A0A077ZM14_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZM14, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 89 aa.

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

Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M46.8Very low55Low245 Ų24596.7 Ų96.7100%1.20750%0.499SS*.  0118.30-81.3171.9162.800106.5
2M50.9Low55.2Low65 Ų6592.6 Ų92.632%0.3249%0.49SS..  trans-66.8135.3173.5-83-175.5161.300109.5L6 M10 D48M2-L6 HydrophobicContact CB-CD2 4.22Å; M2-L6 HydrophobicContact CE-CD2 3.88Å; M2-L6 HydrophobicContact CG-CD2 3.75Å; M2-L6 HydrophobicContact SD-CD2 4.04Å; M2-M10 HydrophobicContact CE-CE 3.68Å; M2-M10 HydrophobicContact CE-SD 3.32Å; M2-M10 WeakPolarHBondContact CE-SD 3.43Å; M2-M10 HydrophobicContact SD-SD 3.7Å; M2-D48 HydrophobicContact SD-CB 4.44Å
3D62.4Low55.8Low125 Ų12592.7 Ų92.767%0.66848%0.484SS*.  trans-62.5142.4174.3-117.6-56.3000110.6T5 L6 R7D3-T5 PolarHBondContact O-N 2.86Å; D3-T5 VanDerWaalsContact O-N 3.08Å; D3-L6 HydrophobicContact CB-CB 4.35Å; D3-L6 WeakPolarHBondContact O-CA 3.47Å; D3-L6 WeakPolarHBondContact O-CB 3.42Å; D3-L6 PolarHBondContact O-N 2.94Å; D3-R7 PolarHBondContact O-N 2.75Å
4G61.1Low56.5Low46 Ų4686.6 Ų86.647%0.47445%0.454SS..Hα-helixtrans-58.8-28.1-177.300000113.1K8G4-K8 WeakPolarHBondContact O-CG 3.25Å; G4-K8 PolarHBondContact O-N 2.86Å
5T58.6Low56.7Low90 Ų9087.7 Ų87.755%0.55246%0.456SS*.Hα-helixtrans-68.7-45.7173-54.70000111.8D3 R7 K8 M9D3-T5 PolarHBondContact O-N 2.86Å; D3-T5 VanDerWaalsContact O-N 3.08Å; T5-R7 VanDerWaalsContact C-N 3.29Å; T5-R7 PolarHBondContact O-N 3.31Å; T5-K8 PolarHBondContact O-N 2.67Å; T5-M9 HydrophobicContact CG2-CE 3.91Å; T5-M9 WeakPolarHBondContact O-CG 3.24Å; T5-M9 PolarHBondContact O-N 2.84Å
6L50.8Low56.8Low80 Ų8086.8 Ų86.842%0.41946%0.455SS..Hα-helixtrans-60.2-44.2177.4-165.585.2000110M2 D3 K8 M9 M10M2-L6 HydrophobicContact CB-CD2 4.22Å; M2-L6 HydrophobicContact CE-CD2 3.88Å; M2-L6 HydrophobicContact CG-CD2 3.75Å; M2-L6 HydrophobicContact SD-CD2 4.04Å; D3-L6 HydrophobicContact CB-CB 4.35Å; D3-L6 WeakPolarHBondContact O-CA 3.47Å; D3-L6 WeakPolarHBondContact O-CB 3.42Å; D3-L6 PolarHBondContact O-N 2.94Å; L6-K8 VanDerWaalsContact C-N 3.34Å; L6-K8 PolarHBondContact O-N 3.21Å; L6-M9 PolarHBondContact O-N 2.77Å; L6-M9 VanDerWaalsContact O-N 3.14Å; L6-M10 HydrophobicContact CD2-SD 4.2Å; L6-M10 HydrophobicContact CG-SD 4.2Å; L6-M10 VanDerWaalsContact O-CG 3.31Å; L6-M10 WeakPolarHBondContact O-CG 3.46Å; L6-M10 PolarHBondContact O-N 2.65Å
7R52.2Low57.1Low82 Ų8282.2 Ų82.231%0.30943%0.432SS..Hα-helixtrans-53.7-48.6176.2-161.5-179.8179.5-126.7-5.1112.1D3 T5 M10 I11 G50 C51 D54D3-R7 PolarHBondContact O-N 2.75Å; T5-R7 VanDerWaalsContact C-N 3.29Å; T5-R7 PolarHBondContact O-N 3.31Å; R7-M10 PolarHBondContact O-N 3.16Å; R7-I11 HydrophobicContact CG-CD1 4.32Å; R7-I11 VanDerWaalsContact O-CG1 3.26Å; R7-I11 WeakPolarHBondContact O-CG1 3.41Å; R7-I11 PolarHBondContact O-N 3.01Å; R7-G50 PolarHBondContact NH2-O 3.36Å; R7-C51 WeakPolarHBondContact CG-SG 3.46Å; R7-D54 IonicContact CZ-OD2 3.07Å; R7-D54 IonicContact NH1-OD2 2.98Å; R7-D54 PolarHBondContact NH1-OD2 3.43Å; R7-D54 IonicContact NH2-OD2 2.63Å; R7-D54 PolarHBondContact NH2-OD2 3.38Å
8K55.4Low57.2Low161 Ų16179.6 Ų79.670%0.742%0.418SS*.Hα-helixtrans-64.6-41.3178.2-73.2178.2-179179.90112.6G4 T5 L6 M10 I11 A12G4-K8 WeakPolarHBondContact O-CG 3.25Å; G4-K8 PolarHBondContact O-N 2.86Å; T5-K8 PolarHBondContact O-N 2.67Å; L6-K8 VanDerWaalsContact C-N 3.34Å; L6-K8 PolarHBondContact O-N 3.21Å; K8-M10 VanDerWaalsContact C-N 3.3Å; K8-M10 PolarHBondContact O-N 3.21Å; K8-I11 PolarHBondContact O-N 3.21Å; K8-A12 WeakPolarHBondContact O-CB 3.31Å; K8-A12 PolarHBondContact O-N 3.49Å
9M52.1Low57Low126 Ų12678 Ų7862%0.62142%0.417SS*.Hα-helixtrans-62.6-40.2177.4-71.3-176.5179.900111.5T5 L6 A12 F13T5-M9 HydrophobicContact CG2-CE 3.91Å; T5-M9 WeakPolarHBondContact O-CG 3.24Å; T5-M9 PolarHBondContact O-N 2.84Å; L6-M9 PolarHBondContact O-N 2.77Å; L6-M9 VanDerWaalsContact O-N 3.14Å; M9-A12 PolarHBondContact O-N 3.38Å; M9-F13 WeakPolarHBondContact O-CB 3.48Å; M9-F13 PolarHBondContact O-N 3.01Å
10M55.6Low56.7Low19 Ų1980.8 Ų80.89%0.09442%0.421CS..Hα-helixtrans-67.6-43178.3-72-178.489.500112.5M2 L6 R7 K8 F13 A14 D44 V45M2-M10 HydrophobicContact CE-CE 3.68Å; M2-M10 HydrophobicContact CE-SD 3.32Å; M2-M10 WeakPolarHBondContact CE-SD 3.43Å; M2-M10 HydrophobicContact SD-SD 3.7Å; L6-M10 HydrophobicContact CD2-SD 4.2Å; L6-M10 HydrophobicContact CG-SD 4.2Å; L6-M10 VanDerWaalsContact O-CG 3.31Å; L6-M10 WeakPolarHBondContact O-CG 3.46Å; L6-M10 PolarHBondContact O-N 2.65Å; R7-M10 PolarHBondContact O-N 3.16Å; K8-M10 VanDerWaalsContact C-N 3.3Å; K8-M10 PolarHBondContact O-N 3.21Å; M10-F13 PolarHBondContact O-N 2.82Å; M10-A14 WeakPolarHBondContact O-CB 3.49Å; M10-A14 PolarHBondContact O-N 3.41Å; M10-D44 HydrophobicContact CE-CB 3.49Å; M10-D44 VanDerWaalsContact CE-CB 3.49Å; M10-D44 WeakPolarHBondContact CE-O 3.47Å; M10-D44 VanDerWaalsContact CE-OD2 3.26Å; M10-D44 WeakPolarHBondContact CE-OD2 3.38Å; M10-V45 HydrophobicContact CB-CG2 3.94Å; M10-V45 HydrophobicContact CE-CB 4.42Å; M10-V45 HydrophobicContact CE-CG2 3.9Å
