1-CD1 3.27Å; F76-I80 HydrophobicContact CE1-CG1 4.37Å; F76-I80 HydrophobicContact CE2-CD1 4.33Å; F76-I80 HydrophobicContact CZ-CD1 3.59Å; F76-I80 HydrophobicContact CZ-CG1 4.42Å; F76-I80 PolarHBondContact O-N 3.12Å
77V70Confident68Low68 Ų68105.4 Ų105.441%0.41252%0.516SS..Hα-helixtrans-60.7-46176.2173.20000111I73 L74 R79 I80 L81I73-V77 HydrophobicContact CG2-CG2 4.45Å; I73-V77 WeakPolarHBondContact O-CG2 3.31Å; I73-V77 PolarHBondContact O-N 2.71Å; L74-V77 PolarHBondContact O-N 3.21Å; V77-R79 VanDerWaalsContact C-N 3.33Å; V77-R79 PolarHBondContact O-N 2.81Å; V77-I80 PolarHBondContact O-N 2.99Å; V77-L81 HydrophobicContact CG1-CD1 3.96Å; V77-L81 WeakPolarHBondContact O-CG 3.42Å; V77-L81 PolarHBondContact O-N 3.26Å
78I71.6Confident68.2Low84 Ų84102.4 Ų102.443%0.43151%0.505SS..Hα-helixtrans-61.1-42.7178-68166.4000110.8L74 F76 I80 L81 L82L74-I78 HydrophobicContact CG-CD1 4.16Å; L74-I78 VanDerWaalsContact O-CG1 3.3Å; L74-I78 WeakPolarHBondContact O-CG1 3.32Å; L74-I78 PolarHBondContact O-N 3.22Å; F76-I78 PolarHBondContact O-N 3.36Å; I78-I80 PolarHBondContact O-N 2.9Å; I78-L81 PolarHBondContact O-N 3.4Å; I78-L82 WeakPolarHBondContact O-CB 3.3Å; I78-L82 PolarHBondContact O-N 2.94Å
79R66.8Low67.9Low189 Ų189100.7 Ų100.771%0.71350%0.497SS*.Hα-helixtrans-61.3-43.5177.2-82.5-177.4168.6-157-2.4112.4N75 F76 V77 L82 I83N75-R79 WeakPolarHBondContact O-CB 3.43Å; N75-R79 WeakPolarHBondContact O-CG 3.46Å; N75-R79 PolarHBondContact O-N 3.21Å; F76-R79 PolarHBondContact O-N 2.92Å; V77-R79 VanDerWaalsContact C-N 3.33Å; V77-R79 PolarHBondContact O-N 2.81Å; R79-L82 PolarHBondContact O-N 2.94Å; R79-I83 VanDerWaalsContact O-CG1 3.28Å; R79-I83 WeakPolarHBondContact O-CG1 3.36Å; R79-I83 PolarHBondContact O-N 3.49Å
80I74.4Confident68Low85 Ų85102 Ų10244%0.43650%0.499SS..Hα-helixtrans-64-46.2177.6-69.9174.2000110.6F76 V77 I78 L82 I83 W84F76-I80 HydrophobicContact CD1-CD1 3.78Å; F76-I80 HydrophobicContact CE1-CD1 3.27Å; F76-I80 HydrophobicContact CE1-CG1 4.37Å; F76-I80 HydrophobicContact CE2-CD1 4.33Å; F76-I80 HydrophobicContact CZ-CD1 3.59Å; F76-I80 HydrophobicContact CZ-CG1 4.42Å; F76-I80 PolarHBondContact O-N 3.12Å; V77-I80 PolarHBondContact O-N 2.99Å; I78-I80 PolarHBondContact O-N 2.9Å; I80-L82 VanDerWaalsContact C-N 3.3Å; I80-L82 PolarHBondContact O-N 2.91Å; I80-I83 PolarHBondContact O-N 3.26Å; I80-W84 WeakPolarHBondContact O-CB 3.43Å; I80-W84 PolarHBondContact O-N 3.47Å
81L71.3Confident67.6Low96 Ų96100.5 Ų100.550%0.50349%0.487SS..Hα-helixtrans-59.5-41.7176.9-76.5169.7000111.7V77 I78 W84 V85V77-L81 HydrophobicContact CG1-CD1 3.96Å; V77-L81 WeakPolarHBondContact O-CG 3.42Å; V77-L81 PolarHBondContact O-N 3.26Å; I78-L81 PolarHBondContact O-N 3.4Å; L81-W84 WeakPolarHBondContact O-CB 3.28Å; L81-W84 PolarHBondContact O-N 3.38Å; L81-V85 WeakPolarHBondContact O-CG2 3.17Å; L81-V85 PolarHBondContact O-N 3Å
82L65.4Low67.2Low103 Ų10397.3 Ų97.354%0.53947%0.473SS..Hα-helixtrans-67.7-42.3-179-155.8128.8000111.7I78 R79 I80 W84 V85 I86I78-L82 WeakPolarHBondContact O-CB 3.3Å; I78-L82 PolarHBondContact O-N 2.94Å; R79-L82 PolarHBondContact O-N 2.94Å; I80-L82 VanDerWaalsContact C-N 3.3Å; I80-L82 PolarHBondContact O-N 2.91Å; L82-W84 VanDerWaalsContact C-N 3.27Å; L82-W84 PolarHBondContact O-N 2.96Å; L82-V85 PolarHBondContact O-N 3.37Å; L82-I86 HydrophobicContact CD2-CD1 3.69Å; L82-I86 VanDerWaalsContact O-CG1 3.27Å; L82-I86 WeakPolarHBondContact O-CG1 3.37Å; L82-I86 PolarHBondContact O-N 2.88Å
