A0A077ZEE4_TRITR Loading...

Protein FAM36A

AlphaFold DB , UniProt , Accession A0A077ZEE4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 105 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
1M36.2Very low44.1Very low240 Ų240151.2 Ų151.2100%1.18279%0.791SS**  096.30-114.8168.1175.100106.9
2T45.7Very low44.3Very low147 Ų147151.8 Ų151.890%0.90279%0.787SS**  trans-104.492.5170.338.30000105.9
3T44.3Very low44.3Very low134 Ų134154 Ų15482%0.82279%0.787SS**  trans-66.7137.9169.5-18.90000108.4
4E57.5Low44.5Very low178 Ų178148.4 Ų148.483%0.83276%0.764SS**  trans-51.5177.4168.6-79.7167.980.100113.8
5E42.4Very low44.9Very low188 Ų188146.3 Ų146.388%0.87976%0.761SS**  trans88.8116.8-179.6-50.4-173.5124.600110.7
6D42Very low45.4Very low131 Ų131140.1 Ų140.170%0.70174%0.744SS**  -174.210950.1-168.6-108.5000106.9P8D6-P8 WeakPolarHBondContact OD1-CD 3.44Å; D6-P8 WeakPolarHBondContact OD1-CG 3.49Å; D6-P8 WeakPolarHBondContact OD2-CD 3.49Å; D6-P8 WeakPolarHBondContact OD2-CG 3.39Å
7K38.1Very low45.7Very low200 Ų200139.1 Ų139.187%0.8774%0.737SS**  trans-132.667150.6-153.9176.7-173.4-179.80109.9
8P40.2Very low45.9Very low75 Ų75141.3 Ų141.349%0.48773%0.734SS.*  trans-71.1133170.332.7-32.9000108.2D6D6-P8 WeakPolarHBondContact OD1-CD 3.44Å; D6-P8 WeakPolarHBondContact OD1-CG 3.49Å; D6-P8 WeakPolarHBondContact OD2-CD 3.49Å; D6-P8 WeakPolarHBondContact OD2-CG 3.39Å
9N46.6Very low46.1Very low116 Ų116144.6 Ų144.662%0.6274%0.736SS**SBend75.742.3125.1-149.3-0.8000118.1
10S47Very low46.2Very low97 Ų97141.4 Ų141.468%0.67872%0.72SS**SBendtrans-107-23.1159.373.60000114.5
11E45.8Very low46.4Very low157 Ų157138.4 Ų138.473%0.73471%0.705SS**SBendtrans-84.6-13.7179-77.9-162.59900114.2K22E11-K22 IonicContact OE1-NZ 3.94Å
12Q46.1Very low47Very low158 Ų158134.6 Ų134.674%0.73868%0.682SS**THydrogen-bonded Turntrans-89-11.4-169.2-148.7175-23.700114
13K44Very low47.5Very low181 Ų181131.5 Ų131.579%0.78766%0.657SS**THydrogen-bonded Turntrans-107.19.3-172.6-130.5-177.3-177.2-176.90115.6T15K13-T15 PolarHBondContact O-N 3.32Å
14T47.6Very low48.2Very low76 Ų76129.6 Ų129.647%0.46665%0.647SS.*  trans-89.963.916420.80000109.5G16 W18T14-G16 PolarHBondContact O-N 3.04Å; T14-W18 HydrophobicContact CG2-CB 4Å; T14-W18 HydrophobicContact CG2-CG 3.89Å
15T50.8Low48.3Very low117 Ų117122.4 Ų122.472%0.71862%0.616SS**  trans-62.8120.2-179.131.70000111.7K13 I17K13-T15 PolarHBondContact O-N 3.32Å; T15-I17 PolarHBondContact O-N 3.22Å
16G51.9Low49.3Very low47 Ų47116.6 Ų116.649%0.48559%0.588SS.*SBendtrans87.8-79.5165.800000115.3T14 L20T14-G16 PolarHBondContact O-N 3.04Å; G16-L20 WeakPolarHBondContact O-CD1 3.49Å; G16-L20 PolarHBondContact O-N 2.96Å
17I51.5Low50.5Low122 Ų122113.3 Ų113.363%0.62657%0.573SS**Hα-helixtrans-76.4-39.4-161.6-53171.2000111.8T15 L20 L21T15-I17 PolarHBondContact O-N 3.22Å; I17-L20 WeakPolarHBondContact O-CB 3.48Å; I17-L20 PolarHBondContact O-N 3.25Å; I17-L21 HydrophobicContact CG2-CD1 4.02Å; I17-L21 WeakPolarHBondContact O-CD1 3.48Å; I17-L21 PolarHBondContact O-N 3.37Å
18W47.8Very low51.6Low180 Ų180110.2 Ų110.268%0.68256%0.556SS**Hα-helixtrans-70.7-31.5178.7-8690000113.1T14 L20 L21 K22T14-W18 HydrophobicContact CG2-CB 4Å; T14-W18 HydrophobicContact CG2-CG 3.89Å; W18-L20 VanDerWaalsContact C-N 3.34Å; W18-L21 PolarHBondContact O-N 3.5Å; W18-K22 WeakPolarHBondContact O-CB 3.46Å; W18-K22 PolarHBondContact O-N 2.98Å
19R50.4Low52.8Low204 Ų204107.2 Ų107.277%0.7754%0.536SS*.Hα-helixtrans-65.5-41.3174.5-143.6-173.1-134.2-168.13.6110.8K22 E23R19-K22 PolarHBondContact O-N 3.44Å; R19-E23 PolarHBondContact O-N 3.08Å
20L49Very low53.7Low79 Ų79104.7 Ų104.741%0.41452%0.521SS..Hα-helixtrans-59.4-49.1170.5-81150.5000111G16 I17 W18 K22 E23 F26G16-L20 WeakPolarHBondContact O-CD1 3.49Å; G16-L20 PolarHBondContact O-N 2.96Å; I17-L20 WeakPolarHBondContact O-CB 3.48Å; I17-L20 PolarHBondContact O-N 3.25Å; W18-L20 VanDerWaalsContact C-N 3.34Å; L20-K22 VanDerWaalsContact C-N 3.29Å; L20-K22 PolarHBondContact O-N 2.97Å; L20-E23 WeakPolarHBondContact O-CB 3.46Å; L20-E23 PolarHBondContact O-N 3.17Å; L20-F26 HydrophobicContact CB-CD1 4.15Å; L20-F26 HydrophobicContact CB-CD2 4.32Å; L20-F26 HydrophobicContact CB-CE1 4.42Å; L20-F26 HydrophobicContact CB-CG 4.1Å; L20-F26 HydrophobicContact CD2-CD2 3.86Å; L20-F26 HydrophobicContact CD2-CE2 4.21Å; L20-F26 HydrophobicContact CD2-CG 4.34Å; L20-F26 WeakPolarHBondContact O-CB 3.23Å
21L50.6Low54.9Low79 Ų79103.3 Ų103.341%0.41451%0.51SS..Hα-helixtrans-61.4-31.1176.6-85.4143.2000114.2I17 W18 E23 F26 V27I17-L21 HydrophobicContact CG2-CD1 4.02Å; I17-L21 WeakPolarHBondContact O-CD1 3.48Å; I17-L21 PolarHBondContact O-N 3.37Å; W18-L21 PolarHBondContact O-N 3.5Å; L21-E23 PolarHBondContact O-N 3.25Å; L21-F26 HydrophobicContact CG-CD1 4.44Å; L21-V27 HydrophobicContact CD2-CG2 4.36Å; L21-V27 WeakPolarHBondContact O-CG2 3.33Å
22K48.9Very low56.1Low160 Ų160102.3 Ų102.370%0.69650%0.501SS*.Hα-helixtrans-73.7-20.9176.9-161.7171.5-177.8173.40111.8E11 W18 R19 L20 P24E11-K22 IonicContact OE1-NZ 3.94Å; W18-K22 WeakPolarHBondContact O-CB 3.46Å; W18-K22 PolarHBondContact O-N 2.98Å; R19-K22 PolarHBondContact O-N 3.44Å; L20-K22 VanDerWaalsContact C-N 3.29Å; L20-K22 PolarHBondContact O-N 2.97Å; K22-P24 VanDerWaalsContact O-CD 3.31Å; K22-P24 WeakPolarHBondContact O-CD 3.42Å
23E55.7Low57.3Low83 Ų8394.8 Ų94.839%0.38847%0.466SS..SBendtrans-78110.9175.1-139.5147.9-168.500108.1R19 L20 L21 C25 F26 K77R19-E23 PolarHBondContact O-N 3.08Å; L20-E23 WeakPolarHBondContact O-CB 3.46Å; L20-E23 PolarHBondContact O-N 3.17Å; L21-E23 PolarHBondContact O-N 3.25Å; E23-C25 PolarHBondContact O-N 2.87Å; E23-F26 PolarHBondContact O-N 3.07Å; E23-K77 IonicContact OE1-NZ 2.86Å; E23-K77 PolarHBondContact OE1-NZ 2.9Å