11I59.1Low56.4Low25 Ų2578.4 Ų78.413%0.12841%0.411CS..Hα-helixtrans-59.4-48.2173.4-67.5170.1000110.3R7 K8 F13 A14 Q15 D54 I55R7-I11 HydrophobicContact CG-CD1 4.32Å; R7-I11 VanDerWaalsContact O-CG1 3.26Å; R7-I11 WeakPolarHBondContact O-CG1 3.41Å; R7-I11 PolarHBondContact O-N 3.01Å; K8-I11 PolarHBondContact O-N 3.21Å; I11-F13 VanDerWaalsContact C-N 3.32Å; I11-F13 PolarHBondContact O-N 2.92Å; I11-A14 PolarHBondContact O-N 3.48Å; I11-Q15 WeakPolarHBondContact O-CG 3.39Å; I11-Q15 PolarHBondContact O-N 3.38Å; I11-D54 HydrophobicContact CD1-CB 3.9Å; I11-I55 HydrophobicContact CB-CD1 4.45Å; I11-I55 HydrophobicContact CB-CG1 4.03Å; I11-I55 HydrophobicContact CG1-CD1 3.97Å; I11-I55 HydrophobicContact CG1-CG1 3.73Å; I11-I55 HydrophobicContact CG2-CG1 3.83Å
12A57.5Low56.5Low47 Ų4772.2 Ų72.239%0.38838%0.375SS..Hα-helixtrans-61.1-42177.800000111.5K8 M9 Q15 V16K8-A12 WeakPolarHBondContact O-CB 3.31Å; K8-A12 PolarHBondContact O-N 3.49Å; M9-A12 PolarHBondContact O-N 3.38Å; A12-Q15 PolarHBondContact O-N 3.3Å; A12-V16 WeakPolarHBondContact O-CB 3.23Å; A12-V16 VanDerWaalsContact O-CG2 3.24Å; A12-V16 WeakPolarHBondContact O-CG2 3.24Å; A12-V16 PolarHBondContact O-N 3.36Å
13F62.3Low56.2Low94 Ų9476.4 Ų76.441%0.41240%0.399SS..Hα-helixtrans-61.7-47.4176.4-177.7-92.8000111.7M9 M10 I11 Q15 V16 V17 A41M9-F13 WeakPolarHBondContact O-CB 3.48Å; M9-F13 PolarHBondContact O-N 3.01Å; M10-F13 PolarHBondContact O-N 2.82Å; I11-F13 VanDerWaalsContact C-N 3.32Å; I11-F13 PolarHBondContact O-N 2.92Å; F13-Q15 VanDerWaalsContact C-N 3.35Å; F13-Q15 PolarHBondContact O-N 2.81Å; F13-V16 PolarHBondContact O-N 2.95Å; F13-V17 HydrophobicContact CD1-CG2 4.02Å; F13-V17 HydrophobicContact CE1-CG2 3.54Å; F13-V17 HydrophobicContact CE2-CG2 4.34Å; F13-V17 HydrophobicContact CZ-CG2 3.74Å; F13-V17 WeakPolarHBondContact O-CG2 3.33Å; F13-V17 PolarHBondContact O-N 3.09Å; F13-A41 HydrophobicContact CD1-CB 3.97Å; F13-A41 HydrophobicContact CE1-CB 3.27Å; F13-A41 HydrophobicContact CZ-CB 3.93Å
14A66.6Low55.2Low7 Ų771.7 Ų71.76%0.05838%0.38CS..Hα-helixtrans-61.5-42.717800000112M10 I11 V17 I18 V45 I55M10-A14 WeakPolarHBondContact O-CB 3.49Å; M10-A14 PolarHBondContact O-N 3.41Å; I11-A14 PolarHBondContact O-N 3.48Å; A14-V17 PolarHBondContact O-N 3.33Å; A14-I18 WeakPolarHBondContact O-CB 3.43Å; A14-I18 WeakPolarHBondContact O-CD1 3.38Å; A14-I18 WeakPolarHBondContact O-CG1 3.27Å; A14-I18 PolarHBondContact O-N 3.39Å; A14-V45 HydrophobicContact CB-CG1 3.97Å; A14-V45 HydrophobicContact CB-CG2 4.3Å; A14-I55 HydrophobicContact CB-CD1 4.01Å; A14-I55 HydrophobicContact CB-CG2 4.28Å
15Q59.7Low54.4Low103 Ų10372.2 Ų72.248%0.48139%0.385SS..Hα-helixtrans-62.5-42175-73.9179.6-23.500112.3I11 A12 F13 V17 I18 A19I11-Q15 WeakPolarHBondContact O-CG 3.39Å; I11-Q15 PolarHBondContact O-N 3.38Å; A12-Q15 PolarHBondContact O-N 3.3Å; F13-Q15 VanDerWaalsContact C-N 3.35Å; F13-Q15 PolarHBondContact O-N 2.81Å; Q15-V17 VanDerWaalsContact C-N 3.34Å; Q15-I18 PolarHBondContact O-N 3.38Å; Q15-A19 VanDerWaalsContact O-CB 3.25Å; Q15-A19 WeakPolarHBondContact O-CB 3.45Å; Q15-A19 PolarHBondContact O-N 2.78Å
16V57.8Low53.6Low73 Ų7375.6 Ų75.644%0.44240%0.399SS..Hα-helixtrans-62.2-43.6175.4169.60000110.6A12 F13 A19 W20A12-V16 WeakPolarHBondContact O-CB 3.23Å; A12-V16 VanDerWaalsContact O-CG2 3.24Å; A12-V16 WeakPolarHBondContact O-CG2 3.24Å; A12-V16 PolarHBondContact O-N 3.36Å; F13-V16 PolarHBondContact O-N 2.95Å; V16-A19 PolarHBondContact O-N 3.07Å; V16-W20 HydrophobicContact CG1-CG 4.42Å; V16-W20 VanDerWaalsContact O-CB 3.24Å; V16-W20 WeakPolarHBondContact O-CB 3.38Å; V16-W20 PolarHBondContact O-N 2.88Å
17V61.7Low53.1Low10 Ų1078.3 Ų78.36%0.06140%0.404CS..Hα-helixtrans-64.4-43.7177.8171.70000111.3F13 A14 Q15 W20 C21 L31 L38 M42F13-V17 HydrophobicContact CD1-CG2 4.02Å; F13-V17 HydrophobicContact CE1-CG2 3.54Å; F13-V17 HydrophobicContact CE2-CG2 4.34Å; F13-V17 HydrophobicContact CZ-CG2 3.74Å; F13-V17 WeakPolarHBondContact O-CG2 3.33Å; F13-V17 PolarHBondContact O-N 3.09Å; A14-V17 PolarHBondContact O-N 3.33Å; Q15-V17 VanDerWaalsContact C-N 3.34Å; V17-W20 WeakPolarHBondContact O-CB 3.49Å; V17-W20 PolarHBondContact O-N 3.45Å; V17-C21 PolarHBondContact O-N 3.26Å; V17-C21 PolarHBondContact O-SG 3.43Å; V17-L31 HydrophobicContact CG1-CD2 4.5Å; V17-L38 HydrophobicContact CG1-CD1 3.9Å; V17-L38 HydrophobicContact CG1-CD2 3.6Å; V17-L38 HydrophobicContact CG1-CG 3.93Å; V17-L38 HydrophobicContact CG2-CD1 4.34Å; V17-M42 HydrophobicContact CB-CE 4.43Å; V17-M42 HydrophobicContact CG1-CE 3.52Å
18I59.4Low52.4Low35 Ų3578.5 Ų78.518%0.17941%0.41CS..Hα-helixtrans-62.3-48.8175.9-68163.9000110.1A14 Q15 W20 C21 Y22 I55 L76 I80A14-I18 WeakPolarHBondContact O-CB 3.43Å; A14-I18 WeakPolarHBondContact O-CD1 3.38Å; A14-I18 WeakPolarHBondContact O-CG1 3.27Å; A14-I18 PolarHBondContact O-N 3.39Å; Q15-I18 PolarHBondContact O-N 3.38Å; I18-W20 VanDerWaalsContact C-N 3.3Å; I18-W20 PolarHBondContact O-N 3Å; I18-C21 WeakPolarHBondContact O-CB 3.49Å; I18-C21 PolarHBondContact O-N 2.95Å; I18-C21 VanDerWaalsContact O-N 3.09Å; I18-Y22 HydrophobicContact CG2-CD2 3.85Å; I18-Y22 HydrophobicContact CG2-CE2 4Å; I18-Y22 WeakPolarHBondContact O-CD2 3.22Å; I18-Y22 PolarHBondContact O-N 3.49Å; I18-I55 HydrophobicContact CD1-CG2 4.17Å; I18-L76 HydrophobicContact CG2-CD2 4Å; I18-I80 HydrophobicContact CD1-CD1 4.4Å; I18-I80 HydrophobicContact CG1-CD1 4.37Å