83I71.3Confident66.7Low103 Ų10399.8 Ų99.853%0.52848%0.483SS..Hα-helixtrans-61-40.4172.9-67.8164.7000110.3R79 I80 I86 R87R79-I83 VanDerWaalsContact O-CG1 3.28Å; R79-I83 WeakPolarHBondContact O-CG1 3.36Å; R79-I83 PolarHBondContact O-N 3.49Å; I80-I83 PolarHBondContact O-N 3.26Å; I83-I86 PolarHBondContact O-N 3.38Å; I83-R87 HydrophobicContact CG2-CG 4.32Å; I83-R87 WeakPolarHBondContact O-CB 3.3Å; I83-R87 VanDerWaalsContact O-CG 3.24Å; I83-R87 WeakPolarHBondContact O-CG 3.26Å; I83-R87 PolarHBondContact O-N 2.96Å
84W73.4Confident66.3Low106 Ų106101 Ų10140%0.40249%0.487SS..Hα-helixtrans-64.2-47.5178.9-173.183000112.1I80 L81 L82 I86 R87 I88 L116I80-W84 WeakPolarHBondContact O-CB 3.43Å; I80-W84 PolarHBondContact O-N 3.47Å; L81-W84 WeakPolarHBondContact O-CB 3.28Å; L81-W84 PolarHBondContact O-N 3.38Å; L82-W84 VanDerWaalsContact C-N 3.27Å; L82-W84 PolarHBondContact O-N 2.96Å; W84-I86 VanDerWaalsContact C-N 3.33Å; W84-I86 PolarHBondContact O-N 3.39Å; W84-R87 PolarHBondContact O-N 3.41Å; W84-I88 HydrophobicContact CD2-CD1 3.58Å; W84-I88 HydrophobicContact CD2-CG1 4.5Å; W84-I88 HydrophobicContact CE3-CD1 3.61Å; W84-I88 HydrophobicContact CG-CD1 4.47Å; W84-I88 HydrophobicContact CH2-CD1 3.29Å; W84-I88 HydrophobicContact CZ2-CD1 3.27Å; W84-I88 HydrophobicContact CZ3-CD1 3.46Å; W84-I88 VanDerWaalsContact CZ3-CD1 3.46Å; W84-I88 WeakPolarHBondContact O-CG1 3.36Å; W84-I88 PolarHBondContact O-N 3.47Å; W84-L116 HydrophobicContact CZ2-CD1 3.84Å; W84-L116 HydrophobicContact CZ2-CD2 3.64Å; W84-L116 HydrophobicContact CZ2-CG 4.43Å
85V64Low65.6Low69 Ų69100 Ų10042%0.41848%0.478SS..Hα-helixtrans-61.3-40.9176.2171.70000111.4L81 L82 I88 N89L81-V85 WeakPolarHBondContact O-CG2 3.17Å; L81-V85 PolarHBondContact O-N 3Å; L82-V85 PolarHBondContact O-N 3.37Å; V85-I88 PolarHBondContact O-N 3.28Å; V85-N89 PolarHBondContact O-N 3.02Å; V85-N89 PolarHBondContact O-ND2 2.93Å
86I64.4Low64.9Low85 Ų8599.6 Ų99.644%0.43648%0.481SS..Hα-helixtrans-65.3-44.2176.4-68.9168.5000110.6L82 I83 W84 I88 N89 I90L82-I86 HydrophobicContact CD2-CD1 3.69Å; L82-I86 VanDerWaalsContact O-CG1 3.27Å; L82-I86 WeakPolarHBondContact O-CG1 3.37Å; L82-I86 PolarHBondContact O-N 2.88Å; I83-I86 PolarHBondContact O-N 3.38Å; W84-I86 VanDerWaalsContact C-N 3.33Å; W84-I86 PolarHBondContact O-N 3.39Å; I86-I88 VanDerWaalsContact C-N 3.33Å; I86-I88 PolarHBondContact O-N 3.03Å; I86-N89 PolarHBondContact O-N 3.35Å; I86-I90 HydrophobicContact CG2-CD1 3.63Å; I86-I90 HydrophobicContact CG2-CG1 4.29Å; I86-I90 VanDerWaalsContact O-CG1 3.29Å; I86-I90 WeakPolarHBondContact O-CG1 3.26Å; I86-I90 PolarHBondContact O-N 3.06Å
87R58.6Low63.9Low184 Ų184101.2 Ų101.269%0.69449%0.49SS*.Hα-helixtrans-61.8-39.2178.6-78.7-82.6-169.8165.51.7112.3I83 W84 Y91I83-R87 HydrophobicContact CG2-CG 4.32Å; I83-R87 WeakPolarHBondContact O-CB 3.3Å; I83-R87 VanDerWaalsContact O-CG 3.24Å; I83-R87 WeakPolarHBondContact O-CG 3.26Å; I83-R87 PolarHBondContact O-N 2.96Å; W84-R87 PolarHBondContact O-N 3.41Å; R87-Y91 WeakPolarHBondContact O-CB 3.27Å; R87-Y91 PolarHBondContact O-N 3.27Å
88I65.7Low63Low67 Ų67100.4 Ų100.434%0.34448%0.483SS..Hα-helixtrans-66.3-48.9175.6-72.6173000110.7W84 V85 I86 I90 Y91 D92 L116W84-I88 HydrophobicContact CD2-CD1 3.58Å; W84-I88 HydrophobicContact CD2-CG1 4.5Å; W84-I88 HydrophobicContact CE3-CD1 3.61Å; W84-I88 HydrophobicContact CG-CD1 4.47Å; W84-I88 HydrophobicContact CH2-CD1 3.29Å; W84-I88 HydrophobicContact CZ2-CD1 3.27Å; W84-I88 HydrophobicContact CZ3-CD1 3.46Å; W84-I88 VanDerWaalsContact CZ3-CD1 3.46Å; W84-I88 WeakPolarHBondContact O-CG1 3.36Å; W84-I88 PolarHBondContact O-N 3.47Å; V85-I88 PolarHBondContact O-N 3.28Å; I86-I88 VanDerWaalsContact C-N 3.33Å; I86-I88 PolarHBondContact O-N 3.03Å; I88-I90 VanDerWaalsContact C-N 3.31Å; I88-I90 PolarHBondContact O-N 3.43Å; I88-Y91 PolarHBondContact O-N 3.36Å; I88-Y91 VanDerWaalsContact O-N 3.11Å; I88-D92 WeakPolarHBondContact O-CB 3.5Å; I88-D92 PolarHBondContact O-N 2.89Å; I88-L116 HydrophobicContact CD1-CD2 4.45Å