24P58.7Low58.9Low93 Ų9391.2 Ų91.260%0.60445%0.454SS*.Hα-helixtrans-57.5-23.2-17322.9-33.8000112.2K22 R28K22-P24 VanDerWaalsContact O-CD 3.31Å; K22-P24 WeakPolarHBondContact O-CD 3.42Å; P24-R28 WeakPolarHBondContact O-CB 3.49Å; P24-R28 WeakPolarHBondContact O-CG 3.49Å; P24-R28 PolarHBondContact O-N 2.89Å
25C59.6Low60.4Low28 Ų2892.9 Ų92.919%0.18946%0.459CS..Hα-helixtrans-60.6-46.3171.5-85.70000114.1E23 V27 R28 C29 C73E23-C25 PolarHBondContact O-N 2.87Å; C25-V27 PolarHBondContact O-N 2.92Å; C25-R28 PolarHBondContact O-N 3.04Å; C25-C29 WeakPolarHBondContact O-CB 3.47Å; C25-C29 PolarHBondContact O-N 3.33Å; C25-C29 PolarHBondContact O-SG 3.28Å; C25-C73 WeakPolarHBondContact CA-SG 3.14Å; C25-C73 HydrophobicContact CB-CB 3.76Å; C25-C73 WeakPolarHBondContact CB-SG 3.47Å; C25-C73 WeakPolarHBondContact SG-CB 3.41Å; C25-C73 PolarHBondContact SG-O 2.67Å; C25-C73 CovalentContact SG-SG 2.03Å; C25-C73 PolarHBondContact SG-SG 3.23Å
26F63.8Low61.6Low66 Ų6688.3 Ų88.329%0.28944%0.435SS..Hα-helixtrans-66.1-42-176.6-174.6-103.2000111.3L20 L21 E23 C29 Q30L20-F26 HydrophobicContact CB-CD1 4.15Å; L20-F26 HydrophobicContact CB-CD2 4.32Å; L20-F26 HydrophobicContact CB-CE1 4.42Å; L20-F26 HydrophobicContact CB-CG 4.1Å; L20-F26 HydrophobicContact CD2-CD2 3.86Å; L20-F26 HydrophobicContact CD2-CE2 4.21Å; L20-F26 HydrophobicContact CD2-CG 4.34Å; L20-F26 WeakPolarHBondContact O-CB 3.23Å; L21-F26 HydrophobicContact CG-CD1 4.44Å; E23-F26 PolarHBondContact O-N 3.07Å; F26-C29 PolarHBondContact O-N 3.4Å; F26-Q30 HydrophobicContact CD1-CG 4.25Å; F26-Q30 HydrophobicContact CE1-CG 3.89Å; F26-Q30 HydrophobicContact CE2-CG 4.37Å; F26-Q30 HydrophobicContact CZ-CG 3.96Å; F26-Q30 WeakPolarHBondContact O-CG 3.34Å; F26-Q30 PolarHBondContact O-N 2.94Å
27V66.1Low62.7Low61 Ų6186.7 Ų86.737%0.3742%0.418SS..Hα-helixtrans-62.9-46.7176.7179.30000110.5L21 C25 C29 Q30 C31L21-V27 HydrophobicContact CD2-CG2 4.36Å; L21-V27 WeakPolarHBondContact O-CG2 3.33Å; C25-V27 PolarHBondContact O-N 2.92Å; V27-C29 PolarHBondContact O-N 2.9Å; V27-Q30 PolarHBondContact O-N 3.33Å; V27-C31 WeakPolarHBondContact O-CB 3.31Å; V27-C31 PolarHBondContact O-N 3.15Å; V27-C31 PolarHBondContact O-SG 3.43Å
28R62.5Low64.1Low136 Ų13686.8 Ų86.851%0.51341%0.414SS..Hα-helixtrans-59.2-47.1174.7-77.1-178.5179.1-173.60.3111.3P24 C25 Q30 C31 Y32 E76P24-R28 WeakPolarHBondContact O-CB 3.49Å; P24-R28 WeakPolarHBondContact O-CG 3.49Å; P24-R28 PolarHBondContact O-N 2.89Å; C25-R28 PolarHBondContact O-N 3.04Å; R28-Q30 VanDerWaalsContact C-N 3.33Å; R28-Q30 PolarHBondContact O-N 3.25Å; R28-C31 PolarHBondContact O-N 3.47Å; R28-Y32 HydrophobicContact CB-CD2 4.28Å; R28-Y32 HydrophobicContact CB-CE2 4.15Å; R28-Y32 WeakPolarHBondContact O-CD2 3.2Å; R28-Y32 PolarHBondContact O-N 3.35Å; R28-E76 IonicContact NH1-OE2 3.88Å
29C64Low65.7Low12 Ų1286 Ų868%0.08142%0.415CS..Hα-helixtrans-57.6-45.8178.7-69.90000112.1C25 F26 V27 Y32 G33 S69 Y70C25-C29 WeakPolarHBondContact O-CB 3.47Å; C25-C29 PolarHBondContact O-N 3.33Å; C25-C29 PolarHBondContact O-SG 3.28Å; F26-C29 PolarHBondContact O-N 3.4Å; V27-C29 PolarHBondContact O-N 2.9Å; C29-Y32 PolarHBondContact O-N 2.96Å; C29-G33 PolarHBondContact O-N 3.22Å; C29-S69 PolarHBondContact SG-O 3.22Å; C29-S69 VanDerWaalsContact SG-O 3.34Å; C29-Y70 VanDerWaalsContact SG-CA 3.57Å
30Q65.3Low67.1Low63 Ų6378.4 Ų78.429%0.29439%0.392SS..Hα-helixtrans-67.1-41.4178-70.4-75.851.900111.6F26 V27 R28 G33 I34 Y62F26-Q30 HydrophobicContact CD1-CG 4.25Å; F26-Q30 HydrophobicContact CE1-CG 3.89Å; F26-Q30 HydrophobicContact CE2-CG 4.37Å; F26-Q30 HydrophobicContact CZ-CG 3.96Å; F26-Q30 WeakPolarHBondContact O-CG 3.34Å; F26-Q30 PolarHBondContact O-N 2.94Å; V27-Q30 PolarHBondContact O-N 3.33Å; R28-Q30 VanDerWaalsContact C-N 3.33Å; R28-Q30 PolarHBondContact O-N 3.25Å; Q30-G33 PolarHBondContact O-N 3.06Å; Q30-I34 WeakPolarHBondContact O-CB 3.22Å; Q30-I34 WeakPolarHBondContact O-CD1 3.39Å; Q30-I34 WeakPolarHBondContact O-CG1 3.49Å; Q30-I34 PolarHBondContact O-N 3.45Å; Q30-Y62 PolarHBondContact OE1-OH 3.29Å
31C72.4Confident68.5Low68 Ų6876.8 Ų76.846%0.45939%0.386SS..Hα-helixtrans-61.4-45.9175.6-76.40000112.3V27 R28 I34 L35V27-C31 WeakPolarHBondContact O-CB 3.31Å; V27-C31 PolarHBondContact O-N 3.15Å; V27-C31 PolarHBondContact O-SG 3.43Å; R28-C31 PolarHBondContact O-N 3.47Å; C31-I34 PolarHBondContact O-N 3.02Å; C31-L35 WeakPolarHBondContact O-CB 3.46Å; C31-L35 WeakPolarHBondContact O-CG 3.36Å; C31-L35 PolarHBondContact O-N 3.27Å
32Y71.9Confident70Confident136 Ų13677.6 Ų77.653%0.53339%0.39SS..Hα-helixtrans-66.6-42.1176.8-73.7-65000111.8R28 C29 I34 L35 G36 V65 S69R28-Y32 HydrophobicContact CB-CD2 4.28Å; R28-Y32 HydrophobicContact CB-CE2 4.15Å; R28-Y32 WeakPolarHBondContact O-CD2 3.2Å; R28-Y32 PolarHBondContact O-N 3.35Å; C29-Y32 PolarHBondContact O-N 2.96Å; Y32-I34 PolarHBondContact O-N 3.41Å; Y32-L35 PolarHBondContact O-N 2.9Å; Y32-G36 PolarHBondContact O-N 3.45Å; Y32-V65 VanDerWaalsContact O-CG1 3.29Å; Y32-V65 WeakPolarHBondContact O-CG1 3.45Å; Y32-S69 WeakPolarHBondContact CB-OG 2.94Å
33G71.2Confident71.4Confident0 Ų072 Ų720%038%0.378CS..Hα-helixtrans-56.7-46.8173.600000112.7C29 Q30 A37C29-G33 PolarHBondContact O-N 3.22Å; Q30-G33 PolarHBondContact O-N 3.06Å; G33-A37 WeakPolarHBondContact O-CB 3.21Å; G33-A37 PolarHBondContact O-N 3.49Å