19A54Low51.7Low49 Ų4974.9 Ų74.941%0.40541%0.405SS..Hα-helixtrans-59.6-4217700000111.3Q15 V16 C21 Y22 D23Q15-A19 VanDerWaalsContact O-CB 3.25Å; Q15-A19 WeakPolarHBondContact O-CB 3.45Å; Q15-A19 PolarHBondContact O-N 2.78Å; V16-A19 PolarHBondContact O-N 3.07Å; A19-C21 VanDerWaalsContact C-N 3.29Å; A19-C21 PolarHBondContact O-N 3.23Å; A19-Y22 PolarHBondContact O-N 3.35Å; A19-Y22 VanDerWaalsContact O-N 3.07Å; A19-D23 WeakPolarHBondContact O-CB 3.41Å; A19-D23 PolarHBondContact O-N 3.49Å
20W50.1Low51.1Low133 Ų13371.7 Ų71.750%0.50440%0.399SS..Hα-helixtrans-61.2-35.5174.7-88.242.8000113V16 V17 I18V16-W20 HydrophobicContact CG1-CG 4.42Å; V16-W20 VanDerWaalsContact O-CB 3.24Å; V16-W20 WeakPolarHBondContact O-CB 3.38Å; V16-W20 PolarHBondContact O-N 2.88Å; V17-W20 WeakPolarHBondContact O-CB 3.49Å; V17-W20 PolarHBondContact O-N 3.45Å; I18-W20 VanDerWaalsContact C-N 3.3Å; I18-W20 PolarHBondContact O-N 3Å
21C50.3Low50.3Low32 Ų3272 Ų7222%0.21640%0.401CS..Hα-helixtrans-68.7-36.6172.9-69.40000111.9V17 I18 A19 L28V17-C21 PolarHBondContact O-N 3.26Å; V17-C21 PolarHBondContact O-SG 3.43Å; I18-C21 WeakPolarHBondContact O-CB 3.49Å; I18-C21 PolarHBondContact O-N 2.95Å; I18-C21 VanDerWaalsContact O-N 3.09Å; A19-C21 VanDerWaalsContact C-N 3.29Å; A19-C21 PolarHBondContact O-N 3.23Å; C21-L28 HydrophobicContact CB-CD1 4.06Å; C21-L28 VanDerWaalsContact SG-CD1 3.57Å
22Y48.2Very low49.6Very low115 Ų11576.6 Ų76.645%0.45143%0.425SS..Hα-helixtrans-76.9-38.4-179.8-92.5-82.2000114.2I18 A19 G24 L76I18-Y22 HydrophobicContact CG2-CD2 3.85Å; I18-Y22 HydrophobicContact CG2-CE2 4Å; I18-Y22 WeakPolarHBondContact O-CD2 3.22Å; I18-Y22 PolarHBondContact O-N 3.49Å; A19-Y22 PolarHBondContact O-N 3.35Å; A19-Y22 VanDerWaalsContact O-N 3.07Å; Y22-G24 PolarHBondContact O-N 2.86Å; Y22-L76 HydrophobicContact CE2-CD1 4.01Å; Y22-L76 HydrophobicContact CE2-CD2 4.05Å
23D45.3Very low49.1Very low153 Ų15381.1 Ų81.182%0.81844%0.443SS*.SBendtrans-72.1-12.3-172.1-140.8-38.8000113.3A19A19-D23 WeakPolarHBondContact O-CB 3.41Å; A19-D23 PolarHBondContact O-N 3.49Å
24G41.3Very low48.2Very low25 Ų2581.9 Ų81.926%0.25845%0.452SS..  trans173.5112.1168.600000112.5Y22 L26 R27Y22-G24 PolarHBondContact O-N 2.86Å; G24-L26 PolarHBondContact O-N 2.83Å; G24-R27 PolarHBondContact O-N 3.18Å
25G43.9Very low47.2Very low57 Ų5784 Ų8459%0.58847%0.466SS*.THydrogen-bonded Turntrans-48.9-14.6175.200000115.4R27 L28G25-R27 VanDerWaalsContact C-N 3.33Å; G25-R27 PolarHBondContact O-N 3.39Å; G25-L28 WeakPolarHBondContact O-CB 3.27Å; G25-L28 PolarHBondContact O-N 2.91Å
26L42Very low46.5Very low162 Ų16282.4 Ų82.485%0.84847%0.471SS*.THydrogen-bonded Turntrans-58.9-33.5168.4-86.8142.4000114.4G24G24-L26 PolarHBondContact O-N 2.83Å
27R39.7Very low45.6Very low137 Ų13783.3 Ų83.352%0.51748%0.479SS..THydrogen-bonded Turntrans-85.9-13.6179.1-74.5-169.6174.6-1802.4113.7G24 G25 S29 A30 L31G24-R27 PolarHBondContact O-N 3.18Å; G25-R27 VanDerWaalsContact C-N 3.33Å; G25-R27 PolarHBondContact O-N 3.39Å; R27-S29 PolarHBondContact O-N 2.81Å; R27-A30 WeakPolarHBondContact O-CA 3.47Å; R27-A30 WeakPolarHBondContact O-CB 3.28Å; R27-A30 PolarHBondContact O-N 3.4Å; R27-L31 WeakPolarHBondContact O-CD1 3.18Å; R27-L31 PolarHBondContact O-N 3.29Å
28L39Very low44.7Very low86 Ų8684.3 Ų84.345%0.4548%0.484SS..Hα-helixtrans-61-32.4173.9-149.480.9000111.4C21 G25 A30 L31 N32C21-L28 HydrophobicContact CB-CD1 4.06Å; C21-L28 VanDerWaalsContact SG-CD1 3.57Å; G25-L28 WeakPolarHBondContact O-CB 3.27Å; G25-L28 PolarHBondContact O-N 2.91Å; L28-A30 VanDerWaalsContact C-N 3.35Å; L28-L31 HydrophobicContact CD1-CD2 4.48Å; L28-L31 VanDerWaalsContact O-CB 3.27Å; L28-L31 WeakPolarHBondContact O-CB 3.13Å; L28-L31 PolarHBondContact O-N 3.23Å; L28-N32 PolarHBondContact O-N 3.44Å
29S39.6Very low44.2Very low85 Ų8582.9 Ų82.959%0.59448%0.477SS*.Hα-helixtrans-65.6-35.9172.2-58.30000112.7R27 N32R27-S29 PolarHBondContact O-N 2.81Å; S29-N32 PolarHBondContact O-N 3.43Å
30A40.1Very low43.8Very low58 Ų5883.6 Ų83.648%0.47948%0.483SS..Hα-helixtrans-70.8-34.5172.800000111.5R27 L28 N32 N33 N34R27-A30 WeakPolarHBondContact O-CA 3.47Å; R27-A30 WeakPolarHBondContact O-CB 3.28Å; R27-A30 PolarHBondContact O-N 3.4Å; L28-A30 VanDerWaalsContact C-N 3.35Å; A30-N32 VanDerWaalsContact C-N 3.33Å; A30-N33 PolarHBondContact O-N 2.97Å; A30-N34 PolarHBondContact O-N 2.9Å
31L38.8Very low43.6Very low27 Ų2778.4 Ų78.414%0.14147%0.468CS..Hα-helixtrans-60.5-40.6170.5-99.491.6000112.1V17 R27 L28 N33 N34 S35 L38V17-L31 HydrophobicContact CG1-CD2 4.5Å; R27-L31 WeakPolarHBondContact O-CD1 3.18Å; R27-L31 PolarHBondContact O-N 3.29Å; L28-L31 HydrophobicContact CD1-CD2 4.48Å; L28-L31 VanDerWaalsContact O-CB 3.27Å; L28-L31 WeakPolarHBondContact O-CB 3.13Å; L28-L31 PolarHBondContact O-N 3.23Å; L31-N33 VanDerWaalsContact C-N 3.25Å; L31-N33 PolarHBondContact O-N 2.92Å; L31-N34 CarbonylContact O-C 3.23Å; L31-N34 VanDerWaalsContact O-C 3.23Å; L31-N34 PolarHBondContact O-N 3.23Å; L31-S35 WeakPolarHBondContact O-CA 3.47Å; L31-S35 PolarHBondContact O-N 3.3Å; L31-L38 HydrophobicContact CD1-CD1 4.47Å; L31-L38 HydrophobicContact CD2-CD1 3.31Å; L31-L38 HydrophobicContact CD2-CD2 3.56Å; L31-L38 HydrophobicContact CD2-CG 4.03Å; L31-L38 HydrophobicContact CG-CD1 3.53Å
