G4VSJ2_SCHMA Loading...

Secreted protein

AlphaFold DB , UniProt , Accession G4VSJ2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 118 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
1M46.1Very low53.2Low251 Ų251147.5 Ų147.5100%1.23682%0.822SS**  0100.90-72.2174.4168.600108.3
2R55.4Low53.6Low244 Ų244141 Ų14192%0.92179%0.793SS**  trans-135.590.8-179.9-173.9170.5-177.2151.3-0.4107.8
3S53.4Low54.8Low118 Ų118135.8 Ų135.883%0.82577%0.771SS**  trans-93.1117.5167.1-62.80000108.4
4P57.3Low55.7Low110 Ų110132.1 Ų132.171%0.71476%0.758SS**  trans-88.4105.2156.730.2-19.3000107
5S53.1Low56.5Low89 Ų89127.5 Ų127.562%0.62274%0.737SS**  61.3101.97282.80000112.6
6F50.9Low57.3Low175 Ų175126.2 Ų126.277%0.76872%0.722SS**  trans79.4114.2147.1-57-68.5000121.7
7Q45.9Very low58.5Low170 Ų170123.4 Ų123.479%0.79470%0.703SS**  67.894.2121.6-61.3-17877.200118.2
8S49.8Very low59.6Low118 Ų118122.3 Ų122.383%0.82570%0.695SS**  trans-138.459.1133.5-175.40000110.2G10S8-G10 PolarHBondContact O-N 3.18Å; S8-G10 VanDerWaalsContact O-N 3.09Å
9V57Low60.5Low155 Ų155121 Ų12194%0.93969%0.685SS**  trans-77.269.6149.4172.50000105.7
10G61.2Low61.5Low52 Ų52122.3 Ų122.354%0.53668%0.682SS.*  trans-102.2104.7-178.100000108.9S8 C12S8-G10 PolarHBondContact O-N 3.18Å; S8-G10 VanDerWaalsContact O-N 3.09Å; G10-C12 PolarHBondContact O-N 3.09Å
11T55.3Low62.4Low140 Ų140124.6 Ų124.686%0.85968%0.681SS**  trans-2.998.6167.556.50000115.6S13T11-S13 PolarHBondContact O-N 3.31Å
12C57.8Low64.1Low70 Ų70118.3 Ų118.347%0.47365%0.65SS.*  trans-63.1105.2167.5-169.80000108.2G10 S14 Q16 I17G10-C12 PolarHBondContact O-N 3.09Å; C12-S14 PolarHBondContact O-N 3.02Å; C12-Q16 VanDerWaalsContact SG-CB 3.54Å; C12-I17 HydrophobicContact CB-CD1 4.47Å; C12-I17 HydrophobicContact CB-CG1 4.42Å; C12-I17 VanDerWaalsContact SG-CG1 3.56Å
13S69.5Low65.2Low73 Ų73116.1 Ų116.151%0.5164%0.641SS.*  trans-51.5135.7174.2-169.70000109.3T11 S15 Q16T11-S13 PolarHBondContact O-N 3.31Å; S13-S15 PolarHBondContact O-N 3.02Å; S13-S15 PolarHBondContact OG-OG 2.77Å; S13-Q16 WeakPolarHBondContact O-CB 3.5Å; S13-Q16 PolarHBondContact O-N 3.44Å
14S67.2Low66.5Low85 Ų85113.9 Ų113.959%0.59463%0.626SS**Hα-helixtrans-47.9-32.4-176.5-175.60000112.6C12 Q16 I17 L18C12-S14 PolarHBondContact O-N 3.02Å; S14-Q16 PolarHBondContact O-N 2.85Å; S14-I17 PolarHBondContact O-N 2.92Å; S14-L18 WeakPolarHBondContact O-CG 3.22Å; S14-L18 PolarHBondContact O-N 3.41Å; S14-L18 VanDerWaalsContact O-N 3.12Å