89N58.8Low61.6Low74 Ų74101.2 Ų101.240%0.39649%0.485SS..Hα-helixtrans-60.9-40.2179.5-79.1-64.7000112.2V85 I86 Y91 D92 L93V85-N89 PolarHBondContact O-N 3.02Å; V85-N89 PolarHBondContact O-ND2 2.93Å; I86-N89 PolarHBondContact O-N 3.35Å; N89-Y91 VanDerWaalsContact C-N 3.33Å; N89-D92 PolarHBondContact O-N 2.8Å; N89-L93 WeakPolarHBondContact O-CB 3.42Å; N89-L93 WeakPolarHBondContact O-CD1 3.27Å; N89-L93 PolarHBondContact O-N 3.34Å
90I62.6Low60.2Low81 Ų81100 Ų10042%0.41549%0.485SS..Hα-helixtrans-64.6-41.1176.3-68.8169.4000110.7I86 I88 L93 Q94I86-I90 HydrophobicContact CG2-CD1 3.63Å; I86-I90 HydrophobicContact CG2-CG1 4.29Å; I86-I90 VanDerWaalsContact O-CG1 3.29Å; I86-I90 WeakPolarHBondContact O-CG1 3.26Å; I86-I90 PolarHBondContact O-N 3.06Å; I88-I90 VanDerWaalsContact C-N 3.31Å; I88-I90 PolarHBondContact O-N 3.43Å; I90-L93 PolarHBondContact O-N 2.87Å; I90-Q94 HydrophobicContact CG2-CG 4.4Å; I90-Q94 WeakPolarHBondContact O-CB 3.43Å; I90-Q94 VanDerWaalsContact O-CG 3.26Å; I90-Q94 WeakPolarHBondContact O-CG 3.4Å; I90-Q94 PolarHBondContact O-N 2.87Å
91Y59.9Low58.7Low68 Ų68101.6 Ų101.627%0.26749%0.493SS..Hα-helixtrans-66.4-40.3179-175.3-111.5000112.3R87 I88 N89 L93 Q94 H95 I98 R119R87-Y91 WeakPolarHBondContact O-CB 3.27Å; R87-Y91 PolarHBondContact O-N 3.27Å; I88-Y91 PolarHBondContact O-N 3.36Å; I88-Y91 VanDerWaalsContact O-N 3.11Å; N89-Y91 VanDerWaalsContact C-N 3.33Å; Y91-L93 VanDerWaalsContact C-N 3.34Å; Y91-Q94 PolarHBondContact O-N 3.49Å; Y91-Q94 VanDerWaalsContact O-N 3.15Å; Y91-H95 AromaticContact CD2-CD2 3.43Å; Y91-H95 VanDerWaalsContact CD2-CD2 3.43Å; Y91-H95 WeakPolarHBondContact CD2-CD2 3.35Å; Y91-H95 AromaticContact CD2-NE2 3.92Å; Y91-H95 AromaticContact CE2-CD2 3Å; Y91-H95 WeakPolarHBondContact CE2-CD2 3.18Å; Y91-H95 AromaticContact CE2-NE2 3.31Å; Y91-H95 VanDerWaalsContact CE2-NE2 3.31Å; Y91-H95 WeakPolarHBondContact CE2-NE2 3.35Å; Y91-H95 AromaticContact CZ-CD2 3.58Å; Y91-H95 PolarHBondContact O-N 3.4Å; Y91-I98 HydrophobicContact CE1-CD1 3.9Å; Y91-R119 VanDerWaalsContact CZ-NH2 3.29Å
92D58.9Low57.4Low57 Ų57102.1 Ų102.131%0.30549%0.492SS..Hα-helixtrans-64.1-39.8176.4-162.138.7000111.5I88 N89 Q94 H95 H99I88-D92 WeakPolarHBondContact O-CB 3.5Å; I88-D92 PolarHBondContact O-N 2.89Å; N89-D92 PolarHBondContact O-N 2.8Å; D92-Q94 VanDerWaalsContact C-N 3.33Å; D92-Q94 PolarHBondContact O-N 2.87Å; D92-H95 CarbonylContact O-C 3.47Å; D92-H95 PolarHBondContact O-N 3.49Å; D92-H99 IonicContact OD1-CD2 3.28Å; D92-H99 PolarHBondContact OD1-CD2 2.99Å; D92-H99 VanDerWaalsContact OD1-CD2 3.28Å; D92-H99 IonicContact OD2-CD2 3.46Å; D92-H99 PolarHBondContact OD2-CD2 2.64Å; D92-H99 IonicContact OD2-NE2 3.56Å
93L59.4Low56.4Low146 Ų146103.1 Ų103.176%0.76449%0.494SS*.Hα-helixtrans-64.9-32.2171.2-99.1138.6000113.7N89 I90 Y91N89-L93 WeakPolarHBondContact O-CB 3.42Å; N89-L93 WeakPolarHBondContact O-CD1 3.27Å; N89-L93 PolarHBondContact O-N 3.34Å; I90-L93 PolarHBondContact O-N 2.87Å; Y91-L93 VanDerWaalsContact C-N 3.34Å
94Q60.6Low54.8Low129 Ų129103.9 Ų103.960%0.60350%0.499SS*.Hα-helixtrans-83-23.3-179.1-76.4177.1-18.400113.2I90 Y91 D92 P96I90-Q94 HydrophobicContact CG2-CG 4.4Å; I90-Q94 WeakPolarHBondContact O-CB 3.43Å; I90-Q94 VanDerWaalsContact O-CG 3.26Å; I90-Q94 WeakPolarHBondContact O-CG 3.4Å; I90-Q94 PolarHBondContact O-N 2.87Å; Y91-Q94 PolarHBondContact O-N 3.49Å; Y91-Q94 VanDerWaalsContact O-N 3.15Å; D92-Q94 VanDerWaalsContact C-N 3.33Å; D92-Q94 PolarHBondContact O-N 2.87Å; Q94-P96 VanDerWaalsContact C-CD 3.49Å