34I77.2Confident72.5Confident105 Ų10569.2 Ų69.254%0.53837%0.367SS..Hα-helixtrans-66.9-46.1177.5-67.5163.5000110.9Q30 C31 Y32 A37 F38Q30-I34 WeakPolarHBondContact O-CB 3.22Å; Q30-I34 WeakPolarHBondContact O-CD1 3.39Å; Q30-I34 WeakPolarHBondContact O-CG1 3.49Å; Q30-I34 PolarHBondContact O-N 3.45Å; C31-I34 PolarHBondContact O-N 3.02Å; Y32-I34 PolarHBondContact O-N 3.41Å; I34-A37 PolarHBondContact O-N 3.08Å; I34-F38 WeakPolarHBondContact O-CB 3.42Å; I34-F38 PolarHBondContact O-N 2.89Å
35L78.5Confident73.4Confident111 Ų11170.7 Ų70.758%0.58136%0.364SS*.Hα-helixtrans-61.2-46.2178.5-84.9161.1000111.9C31 Y32 F38 F39C31-L35 WeakPolarHBondContact O-CB 3.46Å; C31-L35 WeakPolarHBondContact O-CG 3.36Å; C31-L35 PolarHBondContact O-N 3.27Å; Y32-L35 PolarHBondContact O-N 2.9Å; L35-F38 PolarHBondContact O-N 2.89Å; L35-F39 PolarHBondContact O-N 3.38Å
36G75.5Confident74.5Confident21 Ų2172.6 Ų72.622%0.21639%0.389CS..Hα-helixtrans-64.4-44.9177.600000112.3Y32 F38 F39 V40Y32-G36 PolarHBondContact O-N 3.45Å; G36-F38 VanDerWaalsContact C-N 3.35Å; G36-F38 PolarHBondContact O-N 3.46Å; G36-F39 PolarHBondContact O-N 2.93Å; G36-V40 PolarHBondContact O-N 3.27Å
37A76.5Confident75.2Confident14 Ų1476.9 Ų76.912%0.11641%0.414CS..Hα-helixtrans-62.2-41.9174.900000111.7G33 I34 V40 C41 Y62G33-A37 WeakPolarHBondContact O-CB 3.21Å; G33-A37 PolarHBondContact O-N 3.49Å; I34-A37 PolarHBondContact O-N 3.08Å; A37-V40 PolarHBondContact O-N 3.5Å; A37-C41 VanDerWaalsContact O-CB 3.27Å; A37-C41 WeakPolarHBondContact O-CB 3.04Å; A37-C41 PolarHBondContact O-N 3.4Å; A37-C41 PolarHBondContact O-SG 3.43Å; A37-Y62 HydrophobicContact CB-CD2 4.36Å
38F79.4Confident75.9Confident124 Ų12476.7 Ų76.754%0.54441%0.413SS..Hα-helixtrans-62-44.9177.7-172.2-105.1000111.6I34 L35 G36 V40 C41 L42I34-F38 WeakPolarHBondContact O-CB 3.42Å; I34-F38 PolarHBondContact O-N 2.89Å; L35-F38 PolarHBondContact O-N 2.89Å; G36-F38 VanDerWaalsContact C-N 3.35Å; G36-F38 PolarHBondContact O-N 3.46Å; F38-V40 PolarHBondContact O-N 3.39Å; F38-C41 PolarHBondContact O-N 3.22Å; F38-L42 HydrophobicContact CD1-CD1 3.78Å; F38-L42 HydrophobicContact CD1-CG 4.4Å; F38-L42 HydrophobicContact CE1-CD1 3.32Å; F38-L42 HydrophobicContact CE1-CG 4.14Å; F38-L42 HydrophobicContact CZ-CD1 3.76Å; F38-L42 HydrophobicContact CZ-CD2 4.47Å; F38-L42 HydrophobicContact CZ-CG 4.24Å; F38-L42 WeakPolarHBondContact O-CG 3.46Å; F38-L42 PolarHBondContact O-N 3.04Å
39F82.9Confident76.5Confident163 Ų16373.1 Ų73.172%0.71542%0.418SS*.Hα-helixtrans-63.7-42.5179.1-139.9-94.6000112.1L35 G36 L42 G43L35-F39 PolarHBondContact O-N 3.38Å; G36-F39 PolarHBondContact O-N 2.93Å; F39-L42 PolarHBondContact O-N 3.42Å; F39-G43 PolarHBondContact O-N 2.9Å
40V78.6Confident77.2Confident45 Ų4574.6 Ų74.627%0.27343%0.429SS..Hα-helixtrans-70.5-38.6176.2174.10000111.9G36 A37 F38 L42 G43 T44 F57 T61G36-V40 PolarHBondContact O-N 3.27Å; A37-V40 PolarHBondContact O-N 3.5Å; F38-V40 PolarHBondContact O-N 3.39Å; V40-L42 PolarHBondContact O-N 2.91Å; V40-G43 PolarHBondContact O-N 3.32Å; V40-T44 HydrophobicContact CG1-CG2 3.83Å; V40-T44 WeakPolarHBondContact O-CB 3.34Å; V40-T44 WeakPolarHBondContact O-CG2 3.48Å; V40-T44 PolarHBondContact O-N 2.84Å; V40-T44 PolarHBondContact O-OG1 3.34Å; V40-F57 HydrophobicContact CG1-CB 4.38Å; V40-T61 HydrophobicContact CB-CG2 3.86Å; V40-T61 HydrophobicContact CG1-CG2 4.39Å; V40-T61 WeakPolarHBondContact CG1-OG1 3.13Å; V40-T61 HydrophobicContact CG2-CG2 3.46Å; V40-T61 VanDerWaalsContact CG2-CG2 3.46Å
41C78.6Confident77.8Confident44 Ų4475 Ų7530%0.29744%0.442SS..Hα-helixtrans-58.9-47.4174.2-79.90000111A37 F38 T44 F45 V54A37-C41 VanDerWaalsContact O-CB 3.27Å; A37-C41 WeakPolarHBondContact O-CB 3.04Å; A37-C41 PolarHBondContact O-N 3.4Å; A37-C41 PolarHBondContact O-SG 3.43Å; F38-C41 PolarHBondContact O-N 3.22Å; C41-T44 PolarHBondContact O-OG1 2.78Å; C41-F45 WeakPolarHBondContact O-CB 3.18Å; C41-F45 PolarHBondContact O-N 2.86Å; C41-V54 HydrophobicContact CB-CG1 4.16Å
42L81.9Confident78.2Confident96 Ų9675.1 Ų75.150%0.50345%0.448SS..Hα-helixtrans-63.1-46.6176.4-72.1179.1000112.4F38 F39 V40 F45 G46F38-L42 HydrophobicContact CD1-CD1 3.78Å; F38-L42 HydrophobicContact CD1-CG 4.4Å; F38-L42 HydrophobicContact CE1-CD1 3.32Å; F38-L42 HydrophobicContact CE1-CG 4.14Å; F38-L42 HydrophobicContact CZ-CD1 3.76Å; F38-L42 HydrophobicContact CZ-CD2 4.47Å; F38-L42 HydrophobicContact CZ-CG 4.24Å; F38-L42 WeakPolarHBondContact O-CG 3.46Å; F38-L42 PolarHBondContact O-N 3.04Å; F39-L42 PolarHBondContact O-N 3.42Å; V40-L42 PolarHBondContact O-N 2.91Å; L42-F45 PolarHBondContact O-N 3.22Å; L42-G46 PolarHBondContact O-N 2.74Å
43G79.7Confident78.6Confident43 Ų4374.1 Ų74.144%0.44345%0.447SS..Hα-helixtrans-62.9-48.6179.800000112.5F39 V40 G46 L47F39-G43 PolarHBondContact O-N 2.9Å; V40-G43 PolarHBondContact O-N 3.32Å; G43-G46 PolarHBondContact O-N 3.25Å; G43-L47 WeakPolarHBondContact O-CB 3.35Å; G43-L47 PolarHBondContact O-N 2.98Å
44T77.7Confident79Confident25 Ų2574.9 Ų74.915%0.15345%0.451CS..Hα-helixtrans-69.9-35178.955.70000112.4V40 C41 L47 T48 F57V40-T44 HydrophobicContact CG1-CG2 3.83Å; V40-T44 WeakPolarHBondContact O-CB 3.34Å; V40-T44 WeakPolarHBondContact O-CG2 3.48Å; V40-T44 PolarHBondContact O-N 2.84Å; V40-T44 PolarHBondContact O-OG1 3.34Å; C41-T44 PolarHBondContact O-OG1 2.78Å; T44-L47 PolarHBondContact O-N 3.25Å; T44-T48 PolarHBondContact O-N 3.37Å; T44-T48 PolarHBondContact O-OG1 2.87Å; T44-F57 HydrophobicContact CG2-CB 3.99Å; T44-F57 HydrophobicContact CG2-CD2 4.41Å; T44-F57 HydrophobicContact CG2-CG 4.22Å