32N44.3Very low43.6Very low120 Ų12077.9 Ų77.964%0.64246%0.463SS*.Hα-helixtrans-61.1-37.5-178.2-158.527.2000111.9L28 S29 A30 N34 S35L28-N32 PolarHBondContact O-N 3.44Å; S29-N32 PolarHBondContact O-N 3.43Å; A30-N32 VanDerWaalsContact C-N 3.33Å; N32-N34 VanDerWaalsContact C-N 3.26Å; N32-N34 PolarHBondContact O-N 2.97Å; N32-S35 WeakPolarHBondContact O-CB 3.36Å; N32-S35 PolarHBondContact O-N 2.87Å; N32-S35 PolarHBondContact O-OG 2.94Å
33N46.7Very low43.7Very low142 Ų14273.7 Ų73.776%0.75945%0.449SS*.Hα-helixtrans-67-27.3175.5-72.4-9.6000113.1A30 L31A30-N33 PolarHBondContact O-N 2.97Å; L31-N33 VanDerWaalsContact C-N 3.25Å; L31-N33 PolarHBondContact O-N 2.92Å
34N43.5Very low43.6Very low111 Ų11170.3 Ų70.359%0.59443%0.431SS*.THydrogen-bonded Turntrans-110.821.3179-71.7-19.7000112.6A30 L31 N32 A36 C37 L38A30-N34 PolarHBondContact O-N 2.9Å; L31-N34 CarbonylContact O-C 3.23Å; L31-N34 VanDerWaalsContact O-C 3.23Å; L31-N34 PolarHBondContact O-N 3.23Å; N32-N34 VanDerWaalsContact C-N 3.26Å; N32-N34 PolarHBondContact O-N 2.97Å; N34-A36 PolarHBondContact O-N 3.29Å; N34-C37 WeakPolarHBondContact O-CB 3.49Å; N34-C37 PolarHBondContact O-N 3.38Å; N34-L38 PolarHBondContact O-N 2.94Å
35S45.1Very low43.9Very low50 Ų5069.3 Ų69.335%0.3542%0.42SS..Hα-helixtrans-55.1-32.3-171.249.20000113.2L31 N32 L38 S39L31-S35 WeakPolarHBondContact O-CA 3.47Å; L31-S35 PolarHBondContact O-N 3.3Å; N32-S35 WeakPolarHBondContact O-CB 3.36Å; N32-S35 PolarHBondContact O-N 2.87Å; N32-S35 PolarHBondContact O-OG 2.94Å; S35-L38 PolarHBondContact O-N 2.63Å; S35-S39 WeakPolarHBondContact O-CB 3.44Å; S35-S39 PolarHBondContact O-N 2.98Å; S35-S39 PolarHBondContact O-OG 2.9Å
36A45.3Very low44.2Very low71 Ų7168 Ų6859%0.58740%0.4SS*.Hα-helixtrans-65.4-36.8175.100000113.9N34 S39 A40N34-A36 PolarHBondContact O-N 3.29Å; A36-S39 VanDerWaalsContact C-OG 3.3Å; A36-S39 VanDerWaalsContact CA-OG 3.28Å; A36-S39 WeakPolarHBondContact CA-OG 3.07Å; A36-S39 PolarHBondContact O-OG 2.99Å; A36-A40 WeakPolarHBondContact O-CB 3.41Å; A36-A40 PolarHBondContact O-N 3.09Å; A36-A40 VanDerWaalsContact O-N 3.1Å
37C38.8Very low44.5Very low91 Ų9164.2 Ų64.262%0.61538%0.384SS*.Hα-helixtrans-72.5-39.1178.1-170.50000110.3N34 A41N34-C37 WeakPolarHBondContact O-CB 3.49Å; N34-C37 PolarHBondContact O-N 3.38Å; C37-A41 WeakPolarHBondContact O-CB 3.34Å; C37-A41 PolarHBondContact O-N 3.3Å
38L44Very low44.6Very low31 Ų3160.4 Ų60.416%0.16237%0.374CS..Hα-helixtrans-73-35.8178.9-143120.6000112.4V17 L31 N34 S35 M42V17-L38 HydrophobicContact CG1-CD1 3.9Å; V17-L38 HydrophobicContact CG1-CD2 3.6Å; V17-L38 HydrophobicContact CG1-CG 3.93Å; V17-L38 HydrophobicContact CG2-CD1 4.34Å; L31-L38 HydrophobicContact CD1-CD1 4.47Å; L31-L38 HydrophobicContact CD2-CD1 3.31Å; L31-L38 HydrophobicContact CD2-CD2 3.56Å; L31-L38 HydrophobicContact CD2-CG 4.03Å; L31-L38 HydrophobicContact CG-CD1 3.53Å; N34-L38 PolarHBondContact O-N 2.94Å; S35-L38 PolarHBondContact O-N 2.63Å; L38-M42 HydrophobicContact CD2-CE 3.86Å; L38-M42 HydrophobicContact CD2-CG 4.33Å; L38-M42 HydrophobicContact CD2-SD 4.17Å; L38-M42 WeakPolarHBondContact O-CB 3.26Å; L38-M42 WeakPolarHBondContact O-CG 3.36Å; L38-M42 PolarHBondContact O-N 3.48Å
39S48.1Very low44.9Very low6 Ų665 Ų654%0.04239%0.39CS..Hα-helixtrans-61.4-49.8170.7590000112.1S35 A36 A41 M42 V43 Y87S35-S39 WeakPolarHBondContact O-CB 3.44Å; S35-S39 PolarHBondContact O-N 2.98Å; S35-S39 PolarHBondContact O-OG 2.9Å; A36-S39 VanDerWaalsContact C-OG 3.3Å; A36-S39 VanDerWaalsContact CA-OG 3.28Å; A36-S39 WeakPolarHBondContact CA-OG 3.07Å; A36-S39 PolarHBondContact O-OG 2.99Å; S39-A41 VanDerWaalsContact C-N 3.28Å; S39-A41 PolarHBondContact O-N 2.9Å; S39-M42 PolarHBondContact O-N 2.8Å; S39-V43 VanDerWaalsContact O-CB 3.25Å; S39-V43 WeakPolarHBondContact O-CB 3.34Å; S39-V43 WeakPolarHBondContact O-CG2 3.27Å; S39-V43 PolarHBondContact O-N 2.92Å; S39-Y87 WeakPolarHBondContact CB-OH 3.4Å; S39-Y87 PolarHBondContact OG-OH 3.34Å
40A44.9Very low45.1Very low63 Ų6362.4 Ų62.452%0.52138%0.377SS..Hα-helixtrans-58.8-46179.800000110.4A36 D44A36-A40 WeakPolarHBondContact O-CB 3.41Å; A36-A40 PolarHBondContact O-N 3.09Å; A36-A40 VanDerWaalsContact O-N 3.1Å; A40-D44 WeakPolarHBondContact O-CB 3.29Å; A40-D44 PolarHBondContact O-N 3.43Å
41A45.6Very low45Very low24 Ų2459.6 Ų59.620%0.19835%0.354CS..Hα-helixtrans-67.3-43.1179.800000113F13 C37 S39 D44 V45F13-A41 HydrophobicContact CD1-CB 3.97Å; F13-A41 HydrophobicContact CE1-CB 3.27Å; F13-A41 HydrophobicContact CZ-CB 3.93Å; C37-A41 WeakPolarHBondContact O-CB 3.34Å; C37-A41 PolarHBondContact O-N 3.3Å; S39-A41 VanDerWaalsContact C-N 3.28Å; S39-A41 PolarHBondContact O-N 2.9Å; A41-D44 PolarHBondContact O-N 2.79Å; A41-V45 WeakPolarHBondContact O-CG2 3.29Å; A41-V45 PolarHBondContact O-N 3.48Å; A41-V45 VanDerWaalsContact O-N 3.08Å