95H57.8Low53.3Low82 Ų82105.9 Ų105.938%0.3852%0.518SS..  trans-130.866179.8-60.6-79.1000111.6Y91 D92 E97 I98Y91-H95 AromaticContact CD2-CD2 3.43Å; Y91-H95 VanDerWaalsContact CD2-CD2 3.43Å; Y91-H95 WeakPolarHBondContact CD2-CD2 3.35Å; Y91-H95 AromaticContact CD2-NE2 3.92Å; Y91-H95 AromaticContact CE2-CD2 3Å; Y91-H95 WeakPolarHBondContact CE2-CD2 3.18Å; Y91-H95 AromaticContact CE2-NE2 3.31Å; Y91-H95 VanDerWaalsContact CE2-NE2 3.31Å; Y91-H95 WeakPolarHBondContact CE2-NE2 3.35Å; Y91-H95 AromaticContact CZ-CD2 3.58Å; Y91-H95 PolarHBondContact O-N 3.4Å; D92-H95 CarbonylContact O-C 3.47Å; D92-H95 PolarHBondContact O-N 3.49Å; H95-E97 PolarHBondContact O-N 2.77Å; H95-I98 HydrophobicContact CB-CD1 3.57Å; H95-I98 HydrophobicContact CB-CG1 3.89Å; H95-I98 PolarHBondContact O-N 2.92Å; H95-I98 VanDerWaalsContact O-N 3.13Å
96P54.8Low52.1Low81 Ų81114.1 Ų114.153%0.52654%0.543SS..THydrogen-bonded Turntrans-61.9-17.4-179.526.7-35000113Q94 I98 H99Q94-P96 VanDerWaalsContact C-CD 3.49Å; P96-I98 VanDerWaalsContact C-N 3.32Å; P96-I98 PolarHBondContact O-N 3.11Å; P96-H99 WeakPolarHBondContact O-CB 3.36Å; P96-H99 PolarHBondContact O-N 3.18Å
97E51.4Low51.4Low168 Ų168113.1 Ų113.179%0.78554%0.538SS*.THydrogen-bonded Turntrans-68-28.1177.9-57.5-175.1-165.500113.1H95 H99 F100H95-E97 PolarHBondContact O-N 2.77Å; E97-H99 PolarHBondContact O-N 2.86Å; E97-F100 PolarHBondContact O-N 2.93Å
98I51.1Low50.5Low52 Ų52106.9 Ų106.927%0.26752%0.522SS..THydrogen-bonded Turntrans-72.4-25.5178.1-47.3174.2000109.9Y91 H95 P96 F100 I101 F102Y91-I98 HydrophobicContact CE1-CD1 3.9Å; H95-I98 HydrophobicContact CB-CD1 3.57Å; H95-I98 HydrophobicContact CB-CG1 3.89Å; H95-I98 PolarHBondContact O-N 2.92Å; H95-I98 VanDerWaalsContact O-N 3.13Å; P96-I98 VanDerWaalsContact C-N 3.32Å; P96-I98 PolarHBondContact O-N 3.11Å; I98-F100 PolarHBondContact O-N 3.44Å; I98-F100 VanDerWaalsContact O-N 3.14Å; I98-I101 PolarHBondContact O-N 3.46Å; I98-F102 HydrophobicContact CB-CE2 4.39Å; I98-F102 HydrophobicContact CG2-CD2 3.96Å; I98-F102 HydrophobicContact CG2-CE2 3.49Å; I98-F102 VanDerWaalsContact CG2-CE2 3.49Å; I98-F102 HydrophobicContact CG2-CZ 4.49Å; I98-F102 WeakPolarHBondContact O-CD2 3.26Å; I98-F102 PolarHBondContact O-N 2.88Å
99H43.8Very low49.4Very low100 Ų100108.6 Ų108.646%0.46354%0.538SS..Hα-helixtrans-61.1-24.3179-139.5-57.6000112.9D92 P96 E97D92-H99 IonicContact OD1-CD2 3.28Å; D92-H99 PolarHBondContact OD1-CD2 2.99Å; D92-H99 VanDerWaalsContact OD1-CD2 3.28Å; D92-H99 IonicContact OD2-CD2 3.46Å; D92-H99 PolarHBondContact OD2-CD2 2.64Å; D92-H99 IonicContact OD2-NE2 3.56Å; P96-H99 WeakPolarHBondContact O-CB 3.36Å; P96-H99 PolarHBondContact O-N 3.18Å; E97-H99 PolarHBondContact O-N 2.86Å
100F37.3Very low48.7Very low164 Ų164109.6 Ų109.672%0.71955%0.547SS*.Hα-helixtrans-76.3-21.6173.5-95.2-84000114.1E97 I98E97-F100 PolarHBondContact O-N 2.93Å; I98-F100 PolarHBondContact O-N 3.44Å; I98-F100 VanDerWaalsContact O-N 3.14Å
101I42.9Very low47.9Very low118 Ų118109.1 Ų109.161%0.60555%0.547SS*.Hα-helixtrans-83.3-26.6174.5-54.7174.5000110.2I98 N104I98-I101 PolarHBondContact O-N 3.46Å; I101-N104 VanDerWaalsContact O-O 3.13Å
102F44.2Very low47.3Very low107 Ų107110 Ų11047%0.46956%0.556SS.*Hα-helixtrans-75.8-19.6179.5-80-78.2000114.7I98 I107I98-F102 HydrophobicContact CB-CE2 4.39Å; I98-F102 HydrophobicContact CG2-CD2 3.96Å; I98-F102 HydrophobicContact CG2-CE2 3.49Å; I98-F102 VanDerWaalsContact CG2-CE2 3.49Å; I98-F102 HydrophobicContact CG2-CZ 4.49Å; I98-F102 WeakPolarHBondContact O-CD2 3.26Å; I98-F102 PolarHBondContact O-N 2.88Å; F102-I107 HydrophobicContact CD1-CD1 3.31Å; F102-I107 HydrophobicContact CE1-CD1 3.18Å; F102-I107 HydrophobicContact CG-CD1 4.2Å; F102-I107 HydrophobicContact CZ-CD1 4Å
103E42.6Very low46.6Very low124 Ų124111.6 Ų111.658%0.57956%0.56SS**SBendtrans-82.7-17.8-176.9-136171.1-169.300112.8L2L2-E103 WeakPolarHBondContact CD1-OE1 3.42Å