45F79Confident79.1Confident123 Ų12376.7 Ų76.754%0.53946%0.457SS..Hα-helixtrans-64.6-44.5174.7-173.4-95.9000110.9C41 L42 L47 G49 V54C41-F45 WeakPolarHBondContact O-CB 3.18Å; C41-F45 PolarHBondContact O-N 2.86Å; L42-F45 PolarHBondContact O-N 3.22Å; F45-L47 VanDerWaalsContact C-N 3.32Å; F45-L47 PolarHBondContact O-N 3.48Å; F45-G49 WeakPolarHBondContact O-CA 3.2Å; F45-G49 PolarHBondContact O-N 3.38Å; F45-V54 HydrophobicContact CB-CG1 4.48Å; F45-V54 HydrophobicContact CB-CG2 3.91Å; F45-V54 HydrophobicContact CD2-CG2 4.19Å
46G81.8Confident79.3Confident68 Ų6880.5 Ų80.570%0.70146%0.464SS*.Hα-helixtrans-61.9-36.9173.400000113.4L42 G43L42-G46 PolarHBondContact O-N 2.74Å; G43-G46 PolarHBondContact O-N 3.25Å
47L78.3Confident79.6Confident157 Ų15784.9 Ų84.982%0.82248%0.477SS*.Hα-helixtrans-82.2-39.8-176.3-135104.1000114.1G43 T44 F45G43-L47 WeakPolarHBondContact O-CB 3.35Å; G43-L47 PolarHBondContact O-N 2.98Å; T44-L47 PolarHBondContact O-N 3.25Å; F45-L47 VanDerWaalsContact C-N 3.32Å; F45-L47 PolarHBondContact O-N 3.48Å
48T80.9Confident79.7Confident57 Ų5784.5 Ų84.535%0.3548%0.475SS..Hα-helixtrans-110.3-16.4-170.7540000114.5T44 S50 K53T44-T48 PolarHBondContact O-N 3.37Å; T44-T48 PolarHBondContact O-OG1 2.87Å; T48-S50 PolarHBondContact O-N 2.85Å; T48-K53 HydrophobicContact CG2-CD 4.38Å
49G75.6Confident79.7Confident60 Ų6081.5 Ų81.562%0.61947%0.469SS*.  trans57.99.3-178.900000115.1F45F45-G49 WeakPolarHBondContact O-CA 3.2Å; F45-G49 PolarHBondContact O-N 3.38Å
50S78.8Confident79.8Confident44 Ų4478.7 Ų78.731%0.30846%0.461SS..  trans-121.1107.9-168.9-170.10000110.9T48 A52 K53 V54T48-S50 PolarHBondContact O-N 2.85Å; S50-A52 PolarHBondContact O-N 2.88Å; S50-A52 VanDerWaalsContact O-N 3.16Å; S50-K53 PolarHBondContact O-N 3.49Å; S50-K53 VanDerWaalsContact O-N 3.08Å; S50-V54 WeakPolarHBondContact O-CG2 3.39Å; S50-V54 PolarHBondContact O-N 3.32Å; S50-V54 VanDerWaalsContact O-N 3.12Å
51A76.3Confident79.9Confident70 Ų7077.7 Ų77.758%0.57946%0.455SS*.Hα-helixtrans-55.1-35.3-176.700000113.6K53 V54 H55A51-K53 PolarHBondContact O-N 2.03Å; A51-V54 PolarHBondContact O-N 3.07Å; A51-H55 WeakPolarHBondContact O-CB 3.37Å; A51-H55 PolarHBondContact O-N 3.37Å
52A82.6Confident79.9Confident71 Ų7180.2 Ų80.259%0.58746%0.459SS*.Hα-helixtrans-64.7-38.6179.300000113S50 R56S50-A52 PolarHBondContact O-N 2.88Å; S50-A52 VanDerWaalsContact O-N 3.16Å; A52-R56 PolarHBondContact O-N 3.32Å
53K78.5Confident79.9Confident116 Ų11682.9 Ų82.950%0.50447%0.466SS..Hα-helixtrans-72.6-44.2176.1-70176.6-176.5159.80110.3T48 S50 A51 H55 R56 F57T48-K53 HydrophobicContact CG2-CD 4.38Å; S50-K53 PolarHBondContact O-N 3.49Å; S50-K53 VanDerWaalsContact O-N 3.08Å; A51-K53 PolarHBondContact O-N 2.03Å; K53-H55 VanDerWaalsContact C-N 3.27Å; K53-H55 PolarHBondContact O-N 3.34Å; K53-R56 PolarHBondContact O-N 3.29Å; K53-R56 VanDerWaalsContact O-N 3.14Å; K53-F57 HydrophobicContact CB-CD2 4.45Å; K53-F57 VanDerWaalsContact O-CD2 3.23Å; K53-F57 WeakPolarHBondContact O-CD2 3.33Å; K53-F57 PolarHBondContact O-N 3.43Å
54V80.5Confident80Confident15 Ų1584.5 Ų84.59%0.09147%0.468CS..Hα-helixtrans-55.4-43.8176.9176.20000111.1C41 F45 S50 A51 R56 F57 G58C41-V54 HydrophobicContact CB-CG1 4.16Å; F45-V54 HydrophobicContact CB-CG1 4.48Å; F45-V54 HydrophobicContact CB-CG2 3.91Å; F45-V54 HydrophobicContact CD2-CG2 4.19Å; S50-V54 WeakPolarHBondContact O-CG2 3.39Å; S50-V54 PolarHBondContact O-N 3.32Å; S50-V54 VanDerWaalsContact O-N 3.12Å; A51-V54 PolarHBondContact O-N 3.07Å; V54-R56 PolarHBondContact O-N 3.49Å; V54-F57 PolarHBondContact O-N 2.83Å; V54-G58 WeakPolarHBondContact O-CA 3.4Å; V54-G58 PolarHBondContact O-N 2.89Å
55H79.6Confident80.1Confident143 Ų14385 Ų8566%0.66247%0.47SS*.Hα-helixtrans-63.8-41178.8-168.3-83.8000112.8A51 K53 S59A51-H55 WeakPolarHBondContact O-CB 3.37Å; A51-H55 PolarHBondContact O-N 3.37Å; K53-H55 VanDerWaalsContact C-N 3.27Å; K53-H55 PolarHBondContact O-N 3.34Å; H55-S59 WeakPolarHBondContact O-CB 3.47Å; H55-S59 PolarHBondContact O-N 3.34Å; H55-S59 PolarHBondContact O-OG 2.89Å
56R82.4Confident80.1Confident191 Ų19180.3 Ų80.372%0.72145%0.453SS*.Hα-helixtrans-66.3-45176.4-74.9-173.1177.7167.80.4112.3A52 K53 V54 S59 I60A52-R56 PolarHBondContact O-N 3.32Å; K53-R56 PolarHBondContact O-N 3.29Å; K53-R56 VanDerWaalsContact O-N 3.14Å; V54-R56 PolarHBondContact O-N 3.49Å; R56-S59 PolarHBondContact O-OG 3.38Å; R56-S59 VanDerWaalsContact O-OG 3.1Å; R56-I60 WeakPolarHBondContact O-CD1 3.32Å; R56-I60 VanDerWaalsContact O-CG1 3.26Å; R56-I60 WeakPolarHBondContact O-CG1 3.28Å; R56-I60 PolarHBondContact O-N 3.19Å
57F82.1Confident80.1Confident113 Ų11380 Ų8050%0.49644%0.44SS..Hα-helixtrans-67.9-39.1177.2-78.5-71.4000111.8V40 T44 K53 V54 T61V40-F57 HydrophobicContact CG1-CB 4.38Å; T44-F57 HydrophobicContact CG2-CB 3.99Å; T44-F57 HydrophobicContact CG2-CD2 4.41Å; T44-F57 HydrophobicContact CG2-CG 4.22Å; K53-F57 HydrophobicContact CB-CD2 4.45Å; K53-F57 VanDerWaalsContact O-CD2 3.23Å; K53-F57 WeakPolarHBondContact O-CD2 3.33Å; K53-F57 PolarHBondContact O-N 3.43Å; V54-F57 PolarHBondContact O-N 2.83Å; F57-T61 VanDerWaalsContact O-CB 3.26Å; F57-T61 WeakPolarHBondContact O-CB 3.35Å; F57-T61 PolarHBondContact O-N 3.38Å; F57-T61 PolarHBondContact O-OG1 2.95Å
58G77.7Confident80.1Confident7 Ų775.9 Ų75.97%0.07242%0.424CS..Hα-helixtrans-62.1-45.3176.600000112.3V54 T61 Y62V54-G58 WeakPolarHBondContact O-CA 3.4Å; V54-G58 PolarHBondContact O-N 2.89Å; G58-T61 PolarHBondContact O-N 3.48Å; G58-Y62 VanDerWaalsContact O-CB 3.29Å; G58-Y62 WeakPolarHBondContact O-CB 3.37Å; G58-Y62 PolarHBondContact O-N 3.25Å