42M51.8Low45.1Very low21 Ų2160.7 Ų60.710%0.10336%0.36CS..Hα-helixtrans-68.1-39.1177.6-78.2-159.9171.400112.7V17 L38 S39 D44 V45 V46 I80 F83V17-M42 HydrophobicContact CB-CE 4.43Å; V17-M42 HydrophobicContact CG1-CE 3.52Å; L38-M42 HydrophobicContact CD2-CE 3.86Å; L38-M42 HydrophobicContact CD2-CG 4.33Å; L38-M42 HydrophobicContact CD2-SD 4.17Å; L38-M42 WeakPolarHBondContact O-CB 3.26Å; L38-M42 WeakPolarHBondContact O-CG 3.36Å; L38-M42 PolarHBondContact O-N 3.48Å; S39-M42 PolarHBondContact O-N 2.8Å; M42-D44 VanDerWaalsContact C-N 3.33Å; M42-V45 PolarHBondContact O-N 3.48Å; M42-V46 VanDerWaalsContact O-CB 3.29Å; M42-V46 WeakPolarHBondContact O-CB 3.48Å; M42-V46 VanDerWaalsContact O-CG2 3.29Å; M42-V46 WeakPolarHBondContact O-CG2 3.2Å; M42-V46 PolarHBondContact O-N 3.14Å; M42-I80 HydrophobicContact CE-CG1 4.48Å; M42-I80 HydrophobicContact SD-CG1 4.36Å; M42-I80 HydrophobicContact SD-CG2 4.28Å; M42-F83 HydrophobicContact CB-CE1 4.36Å; M42-F83 HydrophobicContact SD-CD1 4.28Å; M42-F83 HydrophobicContact SD-CE1 4.33Å
43V50.2Low45Very low27 Ų2758.8 Ų58.816%0.16436%0.356CS..Hα-helixtrans-64-41.6177.2171.90000110.3S39 V45 V46 T47 V84 Y87S39-V43 VanDerWaalsContact O-CB 3.25Å; S39-V43 WeakPolarHBondContact O-CB 3.34Å; S39-V43 WeakPolarHBondContact O-CG2 3.27Å; S39-V43 PolarHBondContact O-N 2.92Å; V43-V45 VanDerWaalsContact C-N 3.3Å; V43-V45 PolarHBondContact O-N 3.03Å; V43-V46 PolarHBondContact O-N 3.05Å; V43-T47 HydrophobicContact CG1-CG2 3.99Å; V43-T47 WeakPolarHBondContact O-CB 3.37Å; V43-T47 VanDerWaalsContact O-CG2 3.24Å; V43-T47 WeakPolarHBondContact O-CG2 3.37Å; V43-T47 PolarHBondContact O-N 3.44Å; V43-T47 PolarHBondContact O-OG1 3.47Å; V43-V84 HydrophobicContact CG2-CG1 4.31Å; V43-V84 HydrophobicContact CG2-CG2 4.31Å; V43-Y87 HydrophobicContact CG2-CD2 3.59Å; V43-Y87 HydrophobicContact CG2-CE2 4.49Å; V43-Y87 HydrophobicContact CG2-CG 3.64Å
44D43.5Very low44.9Very low82 Ų8256.4 Ų56.444%0.43934%0.343SS..Hα-helixtrans-64.8-37.8177-156.925.4000111M10 A40 A41 M42 T47M10-D44 HydrophobicContact CE-CB 3.49Å; M10-D44 VanDerWaalsContact CE-CB 3.49Å; M10-D44 WeakPolarHBondContact CE-O 3.47Å; M10-D44 VanDerWaalsContact CE-OD2 3.26Å; M10-D44 WeakPolarHBondContact CE-OD2 3.38Å; A40-D44 WeakPolarHBondContact O-CB 3.29Å; A40-D44 PolarHBondContact O-N 3.43Å; A41-D44 PolarHBondContact O-N 2.79Å; M42-D44 VanDerWaalsContact C-N 3.33Å; D44-T47 PolarHBondContact O-OG1 3.35Å
45V47.8Very low44.9Very low4 Ų452.2 Ų52.22%0.02432%0.321CS..Hα-helixtrans-67.2-40.2175.2175.70000112.3M10 A14 A41 M42 V43 C51 I55M10-V45 HydrophobicContact CB-CG2 3.94Å; M10-V45 HydrophobicContact CE-CB 4.42Å; M10-V45 HydrophobicContact CE-CG2 3.9Å; A14-V45 HydrophobicContact CB-CG1 3.97Å; A14-V45 HydrophobicContact CB-CG2 4.3Å; A41-V45 WeakPolarHBondContact O-CG2 3.29Å; A41-V45 PolarHBondContact O-N 3.48Å; A41-V45 VanDerWaalsContact O-N 3.08Å; M42-V45 PolarHBondContact O-N 3.48Å; V43-V45 VanDerWaalsContact C-N 3.3Å; V43-V45 PolarHBondContact O-N 3.03Å; V45-C51 HydrophobicContact CG1-CB 4.46Å; V45-C51 VanDerWaalsContact O-CB 3.27Å; V45-C51 WeakPolarHBondContact O-CB 3.38Å; V45-I55 HydrophobicContact CG1-CD1 3.1Å
46V50.2Low44.8Very low29 Ų2952.1 Ų52.118%0.17632%0.318CS..Hα-helixtrans-85.6-28.6-171.8164.50000112.9M42 V43 D48 L52 I80 V84M42-V46 VanDerWaalsContact O-CB 3.29Å; M42-V46 WeakPolarHBondContact O-CB 3.48Å; M42-V46 VanDerWaalsContact O-CG2 3.29Å; M42-V46 WeakPolarHBondContact O-CG2 3.2Å; M42-V46 PolarHBondContact O-N 3.14Å; V43-V46 PolarHBondContact O-N 3.05Å; V46-D48 PolarHBondContact O-N 3.25Å; V46-L52 HydrophobicContact CB-CD1 4.18Å; V46-L52 HydrophobicContact CG1-CD1 3.54Å; V46-L52 HydrophobicContact CG1-CG 4.42Å; V46-L52 HydrophobicContact CG2-CD1 4.17Å; V46-L52 HydrophobicContact CG2-CG 4.17Å; V46-I80 HydrophobicContact CG2-CG2 4.45Å; V46-V84 HydrophobicContact CB-CB 4.42Å; V46-V84 HydrophobicContact CB-CG1 3.98Å; V46-V84 HydrophobicContact CB-CG2 3.85Å; V46-V84 HydrophobicContact CG1-CB 3.91Å; V46-V84 HydrophobicContact CG1-CG1 3.41Å; V46-V84 VanDerWaalsContact CG1-CG1 3.41Å; V46-V84 HydrophobicContact CG1-CG2 3.85Å; V46-V84 HydrophobicContact CG2-CG2 3.9Å
47T47.1Very low44.5Very low84 Ų8453.1 Ų53.152%0.51532%0.318SS..Hα-helixtrans-64.7-28.6176.446.90000112V43 D44 K49V43-T47 HydrophobicContact CG1-CG2 3.99Å; V43-T47 WeakPolarHBondContact O-CB 3.37Å; V43-T47 VanDerWaalsContact O-CG2 3.24Å; V43-T47 WeakPolarHBondContact O-CG2 3.37Å; V43-T47 PolarHBondContact O-N 3.44Å; V43-T47 PolarHBondContact O-OG1 3.47Å; D44-T47 PolarHBondContact O-OG1 3.35Å; T47-K49 PolarHBondContact O-N 3.28Å; T47-K49 VanDerWaalsContact O-N 3.09Å
48D43Very low44.4Very low56 Ų5653.5 Ų53.530%0.29932%0.32SS..SBendtrans-77.593164.6-161.5-84.9000109.8M2 V46 G50 C51 L52M2-D48 HydrophobicContact SD-CB 4.44Å; V46-D48 PolarHBondContact O-N 3.25Å; D48-G50 PolarHBondContact O-N 3.25Å; D48-G50 PolarHBondContact OD1-N 2.86Å; D48-C51 HydrophobicContact CB-CB 4.2Å; D48-C51 WeakPolarHBondContact O-CB 3.48Å; D48-C51 PolarHBondContact O-N 2.94Å; D48-C51 PolarHBondContact OD1-N 3.36Å; D48-L52 PolarHBondContact O-N 3.07Å
49K45.5Very low44.1Very low182 Ų18257.2 Ų57.279%0.79135%0.346SS*.Hα-helixtrans-50.6-25.5179.1-67.2-175.9177.4-179.80113.4T47T47-K49 PolarHBondContact O-N 3.28Å; T47-K49 VanDerWaalsContact O-N 3.09Å
50G42.4Very low43.5Very low31 Ų3161.6 Ų61.632%0.3238%0.377SS..Hα-helixtrans-72-39.6174.800000112.8R7 D48 L52R7-G50 PolarHBondContact NH2-O 3.36Å; D48-G50 PolarHBondContact O-N 3.25Å; D48-G50 PolarHBondContact OD1-N 2.86Å; G50-L52 VanDerWaalsContact C-N 3.34Å; G50-L52 PolarHBondContact O-N 3.43Å