104N38.3Very low46Very low119 Ų119109 Ų10964%0.63655%0.551SS**SBendtrans-121.5115176.7-72.6-28.2000109.9I101I101-N104 VanDerWaalsContact O-O 3.13Å
105D41.3Very low45.7Very low149 Ų149107.6 Ų107.680%0.79755%0.546SS*.SBendtrans76.1102.4163.1-54.4-37.5000118.5I107D105-I107 PolarHBondContact O-N 3.01Å
106Y40Very low45.1Very low242 Ų242105.2 Ų105.295%0.94954%0.536SS*.  trans9.1100.1153.5-101.7-97000116.8
107I49Very low44.9Very low64 Ų64105.3 Ų105.333%0.32853%0.532SS..  trans-85.9122167.1-65.4168.1000108.4F102 D105 V111F102-I107 HydrophobicContact CD1-CD1 3.31Å; F102-I107 HydrophobicContact CE1-CD1 3.18Å; F102-I107 HydrophobicContact CG-CD1 4.2Å; F102-I107 HydrophobicContact CZ-CD1 4Å; D105-I107 PolarHBondContact O-N 3.01Å; I107-V111 HydrophobicContact CG2-CB 3.81Å; I107-V111 HydrophobicContact CG2-CG1 4Å
108S40.5Very low44.8Very low52 Ų52101.5 Ų101.536%0.36452%0.522SS..  trans-62.4142.2176.296.70000110T110 V111 L112S108-T110 PolarHBondContact O-N 3.4Å; S108-T110 WeakPolarHBondContact OG-CB 3.17Å; S108-T110 PolarHBondContact OG-N 3.41Å; S108-T110 PolarHBondContact OG-OG1 2.97Å; S108-V111 PolarHBondContact O-N 2.96Å; S108-L112 PolarHBondContact O-N 2.89Å
109P43.2Very low44.5Very low104 Ų104105.9 Ų105.968%0.67554%0.535SS*.Hα-helixtrans-54.9-23.717818.6-29.7000112.3L112 F113P109-L112 PolarHBondContact O-N 3.46Å; P109-F113 WeakPolarHBondContact O-CB 3.47Å; P109-F113 PolarHBondContact O-N 3.37Å
110T42.9Very low44.6Very low95 Ų95105.1 Ų105.158%0.58353%0.534SS*.Hα-helixtrans-64.1-42.7173.7-29.10000112.5S108 F113 T114S108-T110 PolarHBondContact O-N 3.4Å; S108-T110 WeakPolarHBondContact OG-CB 3.17Å; S108-T110 PolarHBondContact OG-N 3.41Å; S108-T110 PolarHBondContact OG-OG1 2.97Å; T110-F113 PolarHBondContact O-N 3.46Å; T110-T114 WeakPolarHBondContact O-CB 3.48Å; T110-T114 PolarHBondContact O-N 3.15Å; T110-T114 PolarHBondContact O-OG1 3.27Å
111V45.7Very low44.7Very low70 Ų70100.8 Ų100.842%0.42453%0.528SS..Hα-helixtrans-71.1-38.5178.5176.50000110.7I107 S108 F113 T114 I115I107-V111 HydrophobicContact CG2-CB 3.81Å; I107-V111 HydrophobicContact CG2-CG1 4Å; S108-V111 PolarHBondContact O-N 2.96Å; V111-F113 VanDerWaalsContact C-N 3.31Å; V111-F113 PolarHBondContact O-N 3.45Å; V111-T114 PolarHBondContact O-N 2.98Å; V111-I115 HydrophobicContact CG1-CD1 3.79Å; V111-I115 HydrophobicContact CG1-CG1 4.37Å; V111-I115 WeakPolarHBondContact O-CG1 3.38Å; V111-I115 PolarHBondContact O-N 3.32Å
112L47.6Very low44.9Very low87 Ų8798.8 Ų98.846%0.45552%0.518SS..Hα-helixtrans-57.6-47.1171.3-158.183.6000110.1S108 P109 T114 L116S108-L112 PolarHBondContact O-N 2.89Å; P109-L112 PolarHBondContact O-N 3.46Å; L112-T114 PolarHBondContact O-N 2.9Å; L112-L116 HydrophobicContact CD2-CD1 4.23Å; L112-L116 HydrophobicContact CG-CD1 3.91Å; L112-L116 WeakPolarHBondContact O-CB 3.36Å; L112-L116 WeakPolarHBondContact O-CD1 3.32Å; L112-L116 WeakPolarHBondContact O-CG 2.85Å; L112-L116 PolarHBondContact O-N 3.49Å
113F45.2Very low44.8Very low90 Ų9097.6 Ų97.640%0.39552%0.521SS..Hα-helixtrans-64.8-36.9176.5-124.8-96.7000113.2P109 T110 V111 L116 L117 A144P109-F113 WeakPolarHBondContact O-CB 3.47Å; P109-F113 PolarHBondContact O-N 3.37Å; T110-F113 PolarHBondContact O-N 3.46Å; V111-F113 VanDerWaalsContact C-N 3.31Å; V111-F113 PolarHBondContact O-N 3.45Å; F113-L116 PolarHBondContact O-N 2.97Å; F113-L117 HydrophobicContact CD1-CD1 3.46Å; F113-L117 VanDerWaalsContact CD1-CD1 3.46Å; F113-L117 HydrophobicContact CE1-CD1 3.93Å; F113-L117 WeakPolarHBondContact O-CB 3.28Å; F113-L117 WeakPolarHBondContact O-CD1 3.33Å; F113-L117 PolarHBondContact O-N 3.4Å; F113-A144 HydrophobicContact CE1-CB 4.24Å