59S79.8Confident79.9Confident60 Ų6073.9 Ų73.942%0.4241%0.413SS..Hα-helixtrans-67.5-42.1178.967.90000112.8H55 R56 Y62 F63H55-S59 WeakPolarHBondContact O-CB 3.47Å; H55-S59 PolarHBondContact O-N 3.34Å; H55-S59 PolarHBondContact O-OG 2.89Å; R56-S59 PolarHBondContact O-OG 3.38Å; R56-S59 VanDerWaalsContact O-OG 3.1Å; S59-Y62 PolarHBondContact O-N 3.44Å; S59-F63 PolarHBondContact O-N 2.91Å
60I84.4Confident79.9Confident104 Ų10478.2 Ų78.253%0.53341%0.412SS..Hα-helixtrans-62.7-46175.5-66.1167000109.9R56 F63 V64R56-I60 WeakPolarHBondContact O-CD1 3.32Å; R56-I60 VanDerWaalsContact O-CG1 3.26Å; R56-I60 WeakPolarHBondContact O-CG1 3.28Å; R56-I60 PolarHBondContact O-N 3.19Å; I60-F63 PolarHBondContact O-N 3.46Å; I60-V64 HydrophobicContact CG2-CG2 4.41Å; I60-V64 WeakPolarHBondContact O-CG2 3.31Å; I60-V64 PolarHBondContact O-N 2.96Å
61T80.9Confident79.9Confident25 Ų2579.5 Ų79.515%0.15342%0.421CS..Hα-helixtrans-62.4-46177.9-58.80000111.1V40 F57 G58 F63 V64 V65V40-T61 HydrophobicContact CB-CG2 3.86Å; V40-T61 HydrophobicContact CG1-CG2 4.39Å; V40-T61 WeakPolarHBondContact CG1-OG1 3.13Å; V40-T61 HydrophobicContact CG2-CG2 3.46Å; V40-T61 VanDerWaalsContact CG2-CG2 3.46Å; F57-T61 VanDerWaalsContact O-CB 3.26Å; F57-T61 WeakPolarHBondContact O-CB 3.35Å; F57-T61 PolarHBondContact O-N 3.38Å; F57-T61 PolarHBondContact O-OG1 2.95Å; G58-T61 PolarHBondContact O-N 3.48Å; T61-F63 VanDerWaalsContact C-N 3.26Å; T61-F63 PolarHBondContact O-N 2.83Å; T61-V64 PolarHBondContact O-N 3.34Å; T61-V65 HydrophobicContact CG2-CG2 3.81Å; T61-V65 WeakPolarHBondContact O-CB 3.49Å; T61-V65 VanDerWaalsContact O-CG2 3.27Å; T61-V65 WeakPolarHBondContact O-CG2 3.42Å; T61-V65 PolarHBondContact O-N 2.86Å
62Y80Confident79.8Confident96 Ų9682.8 Ų82.838%0.37642%0.419SS..Hα-helixtrans-55-45.6176.3174.7-101.3000110.9Q30 A37 G58 S59 S66Q30-Y62 PolarHBondContact OE1-OH 3.29Å; A37-Y62 HydrophobicContact CB-CD2 4.36Å; G58-Y62 VanDerWaalsContact O-CB 3.29Å; G58-Y62 WeakPolarHBondContact O-CB 3.37Å; G58-Y62 PolarHBondContact O-N 3.25Å; S59-Y62 PolarHBondContact O-N 3.44Å; Y62-S66 WeakPolarHBondContact CE2-OG 3.36Å; Y62-S66 WeakPolarHBondContact O-CB 3.48Å; Y62-S66 PolarHBondContact O-N 3.49Å; Y62-S66 PolarHBondContact O-OG 2.91Å
63F81.6Confident79.4Confident152 Ų15279.9 Ų79.967%0.66739%0.394SS*.Hα-helixtrans-63.3-47.6178-172.7-98.3000112.2S59 I60 T61 S67S59-F63 PolarHBondContact O-N 2.91Å; I60-F63 PolarHBondContact O-N 3.46Å; T61-F63 VanDerWaalsContact C-N 3.26Å; T61-F63 PolarHBondContact O-N 2.83Å; F63-S67 VanDerWaalsContact O-CB 3.28Å; F63-S67 WeakPolarHBondContact O-CB 3.28Å; F63-S67 PolarHBondContact O-N 2.87Å
64V82Confident79.3Confident77 Ų7781.2 Ų81.247%0.46740%0.397SS..Hα-helixtrans-63.7-48.8179.7173.30000111.2I60 T61 S67 S68I60-V64 HydrophobicContact CG2-CG2 4.41Å; I60-V64 WeakPolarHBondContact O-CG2 3.31Å; I60-V64 PolarHBondContact O-N 2.96Å; T61-V64 PolarHBondContact O-N 3.34Å; V64-S67 PolarHBondContact O-N 2.82Å; V64-S68 WeakPolarHBondContact O-CB 3.49Å; V64-S68 PolarHBondContact O-N 3Å; V64-S68 PolarHBondContact O-OG 3.07Å; V64-S68 VanDerWaalsContact O-OG 3.07Å
65V79.9Confident79.2Confident35 Ų3587.2 Ų87.221%0.21242%0.422CS..Hα-helixtrans-67.7-39.6-178.6-179.90000110.9Y32 T61 S67 S68 S69Y32-V65 VanDerWaalsContact O-CG1 3.29Å; Y32-V65 WeakPolarHBondContact O-CG1 3.45Å; T61-V65 HydrophobicContact CG2-CG2 3.81Å; T61-V65 WeakPolarHBondContact O-CB 3.49Å; T61-V65 VanDerWaalsContact O-CG2 3.27Å; T61-V65 WeakPolarHBondContact O-CG2 3.42Å; T61-V65 PolarHBondContact O-N 2.86Å; V65-S67 VanDerWaalsContact C-N 3.34Å; V65-S68 PolarHBondContact O-N 3.31Å; V65-S69 VanDerWaalsContact O-CB 3.24Å; V65-S69 WeakPolarHBondContact O-CB 3.4Å; V65-S69 PolarHBondContact O-N 2.93Å; V65-S69 PolarHBondContact O-OG 3.04Å
66S78.5Confident78.8Confident25 Ų2583.6 Ų83.618%0.17541%0.406CS..Hα-helixtrans-62.6-43.3174.7-59.80000111.2Y62 Y70Y62-S66 WeakPolarHBondContact CE2-OG 3.36Å; Y62-S66 WeakPolarHBondContact O-CB 3.48Å; Y62-S66 PolarHBondContact O-N 3.49Å; Y62-S66 PolarHBondContact O-OG 2.91Å; S66-Y70 WeakPolarHBondContact O-CB 3.34Å; S66-Y70 PolarHBondContact O-N 3.32Å
67S81.2Confident78.5Confident61 Ų6178.3 Ų78.343%0.42739%0.388SS..Hα-helixtrans-64.6-48177-176.20000111.9F63 V64 V65 S69 Y70 S71F63-S67 VanDerWaalsContact O-CB 3.28Å; F63-S67 WeakPolarHBondContact O-CB 3.28Å; F63-S67 PolarHBondContact O-N 2.87Å; V64-S67 PolarHBondContact O-N 2.82Å; V65-S67 VanDerWaalsContact C-N 3.34Å; S67-S69 VanDerWaalsContact C-N 3.34Å; S67-S69 PolarHBondContact O-N 3.37Å; S67-Y70 WeakPolarHBondContact O-CB 3.37Å; S67-Y70 PolarHBondContact O-N 2.93Å; S67-S71 PolarHBondContact O-N 3.06Å; S67-S71 PolarHBondContact O-OG 2.88Å
68S79.2Confident78.4Confident71 Ų7174.7 Ų74.750%0.49738%0.375SS..Hα-helixtrans-61.5-41.6177.3-64.60000112.3V64 V65 Y70 S71 Y72V64-S68 WeakPolarHBondContact O-CB 3.49Å; V64-S68 PolarHBondContact O-N 3Å; V64-S68 PolarHBondContact O-OG 3.07Å; V64-S68 VanDerWaalsContact O-OG 3.07Å; V65-S68 PolarHBondContact O-N 3.31Å; S68-Y70 VanDerWaalsContact C-N 3.35Å; S68-S71 PolarHBondContact O-N 2.88Å; S68-Y72 WeakPolarHBondContact O-CB 3.05Å; S68-Y72 PolarHBondContact O-N 2.68Å
69S75.7Confident78.5Confident16 Ų1676.4 Ų76.411%0.11238%0.384CS..Hα-helixtrans-66.7-39.2178-55.10000111.3C29 Y32 V65 S67 Y72 C73C29-S69 PolarHBondContact SG-O 3.22Å; C29-S69 VanDerWaalsContact SG-O 3.34Å; Y32-S69 WeakPolarHBondContact CB-OG 2.94Å; V65-S69 VanDerWaalsContact O-CB 3.24Å; V65-S69 WeakPolarHBondContact O-CB 3.4Å; V65-S69 PolarHBondContact O-N 2.93Å; V65-S69 PolarHBondContact O-OG 3.04Å; S67-S69 VanDerWaalsContact C-N 3.34Å; S67-S69 PolarHBondContact O-N 3.37Å; S69-Y72 PolarHBondContact O-N 2.8Å; S69-C73 WeakPolarHBondContact O-CB 3.19Å; S69-C73 PolarHBondContact O-N 3.39Å