51C38.9Very low42.9Very low0 Ų066.9 Ų66.90%040%0.395CS..Hα-helixtrans-62.1-40.2177.5-770000112.6R7 V45 D48 S53 D54 I55R7-C51 WeakPolarHBondContact CG-SG 3.46Å; V45-C51 HydrophobicContact CG1-CB 4.46Å; V45-C51 VanDerWaalsContact O-CB 3.27Å; V45-C51 WeakPolarHBondContact O-CB 3.38Å; D48-C51 HydrophobicContact CB-CB 4.2Å; D48-C51 WeakPolarHBondContact O-CB 3.48Å; D48-C51 PolarHBondContact O-N 2.94Å; D48-C51 PolarHBondContact OD1-N 3.36Å; C51-S53 VanDerWaalsContact C-N 3.28Å; C51-S53 PolarHBondContact O-N 2.89Å; C51-D54 PolarHBondContact O-N 3.25Å; C51-D54 VanDerWaalsContact O-N 3.09Å; C51-I55 HydrophobicContact CB-CD1 4.18Å; C51-I55 WeakPolarHBondContact O-CD1 3.31Å; C51-I55 VanDerWaalsContact O-CG1 3.27Å; C51-I55 WeakPolarHBondContact O-CG1 3.36Å; C51-I55 PolarHBondContact O-N 3Å
52L40.5Very low42.1Very low49 Ų4972.7 Ų72.726%0.25742%0.418SS..Hα-helixtrans-58.8-40.7-177-124.1167.6000112.7V46 D48 G50 D54 I55 V56 F77V46-L52 HydrophobicContact CB-CD1 4.18Å; V46-L52 HydrophobicContact CG1-CD1 3.54Å; V46-L52 HydrophobicContact CG1-CG 4.42Å; V46-L52 HydrophobicContact CG2-CD1 4.17Å; V46-L52 HydrophobicContact CG2-CG 4.17Å; D48-L52 PolarHBondContact O-N 3.07Å; G50-L52 VanDerWaalsContact C-N 3.34Å; G50-L52 PolarHBondContact O-N 3.43Å; L52-D54 VanDerWaalsContact C-N 3.29Å; L52-D54 PolarHBondContact O-N 3.48Å; L52-I55 PolarHBondContact O-N 3.32Å; L52-V56 HydrophobicContact CD2-CG2 4.23Å; L52-V56 PolarHBondContact O-N 3.03Å; L52-F77 HydrophobicContact CD2-CE2 4.24Å
53S41.9Very low41.3Very low81 Ų8183.6 Ų83.657%0.56646%0.458SS*.Hα-helixtrans-69.5-26.7179.7-58.80000112.9C51C51-S53 VanDerWaalsContact C-N 3.28Å; C51-S53 PolarHBondContact O-N 2.89Å
54D45.6Very low40.4Very low91 Ų9188.9 Ų88.949%0.48748%0.481SS..Hα-helixtrans-84-28.1176-78.6-19000112.2R7 I11 C51 L52R7-D54 IonicContact CZ-OD2 3.07Å; R7-D54 IonicContact NH1-OD2 2.98Å; R7-D54 PolarHBondContact NH1-OD2 3.43Å; R7-D54 IonicContact NH2-OD2 2.63Å; R7-D54 PolarHBondContact NH2-OD2 3.38Å; I11-D54 HydrophobicContact CD1-CB 3.9Å; C51-D54 PolarHBondContact O-N 3.25Å; C51-D54 VanDerWaalsContact O-N 3.09Å; L52-D54 VanDerWaalsContact C-N 3.29Å; L52-D54 PolarHBondContact O-N 3.48Å
55I42.8Very low39.8Very low23 Ų2392.5 Ų92.512%0.11850%0.495CS..Hα-helixtrans-84.4-46-179-64.5160000111.2I11 A14 I18 V45 C51 L52 P57I11-I55 HydrophobicContact CB-CD1 4.45Å; I11-I55 HydrophobicContact CB-CG1 4.03Å; I11-I55 HydrophobicContact CG1-CD1 3.97Å; I11-I55 HydrophobicContact CG1-CG1 3.73Å; I11-I55 HydrophobicContact CG2-CG1 3.83Å; A14-I55 HydrophobicContact CB-CD1 4.01Å; A14-I55 HydrophobicContact CB-CG2 4.28Å; I18-I55 HydrophobicContact CD1-CG2 4.17Å; V45-I55 HydrophobicContact CG1-CD1 3.1Å; C51-I55 HydrophobicContact CB-CD1 4.18Å; C51-I55 WeakPolarHBondContact O-CD1 3.31Å; C51-I55 VanDerWaalsContact O-CG1 3.27Å; C51-I55 WeakPolarHBondContact O-CG1 3.36Å; C51-I55 PolarHBondContact O-N 3Å; L52-I55 PolarHBondContact O-N 3.32Å; I55-P57 WeakPolarHBondContact O-CD 3.36Å
56V42.2Very low39.3Very low48 Ų48105 Ų10529%0.29154%0.542SS..SBendtrans-110.795177.5-173.50000106.2L52 F77L52-V56 HydrophobicContact CD2-CG2 4.23Å; L52-V56 PolarHBondContact O-N 3.03Å; V56-F77 HydrophobicContact CG1-CD2 4.13Å
57P39.1Very low38.8Very low92 Ų92106.9 Ų106.960%0.59756%0.557SS**  trans-54.3132.6169.222-30.5000107.4I55I55-P57 WeakPolarHBondContact O-CD 3.36Å
58P36.5Very low38.6Very low99 Ų99113.5 Ų113.564%0.64357%0.572SS**  trans-51.5136.6176.622.2-32.1000107.1S60P58-S60 VanDerWaalsContact C-N 3.29Å; P58-S60 PolarHBondContact O-N 3.34Å
59P38.4Very low38.3Very low110 Ų110115.8 Ų115.871%0.71458%0.584SS**  trans-54.1100.8-173.921.7-32.5000107.3L61P59-L61 PolarHBondContact O-N 2.82Å
60S34.6Very low37.9Very low98 Ų98113.2 Ų113.269%0.68558%0.578SS**  trans-65.3110.8175.141.40000102.7P58 Q62P58-S60 VanDerWaalsContact C-N 3.29Å; P58-S60 PolarHBondContact O-N 3.34Å; S60-Q62 PolarHBondContact O-N 2.85Å
61L32.5Very low37.8Very low173 Ų173117.6 Ų117.691%0.90659%0.594SS**  trans-63.749.2175.2-77.8155.4000110.1P59 R63P59-L61 PolarHBondContact O-N 2.82Å; L61-R63 PolarHBondContact O-N 3.42Å
62Q29.9Very low38.1Very low147 Ų147122.3 Ų122.369%0.68762%0.616SS**  trans-68.697.3159.2-107.4-172.6-14.600106.1S60 Q64S60-Q62 PolarHBondContact O-N 2.85Å; Q62-Q64 PolarHBondContact O-N 3.16Å
63R35.9Very low38.1Very low249 Ų249121.5 Ų121.594%0.9462%0.62SS**  trans-59.931.1177-155.8178.1-171.1166.82.2113.4L61L61-R63 PolarHBondContact O-N 3.42Å
64Q30.1Very low38.4Very low139 Ų139121.3 Ų121.365%0.6562%0.615SS**  trans-103.7108.3-179-92179.4-79.100111.5Q62Q62-Q64 PolarHBondContact O-N 3.16Å
65Q31.4Very low38.6Very low158 Ų158122.2 Ų122.274%0.73862%0.616SS**  trans62.988.3144.3-70.7168.5-58.500116.7S67Q65-S67 VanDerWaalsContact C-N 3.33Å; Q65-S67 PolarHBondContact O-N 2.87Å
66R36Very low38.9Very low266 Ų266123.3 Ų123.3100%1.00462%0.622SS**  34.659.4121-152.4-175.7-152.3-179.86.5114.8
67S40Very low39.3Very low69 Ų69125.9 Ų125.948%0.48363%0.629SS.*  trans-128129.3163.9-172.90000107.8Q65 N69 L70Q65-S67 VanDerWaalsContact C-N 3.33Å; Q65-S67 PolarHBondContact O-N 2.87Å; S67-N69 PolarHBondContact O-N 2.95Å; S67-L70 PolarHBondContact O-N 3.36Å
68R43.6Very low39.9Very low223 Ų223126.4 Ų126.484%0.84262%0.624SS**THydrogen-bonded Turntrans-49.1-19.5-176.4-78.4171.5156.4164.9-8.7114.2L70 L71R68-L70 PolarHBondContact O-N 2.85Å; R68-L71 PolarHBondContact O-N 3.49Å