114T46.6Very low44.8Very low91 Ų9196.9 Ų96.956%0.55853%0.53SS*.Hα-helixtrans-74.8-31.9-177.7-470000111.9T110 V111 L112 P118T110-T114 WeakPolarHBondContact O-CB 3.48Å; T110-T114 PolarHBondContact O-N 3.15Å; T110-T114 PolarHBondContact O-OG1 3.27Å; V111-T114 PolarHBondContact O-N 2.98Å; L112-T114 PolarHBondContact O-N 2.9Å; T114-P118 WeakPolarHBondContact O-CD 3.41Å
115I52.7Low45Very low100 Ų10095.7 Ų95.751%0.51353%0.531SS..Hα-helixtrans-76-29.7170.8-64.2169.1000110.8V111V111-I115 HydrophobicContact CG1-CD1 3.79Å; V111-I115 HydrophobicContact CG1-CG1 4.37Å; V111-I115 WeakPolarHBondContact O-CG1 3.38Å; V111-I115 PolarHBondContact O-N 3.32Å
116L47.1Very low45Very low33 Ų3394.9 Ų94.917%0.17353%0.526CS..Hα-helixtrans-80.1-32.2178.7-76.6165.3000113.9W84 I88 L112 F113 R119 L120W84-L116 HydrophobicContact CZ2-CD1 3.84Å; W84-L116 HydrophobicContact CZ2-CD2 3.64Å; W84-L116 HydrophobicContact CZ2-CG 4.43Å; I88-L116 HydrophobicContact CD1-CD2 4.45Å; L112-L116 HydrophobicContact CD2-CD1 4.23Å; L112-L116 HydrophobicContact CG-CD1 3.91Å; L112-L116 WeakPolarHBondContact O-CB 3.36Å; L112-L116 WeakPolarHBondContact O-CD1 3.32Å; L112-L116 WeakPolarHBondContact O-CG 2.85Å; L112-L116 PolarHBondContact O-N 3.49Å; F113-L116 PolarHBondContact O-N 2.97Å; L116-R119 PolarHBondContact O-N 3.45Å; L116-L120 PolarHBondContact O-N 2.87Å
117L50.5Low44.9Very low82 Ų8286 Ų8643%0.42949%0.492SS..G310 helixtrans-57.7-43.9-176.7-124.493.5000114F113 R119 L120F113-L117 HydrophobicContact CD1-CD1 3.46Å; F113-L117 VanDerWaalsContact CD1-CD1 3.46Å; F113-L117 HydrophobicContact CE1-CD1 3.93Å; F113-L117 WeakPolarHBondContact O-CB 3.28Å; F113-L117 WeakPolarHBondContact O-CD1 3.33Å; F113-L117 PolarHBondContact O-N 3.4Å; L117-R119 PolarHBondContact O-N 3.41Å; L117-L120 PolarHBondContact O-N 3.46Å
118P47.8Very low44.5Very low89 Ų8994.4 Ų94.458%0.57852%0.52SS*.G310 helixtrans-64.9-21.5177.6-2030.8000113T114 A121T114-P118 WeakPolarHBondContact O-CD 3.41Å; P118-A121 WeakPolarHBondContact O-CB 3.47Å; P118-A121 PolarHBondContact O-N 2.87Å
119R44.7Very low44.6Very low143 Ų143100.5 Ų100.554%0.5454%0.54SS..G310 helixtrans-92.8-13.4-178.4-64.9-163.1174-175.5-1.3114.3Y91 L116 L117Y91-R119 VanDerWaalsContact CZ-NH2 3.29Å; L116-R119 PolarHBondContact O-N 3.45Å; L117-R119 PolarHBondContact O-N 3.41Å
120L45.6Very low44.3Very low85 Ų8598.7 Ų98.745%0.44554%0.54SS..SBendtrans-81.8-1161.8-87.3158.8000112.4L116 L117 I122L116-L120 PolarHBondContact O-N 2.87Å; L117-L120 PolarHBondContact O-N 3.46Å; L120-I122 PolarHBondContact O-N 3.13Å
121A41.3Very low44.5Very low72 Ų72100.1 Ų100.160%0.59554%0.544SS*.  trans-64.785.4166.400000108.6P118P118-A121 WeakPolarHBondContact O-CB 3.47Å; P118-A121 PolarHBondContact O-N 2.87Å
122I46.4Very low44.2Very low76 Ų76102.2 Ų102.239%0.3955%0.549SS..  trans-36130.5159.9-65.6158.6000106.7L120 S124 L126 F127L120-I122 PolarHBondContact O-N 3.13Å; I122-S124 PolarHBondContact O-N 2.85Å; I122-S124 VanDerWaalsContact O-N 3.12Å; I122-L126 HydrophobicContact CG2-CB 3.84Å; I122-L126 HydrophobicContact CG2-CD1 3.63Å; I122-L126 HydrophobicContact CG2-CG 4.38Å; I122-F127 HydrophobicContact CB-CD2 4.28Å; I122-F127 HydrophobicContact CB-CE2 3.79Å; I122-F127 HydrophobicContact CD1-CE2 3.69Å; I122-F127 HydrophobicContact CD1-CZ 4.12Å; I122-F127 HydrophobicContact CG1-CE2 4.34Å; I122-F127 HydrophobicContact CG2-CD2 4.07Å; I122-F127 HydrophobicContact CG2-CE2 3.73Å
123P41.3Very low44Very low83 Ų83100.5 Ų100.554%0.53954%0.544SS..  trans-49.9128.7-174.521-32.5000108.5S125 L126P123-S125 PolarHBondContact O-N 3.26Å; P123-L126 HydrophobicContact CG-CD1 4.35Å; P123-L126 PolarHBondContact O-N 2.99Å