70Y75.3Confident78.3Confident151 Ų15179.5 Ų79.559%0.59239%0.393SS*.Hα-helixtrans-61.6-47.6174.2-179.2-97.7000111.4C29 S66 S67 S68 Y72 C73 Y74C29-Y70 VanDerWaalsContact SG-CA 3.57Å; S66-Y70 WeakPolarHBondContact O-CB 3.34Å; S66-Y70 PolarHBondContact O-N 3.32Å; S67-Y70 WeakPolarHBondContact O-CB 3.37Å; S67-Y70 PolarHBondContact O-N 2.93Å; S68-Y70 VanDerWaalsContact C-N 3.35Å; Y70-Y72 VanDerWaalsContact C-N 3.35Å; Y70-Y72 PolarHBondContact O-N 3.22Å; Y70-C73 PolarHBondContact O-N 3Å; Y70-Y74 WeakPolarHBondContact O-CB 3.41Å; Y70-Y74 PolarHBondContact O-N 3.35Å
71S79.5Confident78.1Confident70 Ų7080 Ų8049%0.4939%0.394SS..Hα-helixtrans-60-43.6175.6-64.40000112.2S67 S68 F75S67-S71 PolarHBondContact O-N 3.06Å; S67-S71 PolarHBondContact O-OG 2.88Å; S68-S71 PolarHBondContact O-N 2.88Å; S71-F75 WeakPolarHBondContact O-CB 3.35Å; S71-F75 PolarHBondContact O-N 2.9Å
72Y74.7Confident78Confident139 Ų13986.3 Ų86.355%0.54541%0.414SS..Hα-helixtrans-62.9-46.1177.4-174.7-91.5000111.6S68 S69 Y70 F75 E76S68-Y72 WeakPolarHBondContact O-CB 3.05Å; S68-Y72 PolarHBondContact O-N 2.68Å; S69-Y72 PolarHBondContact O-N 2.8Å; Y70-Y72 VanDerWaalsContact C-N 3.35Å; Y70-Y72 PolarHBondContact O-N 3.22Å; Y72-F75 WeakPolarHBondContact O-CB 3.24Å; Y72-F75 PolarHBondContact O-N 3.48Å; Y72-E76 HydrophobicContact CD1-CG 4.13Å; Y72-E76 HydrophobicContact CE1-CG 3.57Å; Y72-E76 PolarHBondContact O-N 3.43Å; Y72-E76 PolarHBondContact OH-OE1 2.89Å
73C73.1Confident78Confident10 Ų1085.7 Ų85.77%0.06842%0.418CS..Hα-helixtrans-71.3-34.8-179-148.10000113C25 S69 Y70 F75 E76 K77C25-C73 WeakPolarHBondContact CA-SG 3.14Å; C25-C73 HydrophobicContact CB-CB 3.76Å; C25-C73 WeakPolarHBondContact CB-SG 3.47Å; C25-C73 WeakPolarHBondContact SG-CB 3.41Å; C25-C73 PolarHBondContact SG-O 2.67Å; C25-C73 CovalentContact SG-SG 2.03Å; C25-C73 PolarHBondContact SG-SG 3.23Å; S69-C73 WeakPolarHBondContact O-CB 3.19Å; S69-C73 PolarHBondContact O-N 3.39Å; Y70-C73 PolarHBondContact O-N 3Å; C73-F75 VanDerWaalsContact C-N 3.3Å; C73-E76 PolarHBondContact O-N 3.01Å; C73-K77 WeakPolarHBondContact O-CB 3.33Å; C73-K77 PolarHBondContact O-N 3.41Å
74Y76.9Confident77.9Confident145 Ų14581.8 Ų81.857%0.56941%0.406SS*.Hα-helixtrans-60.3-44.3171.3-175.2-97.3000110.8Y70 K77 V78Y70-Y74 WeakPolarHBondContact O-CB 3.41Å; Y70-Y74 PolarHBondContact O-N 3.35Å; Y74-K77 PolarHBondContact O-N 2.81Å; Y74-V78 HydrophobicContact CD1-CG2 4.34Å; Y74-V78 HydrophobicContact CE1-CG2 3.98Å; Y74-V78 WeakPolarHBondContact O-CG2 3.42Å; Y74-V78 PolarHBondContact O-N 3.42Å
75F78.7Confident77.9Confident141 Ų14184.4 Ų84.462%0.61841%0.413SS*.Hα-helixtrans-63.1-45.3175.8-173.6-94.9000112.4S71 Y72 C73 K77 V78 T79S71-F75 WeakPolarHBondContact O-CB 3.35Å; S71-F75 PolarHBondContact O-N 2.9Å; Y72-F75 WeakPolarHBondContact O-CB 3.24Å; Y72-F75 PolarHBondContact O-N 3.48Å; C73-F75 VanDerWaalsContact C-N 3.3Å; F75-K77 PolarHBondContact O-N 2.72Å; F75-V78 PolarHBondContact O-N 3.25Å; F75-T79 WeakPolarHBondContact O-CB 3.46Å; F75-T79 PolarHBondContact O-N 2.96Å; F75-T79 PolarHBondContact O-OG1 3.36Å
76E72Confident77.9Confident67 Ų6788.3 Ų88.331%0.31343%0.429SS..Hα-helixtrans-63.4-39.6176-78.1-148.5148.200112.3R28 Y72 C73 T79 M80R28-E76 IonicContact NH1-OE2 3.88Å; Y72-E76 HydrophobicContact CD1-CG 4.13Å; Y72-E76 HydrophobicContact CE1-CG 3.57Å; Y72-E76 PolarHBondContact O-N 3.43Å; Y72-E76 PolarHBondContact OH-OE1 2.89Å; C73-E76 PolarHBondContact O-N 3.01Å; E76-T79 PolarHBondContact O-N 3.42Å; E76-M80 VanDerWaalsContact O-CB 3.28Å; E76-M80 WeakPolarHBondContact O-CB 3.46Å; E76-M80 PolarHBondContact O-N 3.48Å
77K75.5Confident78.1Confident80 Ų8091.9 Ų91.935%0.34845%0.446SS..Hα-helixtrans-60.9-50.2176.9-175.7177179.3176.50110.9E23 C73 Y74 F75 T79 M80 E81E23-K77 IonicContact OE1-NZ 2.86Å; E23-K77 PolarHBondContact OE1-NZ 2.9Å; C73-K77 WeakPolarHBondContact O-CB 3.33Å; C73-K77 PolarHBondContact O-N 3.41Å; Y74-K77 PolarHBondContact O-N 2.81Å; F75-K77 PolarHBondContact O-N 2.72Å; K77-T79 VanDerWaalsContact C-N 3.29Å; K77-T79 PolarHBondContact O-N 2.85Å; K77-M80 PolarHBondContact O-N 3.5Å; K77-E81 WeakPolarHBondContact CE-OE1 3.34Å; K77-E81 WeakPolarHBondContact O-CB 3.42Å; K77-E81 WeakPolarHBondContact O-CG 3.03Å; K77-E81 PolarHBondContact O-N 3.32Å
78V80.1Confident78Confident36 Ų3697.5 Ų97.522%0.21846%0.458CS..Hα-helixtrans-62.2-38.71781730000111.3Y74 F75 R82Y74-V78 HydrophobicContact CD1-CG2 4.34Å; Y74-V78 HydrophobicContact CE1-CG2 3.98Å; Y74-V78 WeakPolarHBondContact O-CG2 3.42Å; Y74-V78 PolarHBondContact O-N 3.42Å; F75-V78 PolarHBondContact O-N 3.25Å; V78-R82 PolarHBondContact O-N 3.33Å
79T80.1Confident78.2Confident44 Ų44100 Ų10027%0.2746%0.461SS..Hα-helixtrans-69.6-43.5178.6-55.70000111.6F75 E76 K77 R82 N83F75-T79 WeakPolarHBondContact O-CB 3.46Å; F75-T79 PolarHBondContact O-N 2.96Å; F75-T79 PolarHBondContact O-OG1 3.36Å; E76-T79 PolarHBondContact O-N 3.42Å; K77-T79 VanDerWaalsContact C-N 3.29Å; K77-T79 PolarHBondContact O-N 2.85Å; T79-R82 PolarHBondContact O-N 3.4Å; T79-N83 WeakPolarHBondContact O-CB 3.12Å; T79-N83 PolarHBondContact O-N 3.41Å; T79-N83 PolarHBondContact O-ND2 2.86Å; T79-N83 PolarHBondContact O-OD1 3.49Å