69N37.2Very low40.5Very low104 Ų104127.9 Ų127.956%0.55662%0.624SS**Hα-helixtrans-60.4-26.4-178-56.31.4000114.1S67 E72 G73S67-N69 PolarHBondContact O-N 2.95Å; N69-E72 PolarHBondContact O-N 2.85Å; N69-G73 PolarHBondContact O-N 3.21Å
70L35.9Very low41.2Very low127 Ų127124 Ų12467%0.66560%0.596SS**Hα-helixtrans-72.2-33.3-179.9-154.5139.9000111.8S67 R68 E72 G73 V74S67-L70 PolarHBondContact O-N 3.36Å; R68-L70 PolarHBondContact O-N 2.85Å; L70-E72 VanDerWaalsContact C-N 3.32Å; L70-G73 PolarHBondContact O-N 2.94Å; L70-V74 HydrophobicContact CD2-CG2 4.45Å; L70-V74 WeakPolarHBondContact O-CG2 3.5Å; L70-V74 PolarHBondContact O-N 2.87Å; L70-V74 VanDerWaalsContact O-N 3.16Å
71L41.8Very low41.9Very low124 Ų124122.4 Ų122.465%0.64959%0.585SS**Hα-helixtrans-67.4-37.7174.2-146.683.8000110.6R68 V74 H75R68-L71 PolarHBondContact O-N 3.49Å; L71-V74 PolarHBondContact O-N 3.27Å; L71-H75 WeakPolarHBondContact O-CB 3.26Å; L71-H75 PolarHBondContact O-CD2 3.15Å; L71-H75 VanDerWaalsContact O-CD2 3.3Å; L71-H75 PolarHBondContact O-N 2.88Å
72E43.3Very low42.7Very low99 Ų99119.2 Ų119.246%0.46357%0.569SS.*Hα-helixtrans-64.8-41.6174.6-69.3178.5167.300111.8N69 L70 V74 H75 L76N69-E72 PolarHBondContact O-N 2.85Å; L70-E72 VanDerWaalsContact C-N 3.32Å; E72-V74 PolarHBondContact O-N 2.81Å; E72-H75 PolarHBondContact O-N 3.29Å; E72-L76 VanDerWaalsContact O-CB 3.31Å; E72-L76 WeakPolarHBondContact O-CB 3.32Å; E72-L76 PolarHBondContact O-N 3.48Å
73G42Very low43.5Very low32 Ų32114.9 Ų114.933%0.3355%0.548SS..Hα-helixtrans-62.3-41.5177.100000113.2N69 L70 L76 F77N69-G73 PolarHBondContact O-N 3.21Å; L70-G73 PolarHBondContact O-N 2.94Å; G73-L76 PolarHBondContact O-N 3.28Å; G73-F77 PolarHBondContact O-N 3.01Å
74V48.3Very low43.9Very low77 Ų77103.2 Ų103.247%0.46750%0.504SS..Hα-helixtrans-67.1-45.3175.6176.80000111L70 L71 E72 L76 F77 E78L70-V74 HydrophobicContact CD2-CG2 4.45Å; L70-V74 WeakPolarHBondContact O-CG2 3.5Å; L70-V74 PolarHBondContact O-N 2.87Å; L70-V74 VanDerWaalsContact O-N 3.16Å; L71-V74 PolarHBondContact O-N 3.27Å; E72-V74 PolarHBondContact O-N 2.81Å; V74-L76 VanDerWaalsContact C-N 3.29Å; V74-L76 PolarHBondContact O-N 3.08Å; V74-F77 PolarHBondContact O-N 3.48Å; V74-E78 PolarHBondContact O-N 3.37Å
75H49.5Very low44.6Very low109 Ų10998.6 Ų98.651%0.50549%0.494SS..Hα-helixtrans-61.4-37.4175.8-89.8-63.6000112.5L71 E72 E78 M79L71-H75 WeakPolarHBondContact O-CB 3.26Å; L71-H75 PolarHBondContact O-CD2 3.15Å; L71-H75 VanDerWaalsContact O-CD2 3.3Å; L71-H75 PolarHBondContact O-N 2.88Å; E72-H75 PolarHBondContact O-N 3.29Å; H75-E78 PolarHBondContact O-N 3.1Å; H75-M79 VanDerWaalsContact O-CB 3.23Å; H75-M79 WeakPolarHBondContact O-CB 3.41Å; H75-M79 PolarHBondContact O-N 3.28Å
76L49Very low45.3Very low46 Ų46100.8 Ų100.824%0.24150%0.496CS..Hα-helixtrans-66.4-44.8175.5-168.198.6000110.9I18 Y22 E72 G73 V74 E78 M79 I80I18-L76 HydrophobicContact CG2-CD2 4Å; Y22-L76 HydrophobicContact CE2-CD1 4.01Å; Y22-L76 HydrophobicContact CE2-CD2 4.05Å; E72-L76 VanDerWaalsContact O-CB 3.31Å; E72-L76 WeakPolarHBondContact O-CB 3.32Å; E72-L76 PolarHBondContact O-N 3.48Å; G73-L76 PolarHBondContact O-N 3.28Å; V74-L76 VanDerWaalsContact C-N 3.29Å; V74-L76 PolarHBondContact O-N 3.08Å; L76-E78 VanDerWaalsContact C-N 3.35Å; L76-E78 PolarHBondContact O-N 2.81Å; L76-M79 PolarHBondContact O-N 2.93Å; L76-I80 HydrophobicContact CD2-CD1 3.81Å; L76-I80 HydrophobicContact CG-CD1 3.9Å; L76-I80 HydrophobicContact CG-CG1 4.47Å; L76-I80 WeakPolarHBondContact O-CB 3.39Å; L76-I80 VanDerWaalsContact O-CG1 3.28Å; L76-I80 WeakPolarHBondContact O-CG1 3.42Å; L76-I80 PolarHBondContact O-N 3.43Å
77F50.7Low45.4Very low102 Ų10293.3 Ų93.345%0.44747%0.468SS..Hα-helixtrans-60.4-45175.4-177.3-95.1000111.3L52 V56 G73 V74 M79 I80 S81L52-F77 HydrophobicContact CD2-CE2 4.24Å; V56-F77 HydrophobicContact CG1-CD2 4.13Å; G73-F77 PolarHBondContact O-N 3.01Å; V74-F77 PolarHBondContact O-N 3.48Å; F77-M79 VanDerWaalsContact C-N 3.34Å; F77-M79 PolarHBondContact O-N 3.08Å; F77-I80 PolarHBondContact O-N 3.04Å; F77-S81 WeakPolarHBondContact O-CB 3.4Å; F77-S81 PolarHBondContact O-N 3.05Å
78E50.9Low45Very low103 Ų10396 Ų9648%0.48148%0.476SS..Hα-helixtrans-62.5-39.9173.3-83-169.2144.900112.3V74 H75 L76 S81 N82V74-E78 PolarHBondContact O-N 3.37Å; H75-E78 PolarHBondContact O-N 3.1Å; L76-E78 VanDerWaalsContact C-N 3.35Å; L76-E78 PolarHBondContact O-N 2.81Å; E78-S81 PolarHBondContact O-N 3.36Å; E78-N82 WeakPolarHBondContact O-CB 3.28Å; E78-N82 PolarHBondContact O-N 3.23Å; E78-N82 PolarHBondContact O-ND2 3.15Å
79M50.4Low44.5Very low131 Ų13194.4 Ų94.465%0.64549%0.491SS*.Hα-helixtrans-66.2-46179.4-171.4179.3-70.300110.9H75 L76 F77 F83H75-M79 VanDerWaalsContact O-CB 3.23Å; H75-M79 WeakPolarHBondContact O-CB 3.41Å; H75-M79 PolarHBondContact O-N 3.28Å; L76-M79 PolarHBondContact O-N 2.93Å; F77-M79 VanDerWaalsContact C-N 3.34Å; F77-M79 PolarHBondContact O-N 3.08Å; M79-F83 WeakPolarHBondContact O-CB 3.36Å; M79-F83 PolarHBondContact O-N 3.33Å