124S42.3Very low43.8Very low109 Ų109105.1 Ų105.176%0.76256%0.559SS**G310 helixtrans-54.8-9.6-176.347.60000113.6I122 L126 F127I122-S124 PolarHBondContact O-N 2.85Å; I122-S124 VanDerWaalsContact O-N 3.12Å; S124-L126 VanDerWaalsContact C-N 3.32Å; S124-L126 PolarHBondContact O-N 3.47Å; S124-F127 PolarHBondContact O-N 3.44Å
125S43.2Very low43.7Very low94 Ų94106.4 Ų106.466%0.65756%0.558SS**G310 helixtrans-63.6-2816859.60000114.4P123P123-S125 PolarHBondContact O-N 3.26Å
126L40.7Very low43.4Very low131 Ų131104.7 Ų104.769%0.68655%0.55SS*.G310 helixtrans-85.4-12.9178.3-80.6162.7000113.6I122 P123 S124I122-L126 HydrophobicContact CG2-CB 3.84Å; I122-L126 HydrophobicContact CG2-CD1 3.63Å; I122-L126 HydrophobicContact CG2-CG 4.38Å; P123-L126 HydrophobicContact CG-CD1 4.35Å; P123-L126 PolarHBondContact O-N 2.99Å; S124-L126 VanDerWaalsContact C-N 3.32Å; S124-L126 PolarHBondContact O-N 3.47Å
127F39.2Very low43.2Very low57 Ų57108.9 Ų108.925%0.2557%0.571CS.*G310 helixtrans-110.526.7-177.3-78.9-76.4000114I122 S124 K129 I136I122-F127 HydrophobicContact CB-CD2 4.28Å; I122-F127 HydrophobicContact CB-CE2 3.79Å; I122-F127 HydrophobicContact CD1-CE2 3.69Å; I122-F127 HydrophobicContact CD1-CZ 4.12Å; I122-F127 HydrophobicContact CG1-CE2 4.34Å; I122-F127 HydrophobicContact CG2-CD2 4.07Å; I122-F127 HydrophobicContact CG2-CE2 3.73Å; S124-F127 PolarHBondContact O-N 3.44Å; F127-K129 PolarHBondContact O-N 3.08Å; F127-I136 HydrophobicContact CE1-CD1 3.81Å; F127-I136 HydrophobicContact CZ-CD1 3.61Å
128R39.4Very low42.9Very low239 Ų239111.4 Ų111.490%0.90258%0.583SS**  trans-71.531.7171.9-152179.9-176.5-176.60.9113.7
129K42.4Very low42.8Very low181 Ų181112.8 Ų112.879%0.78759%0.585SS**SBendtrans-139.267.3170.8-116.3-179.9-179.9-179.60110.3F127 N131F127-K129 PolarHBondContact O-N 3.08Å; K129-N131 VanDerWaalsContact C-N 3.27Å; K129-N131 PolarHBondContact O-N 3.01Å
130G37.9Very low42.5Very low65 Ų65110.7 Ų110.767%0.6758%0.58SS**THydrogen-bonded Turntrans42.1-33.3147.500000124
131N47Very low42.2Very low126 Ų126110.1 Ų110.167%0.67458%0.583SS**THydrogen-bonded Turntrans-131.3-21.5-167.2-84.2-17.6000115.9K129K129-N131 VanDerWaalsContact C-N 3.27Å; K129-N131 PolarHBondContact O-N 3.01Å
132H40Very low42.1Very low113 Ų113110.1 Ų110.152%0.52358%0.578SS.*Hα-helixtrans-83.3-21.9-176-69.8-57.2000114.7R134 Q135 I136H132-R134 VanDerWaalsContact C-N 3.26Å; H132-R134 PolarHBondContact O-N 3.37Å; H132-Q135 PolarHBondContact ND1-OE1 2.97Å; H132-Q135 PolarHBondContact O-N 2.97Å; H132-I136 PolarHBondContact O-N 3.29Å
133S43Very low41.9Very low51 Ų51111.3 Ų111.336%0.35759%0.589SS.*Hα-helixtrans-62-34.7176.148.50000112.2L137S133-L137 WeakPolarHBondContact O-CB 3.4Å; S133-L137 PolarHBondContact O-N 2.9Å; S133-L137 VanDerWaalsContact O-N 3.11Å
134R41.7Very low41.8Very low188 Ų188110.1 Ų110.171%0.70959%0.586SS**Hα-helixtrans-67.9-36.3176.5-81.8-176.7169.2177-3.3113.2H132 L137 M138H132-R134 VanDerWaalsContact C-N 3.26Å; H132-R134 PolarHBondContact O-N 3.37Å; R134-L137 PolarHBondContact O-N 3.4Å; R134-M138 PolarHBondContact O-N 3.37Å
135Q44.2Very low41.5Very low117 Ų117110.8 Ų110.855%0.54759%0.586SS.*Hα-helixtrans-72.3-39.4179.9-73.8176.6-26.500112.1H132 L137 M138 L139H132-Q135 PolarHBondContact ND1-OE1 2.97Å; H132-Q135 PolarHBondContact O-N 2.97Å; Q135-L137 VanDerWaalsContact C-N 3.33Å; Q135-M138 PolarHBondContact O-N 3.16Å; Q135-L139 PolarHBondContact O-N 3.06Å
136I45.6Very low41Very low65 Ų65114.6 Ų114.633%0.33361%0.611SS.*Hα-helixtrans-66.8-38.9175.7-68168000110.1F127 H132 M138 L139 F140F127-I136 HydrophobicContact CE1-CD1 3.81Å; F127-I136 HydrophobicContact CZ-CD1 3.61Å; H132-I136 PolarHBondContact O-N 3.29Å; I136-M138 PolarHBondContact O-N 3.07Å; I136-L139 PolarHBondContact O-N 3.36Å; I136-F140 HydrophobicContact CG2-CD2 3.93Å; I136-F140 HydrophobicContact CG2-CE2 3.79Å; I136-F140 VanDerWaalsContact O-CD2 3.26Å; I136-F140 WeakPolarHBondContact O-CD2 3.25Å; I136-F140 PolarHBondContact O-N 2.96Å; I136-F140 VanDerWaalsContact O-N 3.17Å