80M76Confident78.6Confident124 Ų124103.5 Ų103.561%0.61148%0.478SS*.Hα-helixtrans-62-44.2175-95.9-84.5-161.600111.8E76 K77 R82 N83 V84E76-M80 VanDerWaalsContact O-CB 3.28Å; E76-M80 WeakPolarHBondContact O-CB 3.46Å; E76-M80 PolarHBondContact O-N 3.48Å; K77-M80 PolarHBondContact O-N 3.5Å; M80-R82 VanDerWaalsContact C-N 3.31Å; M80-R82 PolarHBondContact O-N 2.89Å; M80-N83 PolarHBondContact O-N 3.06Å; M80-V84 WeakPolarHBondContact O-CB 3.43Å; M80-V84 WeakPolarHBondContact O-CG2 3.26Å; M80-V84 PolarHBondContact O-N 3.1Å
81E80Confident78.9Confident115 Ų115101 Ų10154%0.53747%0.474SS..Hα-helixtrans-58.6-44.2178.1-77.8175.7173.200111.1K77 V84 E85K77-E81 WeakPolarHBondContact CE-OE1 3.34Å; K77-E81 WeakPolarHBondContact O-CB 3.42Å; K77-E81 WeakPolarHBondContact O-CG 3.03Å; K77-E81 PolarHBondContact O-N 3.32Å; E81-V84 PolarHBondContact O-N 3.21Å; E81-E85 WeakPolarHBondContact O-CB 3.26Å; E81-E85 PolarHBondContact O-N 2.95Å; E81-E85 VanDerWaalsContact O-N 3.08Å
82R78.6Confident79Confident157 Ų157103.9 Ų103.959%0.59248%0.479SS*.Hα-helixtrans-63.7-48.3173.8-72.3-172.8-177.3129.81.4113V78 T79 M80 V84 E85 E86V78-R82 PolarHBondContact O-N 3.33Å; T79-R82 PolarHBondContact O-N 3.4Å; M80-R82 VanDerWaalsContact C-N 3.31Å; M80-R82 PolarHBondContact O-N 2.89Å; R82-V84 VanDerWaalsContact C-N 3.27Å; R82-V84 PolarHBondContact O-N 3.45Å; R82-E85 WeakPolarHBondContact O-CB 3.27Å; R82-E85 PolarHBondContact O-N 2.86Å; R82-E85 VanDerWaalsContact O-N 3.15Å; R82-E86 PolarHBondContact O-N 2.97Å
83N79.5Confident79.5Confident83 Ų83103.2 Ų103.244%0.44448%0.481SS..Hα-helixtrans-63.2-35-179.1-68.2-9.1000112T79 M80 L87T79-N83 WeakPolarHBondContact O-CB 3.12Å; T79-N83 PolarHBondContact O-N 3.41Å; T79-N83 PolarHBondContact O-ND2 2.86Å; T79-N83 PolarHBondContact O-OD1 3.49Å; M80-N83 PolarHBondContact O-N 3.06Å; N83-L87 WeakPolarHBondContact O-CB 3.29Å; N83-L87 PolarHBondContact O-N 3.36Å
84V79.5Confident79.9Confident71 Ų71106.1 Ų106.143%0.4350%0.499SS..Hα-helixtrans-71.4-35.4176.9170.10000111.2M80 E81 R82 R88M80-V84 WeakPolarHBondContact O-CB 3.43Å; M80-V84 WeakPolarHBondContact O-CG2 3.26Å; M80-V84 PolarHBondContact O-N 3.1Å; E81-V84 PolarHBondContact O-N 3.21Å; R82-V84 VanDerWaalsContact C-N 3.27Å; R82-V84 PolarHBondContact O-N 3.45Å; V84-R88 WeakPolarHBondContact O-CB 3.39Å; V84-R88 WeakPolarHBondContact O-CG 3.32Å; V84-R88 PolarHBondContact O-N 3.41Å
85E82.9Confident80Confident131 Ų131103.7 Ų103.761%0.61249%0.492SS*.Hα-helixtrans-65.3-49.6174.6-164.7162.7-153.300110.7E81 R82 L87 R88 E89E81-E85 WeakPolarHBondContact O-CB 3.26Å; E81-E85 PolarHBondContact O-N 2.95Å; E81-E85 VanDerWaalsContact O-N 3.08Å; R82-E85 WeakPolarHBondContact O-CB 3.27Å; R82-E85 PolarHBondContact O-N 2.86Å; R82-E85 VanDerWaalsContact O-N 3.15Å; E85-L87 PolarHBondContact O-N 3.14Å; E85-R88 WeakPolarHBondContact O-CB 3.47Å; E85-R88 PolarHBondContact O-N 3.38Å; E85-E89 WeakPolarHBondContact O-CG 3.34Å; E85-E89 PolarHBondContact O-N 2.96Å
86E80.1Confident80.1Confident117 Ų117103.3 Ų103.355%0.54749%0.493SS..Hα-helixtrans-58.7-44.6173.7-70.1179.9-175.600111.9R82 R88 E89 I90R82-E86 PolarHBondContact O-N 2.97Å; E86-R88 VanDerWaalsContact C-N 3.34Å; E86-R88 PolarHBondContact O-N 3.48Å; E86-E89 PolarHBondContact O-N 3.45Å; E86-I90 VanDerWaalsContact O-CG1 3.31Å; E86-I90 WeakPolarHBondContact O-CG1 3.37Å; E86-I90 PolarHBondContact O-N 3.29Å
87L80.8Confident80.3Confident100 Ų100106.2 Ų106.252%0.52451%0.506SS..Hα-helixtrans-67.6-34.9179.8-161.673.7000112N83 E85 I90 I91N83-L87 WeakPolarHBondContact O-CB 3.29Å; N83-L87 PolarHBondContact O-N 3.36Å; E85-L87 PolarHBondContact O-N 3.14Å; L87-I90 PolarHBondContact O-N 2.82Å; L87-I91 HydrophobicContact CD2-CD1 4.33Å; L87-I91 HydrophobicContact CG-CD1 4.01Å; L87-I91 WeakPolarHBondContact O-CB 3.29Å; L87-I91 WeakPolarHBondContact O-CD1 3.13Å; L87-I91 WeakPolarHBondContact O-CG1 3.22Å; L87-I91 PolarHBondContact O-N 3.45Å
88R79.8Confident80.3Confident180 Ų180108.5 Ų108.568%0.67952%0.518SS*.Hα-helixtrans-63.6-42.2173.6-91.6-170.1-170.8-177.35.1111.6V84 E85 E86 I91 H92V84-R88 WeakPolarHBondContact O-CB 3.39Å; V84-R88 WeakPolarHBondContact O-CG 3.32Å; V84-R88 PolarHBondContact O-N 3.41Å; E85-R88 WeakPolarHBondContact O-CB 3.47Å; E85-R88 PolarHBondContact O-N 3.38Å; E86-R88 VanDerWaalsContact C-N 3.34Å; E86-R88 PolarHBondContact O-N 3.48Å; R88-I91 PolarHBondContact O-N 2.88Å; R88-H92 WeakPolarHBondContact O-CB 3.41Å; R88-H92 PolarHBondContact O-N 3.48Å
89E83.8Confident80Confident122 Ų122112.9 Ų112.957%0.5753%0.534SS*.Hα-helixtrans-62.6-46.3177-70.6-176.117000110.9E85 E86 I91 H92 Q93E85-E89 WeakPolarHBondContact O-CG 3.34Å; E85-E89 PolarHBondContact O-N 2.96Å; E86-E89 PolarHBondContact O-N 3.45Å; E89-I91 PolarHBondContact O-N 3.33Å; E89-H92 PolarHBondContact O-N 2.92Å; E89-Q93 WeakPolarHBondContact O-CG 3.44Å; E89-Q93 PolarHBondContact O-N 2.75Å
90I83.1Confident79.7Confident91 Ų91116.7 Ų116.747%0.46755%0.552SS.*Hα-helixtrans-61.9-45.9177.1-63.9165000111E86 L87 H92 Q93 V94E86-I90 VanDerWaalsContact O-CG1 3.31Å; E86-I90 WeakPolarHBondContact O-CG1 3.37Å; E86-I90 PolarHBondContact O-N 3.29Å; L87-I90 PolarHBondContact O-N 2.82Å; I90-H92 VanDerWaalsContact C-N 3.3Å; I90-H92 PolarHBondContact O-N 2.68Å; I90-Q93 PolarHBondContact O-N 2.81Å; I90-V94 HydrophobicContact CG2-CG2 4.26Å; I90-V94 WeakPolarHBondContact O-CG2 3.36Å; I90-V94 PolarHBondContact O-N 3.5Å
91I82.9Confident79.5Confident99 Ų99116.3 Ų116.351%0.50855%0.552SS.*Hα-helixtrans-62.2-39.3178-71165.6000110.9L87 R88 E89 H95L87-I91 HydrophobicContact CD2-CD1 4.33Å; L87-I91 HydrophobicContact CG-CD1 4.01Å; L87-I91 WeakPolarHBondContact O-CB 3.29Å; L87-I91 WeakPolarHBondContact O-CD1 3.13Å; L87-I91 WeakPolarHBondContact O-CG1 3.22Å; L87-I91 PolarHBondContact O-N 3.45Å; R88-I91 PolarHBondContact O-N 2.88Å; E89-I91 PolarHBondContact O-N 3.33Å; I91-H95 WeakPolarHBondContact O-CB 3.23Å; I91-H95 PolarHBondContact O-N 2.94Å