80I52.4Low44.9Very low28 Ų2894 Ų9414%0.14449%0.487CS..Hα-helixtrans-65.1-44.8175.9-64.9168000110I18 M42 V46 L76 F77 F83 V84I18-I80 HydrophobicContact CD1-CD1 4.4Å; I18-I80 HydrophobicContact CG1-CD1 4.37Å; M42-I80 HydrophobicContact CE-CG1 4.48Å; M42-I80 HydrophobicContact SD-CG1 4.36Å; M42-I80 HydrophobicContact SD-CG2 4.28Å; V46-I80 HydrophobicContact CG2-CG2 4.45Å; L76-I80 HydrophobicContact CD2-CD1 3.81Å; L76-I80 HydrophobicContact CG-CD1 3.9Å; L76-I80 HydrophobicContact CG-CG1 4.47Å; L76-I80 WeakPolarHBondContact O-CB 3.39Å; L76-I80 VanDerWaalsContact O-CG1 3.28Å; L76-I80 WeakPolarHBondContact O-CG1 3.42Å; L76-I80 PolarHBondContact O-N 3.43Å; F77-I80 PolarHBondContact O-N 3.04Å; I80-F83 WeakPolarHBondContact O-CB 3.25Å; I80-F83 PolarHBondContact O-N 2.87Å; I80-V84 WeakPolarHBondContact O-CG2 3.1Å; I80-V84 PolarHBondContact O-N 2.84Å
81S48.6Very low45.4Very low65 Ų6592.2 Ų92.246%0.45548%0.478SS..Hα-helixtrans-65.4-41.1179.8-171.30000112.2F77 E78 F83 G85F77-S81 WeakPolarHBondContact O-CB 3.4Å; F77-S81 PolarHBondContact O-N 3.05Å; E78-S81 PolarHBondContact O-N 3.36Å; S81-F83 VanDerWaalsContact C-N 3.35Å; S81-G85 PolarHBondContact O-N 3.09Å
82N50.1Low45.6Very low105 Ų10590.4 Ų90.456%0.56147%0.469SS*.Hα-helixtrans-66.7-39.4174.7-85-49000111.4E78 R86E78-N82 WeakPolarHBondContact O-CB 3.28Å; E78-N82 PolarHBondContact O-N 3.23Å; E78-N82 PolarHBondContact O-ND2 3.15Å; N82-R86 WeakPolarHBondContact O-CG 3.24Å; N82-R86 PolarHBondContact O-N 2.82Å; N82-R86 VanDerWaalsContact O-N 3.15Å
83F47.1Very low45.7Very low57 Ų5789.9 Ų89.925%0.2547%0.469CS..Hα-helixtrans-61.5-50176.4-176.4-119.1000110.5M42 M79 I80 S81 R86 Y87M42-F83 HydrophobicContact CB-CE1 4.36Å; M42-F83 HydrophobicContact SD-CD1 4.28Å; M42-F83 HydrophobicContact SD-CE1 4.33Å; M79-F83 WeakPolarHBondContact O-CB 3.36Å; M79-F83 PolarHBondContact O-N 3.33Å; I80-F83 WeakPolarHBondContact O-CB 3.25Å; I80-F83 PolarHBondContact O-N 2.87Å; S81-F83 VanDerWaalsContact C-N 3.35Å; F83-R86 WeakPolarHBondContact O-CB 3.09Å; F83-R86 PolarHBondContact O-N 3.43Å; F83-Y87 HydrophobicContact CD1-CE2 4.46Å; F83-Y87 AromaticContact CD2-CE2 3.98Å; F83-Y87 HydrophobicContact CD2-CE2 3.98Å; F83-Y87 HydrophobicContact CE1-CE2 4.37Å; F83-Y87 AromaticContact CE2-CE2 3.81Å; F83-Y87 HydrophobicContact CE2-CE2 3.81Å; F83-Y87 HydrophobicContact CG-CE2 4.33Å; F83-Y87 HydrophobicContact CZ-CE2 4.07Å; F83-Y87 WeakPolarHBondContact O-CD2 3.49Å
84V44.4Very low45.9Very low3 Ų393.6 Ų93.62%0.01848%0.478CS..Hα-helixtrans-68.1-40.3178.4178.60000112.2V43 V46 I80 R86 Y87 I88V43-V84 HydrophobicContact CG2-CG1 4.31Å; V43-V84 HydrophobicContact CG2-CG2 4.31Å; V46-V84 HydrophobicContact CB-CB 4.42Å; V46-V84 HydrophobicContact CB-CG1 3.98Å; V46-V84 HydrophobicContact CB-CG2 3.85Å; V46-V84 HydrophobicContact CG1-CB 3.91Å; V46-V84 HydrophobicContact CG1-CG1 3.41Å; V46-V84 VanDerWaalsContact CG1-CG1 3.41Å; V46-V84 HydrophobicContact CG1-CG2 3.85Å; V46-V84 HydrophobicContact CG2-CG2 3.9Å; I80-V84 WeakPolarHBondContact O-CG2 3.1Å; I80-V84 PolarHBondContact O-N 2.84Å; V84-R86 PolarHBondContact O-N 3.36Å; V84-R86 VanDerWaalsContact O-N 3.14Å; V84-Y87 WeakPolarHBondContact O-CA 3.07Å; V84-Y87 PolarHBondContact O-N 3.49Å; V84-I88 HydrophobicContact CG1-CD1 4.21Å; V84-I88 HydrophobicContact CG1-CG1 4.4Å; V84-I88 PolarHBondContact O-N 3.14Å
85G45.1Very low45.8Very low42 Ų4294.7 Ų94.743%0.43348%0.478SS..Hα-helixtrans-57.2-28.5176.200000113.4S81 Y87 I88S81-G85 PolarHBondContact O-N 3.09Å; G85-Y87 VanDerWaalsContact C-N 3.29Å; G85-Y87 PolarHBondContact O-N 2.85Å; G85-I88 PolarHBondContact O-N 3.3Å
86R44.7Very low45.5Very low204 Ų20493.6 Ų93.677%0.7748%0.477SS*.THydrogen-bonded Turntrans-72-18173-74.7178.1178.3-164.40.2114.3N82 F83 V84N82-R86 WeakPolarHBondContact O-CG 3.24Å; N82-R86 PolarHBondContact O-N 2.82Å; N82-R86 VanDerWaalsContact O-N 3.15Å; F83-R86 WeakPolarHBondContact O-CB 3.09Å; F83-R86 PolarHBondContact O-N 3.43Å; V84-R86 PolarHBondContact O-N 3.36Å; V84-R86 VanDerWaalsContact O-N 3.14Å
87Y39.1Very low45.2Very low109 Ų10997.3 Ų97.343%0.42750%0.495SS..THydrogen-bonded Turntrans-99.4-3.2176.9-67.7-82.4000113.5S39 V43 F83 V84 G85 V89S39-Y87 WeakPolarHBondContact CB-OH 3.4Å; S39-Y87 PolarHBondContact OG-OH 3.34Å; V43-Y87 HydrophobicContact CG2-CD2 3.59Å; V43-Y87 HydrophobicContact CG2-CE2 4.49Å; V43-Y87 HydrophobicContact CG2-CG 3.64Å; F83-Y87 HydrophobicContact CD1-CE2 4.46Å; F83-Y87 AromaticContact CD2-CE2 3.98Å; F83-Y87 HydrophobicContact CD2-CE2 3.98Å; F83-Y87 HydrophobicContact CE1-CE2 4.37Å; F83-Y87 AromaticContact CE2-CE2 3.81Å; F83-Y87 HydrophobicContact CE2-CE2 3.81Å; F83-Y87 HydrophobicContact CG-CE2 4.33Å; F83-Y87 HydrophobicContact CZ-CE2 4.07Å; F83-Y87 WeakPolarHBondContact O-CD2 3.49Å; V84-Y87 WeakPolarHBondContact O-CA 3.07Å; V84-Y87 PolarHBondContact O-N 3.49Å; G85-Y87 VanDerWaalsContact C-N 3.29Å; G85-Y87 PolarHBondContact O-N 2.85Å; Y87-V89 PolarHBondContact O-N 3.47Å
88I31.1Very low44.8Very low125 Ų12596.9 Ų96.964%0.64150%0.499SS*.  trans-89.136.2173.4-49.9173.3000110.4V84 G85V84-I88 HydrophobicContact CG1-CD1 4.21Å; V84-I88 HydrophobicContact CG1-CG1 4.4Å; V84-I88 PolarHBondContact O-N 3.14Å; G85-I88 PolarHBondContact O-N 3.3Å
89V33.6Very low44.2Very low191 Ų19196.4 Ų96.4100%1.15850%0.5SS*.  trans-115.80168-175.80000107.9Y87Y87-V89 PolarHBondContact O-N 3.47Å

Retrieved 89 of 89 residues in 103.8 ms (Link to these results)