137L42.4Very low41.1Very low120 Ų120113.8 Ų113.863%0.62861%0.607SS**Hα-helixtrans-62.4-41.5174.8-157.188.3000112.7S133 R134 Q135 F140 S141S133-L137 WeakPolarHBondContact O-CB 3.4Å; S133-L137 PolarHBondContact O-N 2.9Å; S133-L137 VanDerWaalsContact O-N 3.11Å; R134-L137 PolarHBondContact O-N 3.4Å; Q135-L137 VanDerWaalsContact C-N 3.33Å; L137-F140 PolarHBondContact O-N 3.46Å; L137-S141 PolarHBondContact O-N 3.08Å
138M44.8Very low41.2Very low135 Ų135116.8 Ų116.867%0.66563%0.626SS**Hα-helixtrans-66.6-35.5175.6-80.6-177.4-173.800113.3R134 Q135 I136 F140 S141 S142R134-M138 PolarHBondContact O-N 3.37Å; Q135-M138 PolarHBondContact O-N 3.16Å; I136-M138 PolarHBondContact O-N 3.07Å; M138-F140 VanDerWaalsContact C-N 3.35Å; M138-S141 PolarHBondContact O-N 3.46Å; M138-S141 PolarHBondContact O-OG 2.96Å; M138-S142 PolarHBondContact O-N 3.29Å; M138-S142 VanDerWaalsContact O-N 3.14Å
139L45.1Very low41.3Very low118 Ų118110 Ų11062%0.61861%0.61SS**Hα-helixtrans-64.7-39.8175.7-89.9156.7000111.5Q135 I136 S142 V143Q135-L139 PolarHBondContact O-N 3.06Å; I136-L139 PolarHBondContact O-N 3.36Å; L139-S142 PolarHBondContact O-N 2.85Å; L139-V143 WeakPolarHBondContact O-CG2 3.29Å; L139-V143 PolarHBondContact O-N 3Å
140F39.2Very low41.2Very low100 Ų100105.8 Ų105.844%0.43960%0.6SS.*Hα-helixtrans-68.9-35.4176.1-82.9-73.1000113.2I136 L137 M138 S142 V143 A144I136-F140 HydrophobicContact CG2-CD2 3.93Å; I136-F140 HydrophobicContact CG2-CE2 3.79Å; I136-F140 VanDerWaalsContact O-CD2 3.26Å; I136-F140 WeakPolarHBondContact O-CD2 3.25Å; I136-F140 PolarHBondContact O-N 2.96Å; I136-F140 VanDerWaalsContact O-N 3.17Å; L137-F140 PolarHBondContact O-N 3.46Å; M138-F140 VanDerWaalsContact C-N 3.35Å; F140-S142 VanDerWaalsContact C-N 3.32Å; F140-S142 PolarHBondContact O-N 3.18Å; F140-V143 PolarHBondContact O-N 3.12Å; F140-A144 PolarHBondContact O-N 2.67Å
141S38.9Very low41.4Very low72 Ų72108.4 Ų108.450%0.50360%0.596SS.*Hα-helixtrans-68.6-31.5175.762.80000112.9L137 M138 T145L137-S141 PolarHBondContact O-N 3.08Å; M138-S141 PolarHBondContact O-N 3.46Å; M138-S141 PolarHBondContact O-OG 2.96Å; S141-T145 PolarHBondContact O-OG1 3.3Å
142S39.7Very low41Very low72 Ų72107.2 Ų107.250%0.50359%0.59SS.*Hα-helixtrans-70.1-31.7175.8176.40000113M138 L139 F140 T145M138-S142 PolarHBondContact O-N 3.29Å; M138-S142 VanDerWaalsContact O-N 3.14Å; L139-S142 PolarHBondContact O-N 2.85Å; F140-S142 VanDerWaalsContact C-N 3.32Å; F140-S142 PolarHBondContact O-N 3.18Å; S142-T145 PolarHBondContact O-OG1 3.22Å
143V43.1Very low41.1Very low102 Ų102106.8 Ų106.862%0.61860%0.595SS**Hα-helixtrans-78.6-28.1179.4175.10000111.6L139 F140 T145L139-V143 WeakPolarHBondContact O-CG2 3.29Å; L139-V143 PolarHBondContact O-N 3Å; F140-V143 PolarHBondContact O-N 3.12Å; V143-T145 PolarHBondContact O-N 3.43Å
144A37.8Very low41Very low58 Ų58111.1 Ų111.148%0.47961%0.613SS.*THydrogen-bonded Turntrans-76.7-8.3176.100000114F113 F140F113-A144 HydrophobicContact CE1-CB 4.24Å; F140-A144 PolarHBondContact O-N 2.67Å
145T36.3Very low40.9Very low122 Ų122104.7 Ų104.775%0.74861%0.605SS**THydrogen-bonded Turntrans-112.13.2-176.542.80000114S141 S142 V143S141-T145 PolarHBondContact O-OG1 3.3Å; S142-T145 PolarHBondContact O-OG1 3.22Å; V143-T145 PolarHBondContact O-N 3.43Å
146C33.6Very low40.6Very low175 Ų175103.5 Ų103.5100%1.18261%0.611SS**  trans-1090175.1-152.10000109.1

Retrieved 146 of 146 residues in 222.2 ms (Link to these results)