92H81.5Confident79.2Confident129 Ų129118.2 Ų118.260%0.59756%0.561SS**Hα-helixtrans-64.4-41176.4-109.4-81.2000112.2R88 E89 I90 Q96R88-H92 WeakPolarHBondContact O-CB 3.41Å; R88-H92 PolarHBondContact O-N 3.48Å; E89-H92 PolarHBondContact O-N 2.92Å; I90-H92 VanDerWaalsContact C-N 3.3Å; I90-H92 PolarHBondContact O-N 2.68Å; H92-Q96 WeakPolarHBondContact O-CG 3.36Å; H92-Q96 PolarHBondContact O-N 3.36Å; H92-Q96 VanDerWaalsContact O-N 3.07Å
93Q84.6Confident78.9Confident125 Ų125117.7 Ų117.758%0.58457%0.57SS**Hα-helixtrans-65.3-50175.6-73.2-176.2-4.900111.5E89 I90 H95 Q96 E97E89-Q93 WeakPolarHBondContact O-CG 3.44Å; E89-Q93 PolarHBondContact O-N 2.75Å; I90-Q93 PolarHBondContact O-N 2.81Å; Q93-H95 VanDerWaalsContact C-N 3.3Å; Q93-H95 PolarHBondContact O-N 3.38Å; Q93-Q96 WeakPolarHBondContact O-CB 3.49Å; Q93-Q96 PolarHBondContact O-N 3.48Å; Q93-E97 PolarHBondContact O-N 2.93Å
94V81.1Confident78.4Confident71 Ų71120.3 Ų120.343%0.4358%0.584SS.*Hα-helixtrans-60.9-39.3178.4173.80000111.4I90 Q96 E97 Q98I90-V94 HydrophobicContact CG2-CG2 4.26Å; I90-V94 WeakPolarHBondContact O-CG2 3.36Å; I90-V94 PolarHBondContact O-N 3.5Å; V94-Q96 VanDerWaalsContact C-N 3.31Å; V94-Q96 PolarHBondContact O-N 2.82Å; V94-E97 PolarHBondContact O-N 3.12Å; V94-Q98 WeakPolarHBondContact O-CB 3.27Å; V94-Q98 WeakPolarHBondContact O-CG 3.22Å; V94-Q98 PolarHBondContact O-N 3.16Å
95H80.2Confident77.6Confident94 Ų94124.7 Ų124.744%0.43562%0.618SS.*Hα-helixtrans-68.7-29.6176.7-169.570.3000112.8I91 Q93 K99I91-H95 WeakPolarHBondContact O-CB 3.23Å; I91-H95 PolarHBondContact O-N 2.94Å; Q93-H95 VanDerWaalsContact C-N 3.3Å; Q93-H95 PolarHBondContact O-N 3.38Å; H95-K99 WeakPolarHBondContact NE2-CE 3.4Å; H95-K99 PolarHBondContact NE2-NZ 2.97Å; H95-K99 WeakPolarHBondContact O-CG 3.34Å; H95-K99 PolarHBondContact O-N 3.33Å
96Q79Confident77.3Confident134 Ų134124.4 Ų124.463%0.62662%0.619SS**Hα-helixtrans-74.4-42.6172.5-79.5-171.5-16.900112H92 Q93 V94 K99 L100H92-Q96 WeakPolarHBondContact O-CG 3.36Å; H92-Q96 PolarHBondContact O-N 3.36Å; H92-Q96 VanDerWaalsContact O-N 3.07Å; Q93-Q96 WeakPolarHBondContact O-CB 3.49Å; Q93-Q96 PolarHBondContact O-N 3.48Å; V94-Q96 VanDerWaalsContact C-N 3.31Å; V94-Q96 PolarHBondContact O-N 2.82Å; Q96-K99 PolarHBondContact O-N 3.39Å; Q96-L100 PolarHBondContact O-N 2.66Å; Q96-L100 VanDerWaalsContact O-N 3.08Å
97E76.2Confident77.2Confident127 Ų127124.8 Ų124.859%0.59362%0.622SS**Hα-helixtrans-61.9-45.6175.5-72.5-169.5114.500111.4Q93 V94 K99 L100 D101Q93-E97 PolarHBondContact O-N 2.93Å; V94-E97 PolarHBondContact O-N 3.12Å; E97-K99 VanDerWaalsContact C-N 3.26Å; E97-K99 PolarHBondContact O-N 3.47Å; E97-L100 WeakPolarHBondContact O-CA 3.43Å; E97-L100 WeakPolarHBondContact O-CB 3.37Å; E97-L100 PolarHBondContact O-N 3.08Å; E97-D101 PolarHBondContact O-N 3.32Å
98Q77.4Confident77Confident128 Ų128126.2 Ų126.260%0.59863%0.628SS**Hα-helixtrans-60-34.4175.8-79-161.9-33.100113.4V94 L100 Q102V94-Q98 WeakPolarHBondContact O-CB 3.27Å; V94-Q98 WeakPolarHBondContact O-CG 3.22Å; V94-Q98 PolarHBondContact O-N 3.16Å; Q98-L100 VanDerWaalsContact C-N 3.34Å; Q98-Q102 WeakPolarHBondContact O-CB 3.03Å; Q98-Q102 PolarHBondContact O-N 3.42Å; Q98-Q102 VanDerWaalsContact O-N 3.17Å
99K72.9Confident76.8Confident129 Ų129123 Ų12356%0.56163%0.625SS**Hα-helixtrans-71.7-28.7174.4-81.8-176.2177.8171.60112.8H95 Q96 E97H95-K99 WeakPolarHBondContact NE2-CE 3.4Å; H95-K99 PolarHBondContact NE2-NZ 2.97Å; H95-K99 WeakPolarHBondContact O-CG 3.34Å; H95-K99 PolarHBondContact O-N 3.33Å; Q96-K99 PolarHBondContact O-N 3.39Å; E97-K99 VanDerWaalsContact C-N 3.26Å; E97-K99 PolarHBondContact O-N 3.47Å
100L73.1Confident76.4Confident124 Ų124123.1 Ų123.165%0.64963%0.628SS**Hα-helixtrans-73-48.9176.3-149.694000110.3Q96 E97 Q98 Q102 N103 D104Q96-L100 PolarHBondContact O-N 2.66Å; Q96-L100 VanDerWaalsContact O-N 3.08Å; E97-L100 WeakPolarHBondContact O-CA 3.43Å; E97-L100 WeakPolarHBondContact O-CB 3.37Å; E97-L100 PolarHBondContact O-N 3.08Å; Q98-L100 VanDerWaalsContact C-N 3.34Å; L100-Q102 VanDerWaalsContact C-N 3.29Å; L100-Q102 PolarHBondContact O-N 2.91Å; L100-N103 PolarHBondContact O-N 2.85Å; L100-D104 PolarHBondContact O-N 3.44Å
101D72.7Confident75.9Confident115 Ų115125.2 Ų125.262%0.61564%0.639SS**Hα-helixtrans-59.6-36.9177.3-86.8-54.9000112.7E97 N103 D104E97-D101 PolarHBondContact O-N 3.32Å; D101-N103 PolarHBondContact O-N 2.98Å; D101-D104 PolarHBondContact O-N 2.94Å
102Q73.3Confident75.5Confident156 Ų156127.1 Ų127.173%0.72965%0.648SS**THydrogen-bonded Turntrans-71.2-18.7177.9-165.7175.3-0.700113.3Q98 L100Q98-Q102 WeakPolarHBondContact O-CB 3.03Å; Q98-Q102 PolarHBondContact O-N 3.42Å; Q98-Q102 VanDerWaalsContact O-N 3.17Å; L100-Q102 VanDerWaalsContact C-N 3.29Å; L100-Q102 PolarHBondContact O-N 2.91Å
103N72.1Confident75Confident145 Ų145126.9 Ų126.978%0.77565%0.652SS**THydrogen-bonded Turntrans-94.3-17.5178.3-124.611.5000112.8L100 D101L100-N103 PolarHBondContact O-N 2.85Å; D101-N103 PolarHBondContact O-N 2.98Å
104D69.2Low74.2Confident139 Ų139127.1 Ų127.174%0.74366%0.658SS**  trans-92.2-3.4176.3-90.8-24.9000113.7L100 D101L100-D104 PolarHBondContact O-N 3.44Å; D101-D104 PolarHBondContact O-N 2.94Å
105S63Low73.6Confident163 Ų163132.2 Ų132.2100%1.1468%0.679SS**  trans-104.30168.9-74.50000112.4

Retrieved 105 of 105 residues in 17.7 ms (Link to these results)