15S68Low67.7Low62 Ų62114.3 Ų114.343%0.43462%0.621SS.*Hα-helixtrans-59.6-38.7173.556.20000114.4S13 L18 L19S13-S15 PolarHBondContact O-N 3.02Å; S13-S15 PolarHBondContact OG-OG 2.77Å; S15-L18 PolarHBondContact O-N 3.35Å; S15-L19 WeakPolarHBondContact O-CB 3.42Å; S15-L19 VanDerWaalsContact O-CG 3.22Å; S15-L19 WeakPolarHBondContact O-CG 3.45Å; S15-L19 PolarHBondContact O-N 3.04Å
16Q69.4Low68.9Low107 Ų107115.1 Ų115.150%0.562%0.618SS.*Hα-helixtrans-68.8-35.2179.3-71.2-115.960.800112.3C12 S13 S14 K20C12-Q16 VanDerWaalsContact SG-CB 3.54Å; S13-Q16 WeakPolarHBondContact O-CB 3.5Å; S13-Q16 PolarHBondContact O-N 3.44Å; S14-Q16 PolarHBondContact O-N 2.85Å; Q16-K20 WeakPolarHBondContact O-CB 3.43Å; Q16-K20 WeakPolarHBondContact O-CG 3.39Å; Q16-K20 PolarHBondContact O-N 3.38Å
17I76.6Confident70.3Confident79 Ų79109 Ų10941%0.40560%0.6SS.*Hα-helixtrans-67.8-44.7174.6-62168.3000109.9C12 S14 K20 R21C12-I17 HydrophobicContact CB-CD1 4.47Å; C12-I17 HydrophobicContact CB-CG1 4.42Å; C12-I17 VanDerWaalsContact SG-CG1 3.56Å; S14-I17 PolarHBondContact O-N 2.92Å; I17-K20 PolarHBondContact O-N 2.94Å; I17-R21 WeakPolarHBondContact O-CB 3.38Å; I17-R21 PolarHBondContact O-N 2.92Å
18L78.6Confident72Confident104 Ų104105.6 Ų105.655%0.54559%0.59SS.*Hα-helixtrans-63.4-42.7176.8-68.7175.7000111.9S14 S15 R21 M22S14-L18 WeakPolarHBondContact O-CG 3.22Å; S14-L18 PolarHBondContact O-N 3.41Å; S14-L18 VanDerWaalsContact O-N 3.12Å; S15-L18 PolarHBondContact O-N 3.35Å; L18-R21 PolarHBondContact O-N 3.46Å; L18-M22 WeakPolarHBondContact O-CB 3.37Å; L18-M22 PolarHBondContact O-N 3.12Å
19L76.7Confident73.6Confident97 Ų97102.5 Ų102.551%0.50857%0.572SS.*Hα-helixtrans-62.9-45.5176.8-74.4174.8000112S15 R21 M22 W23S15-L19 WeakPolarHBondContact O-CB 3.42Å; S15-L19 VanDerWaalsContact O-CG 3.22Å; S15-L19 WeakPolarHBondContact O-CG 3.45Å; S15-L19 PolarHBondContact O-N 3.04Å; L19-R21 VanDerWaalsContact C-N 3.34Å; L19-R21 PolarHBondContact O-N 3.17Å; L19-M22 HydrophobicContact CD2-CE 3.77Å; L19-M22 PolarHBondContact O-N 3.17Å; L19-W23 WeakPolarHBondContact O-CB 3.38Å; L19-W23 PolarHBondContact O-N 3.08Å
20K80.3Confident74.7Confident147 Ų14799.3 Ų99.364%0.63955%0.553SS**Hα-helixtrans-60.8-42.8175.2-77.6178.7-176.7-74.60111.8Q16 I17 S24Q16-K20 WeakPolarHBondContact O-CB 3.43Å; Q16-K20 WeakPolarHBondContact O-CG 3.39Å; Q16-K20 PolarHBondContact O-N 3.38Å; I17-K20 PolarHBondContact O-N 2.94Å; K20-S24 WeakPolarHBondContact O-CB 3.42Å; K20-S24 PolarHBondContact O-N 3.35Å
21R81.4Confident75.5Confident171 Ų171100.9 Ų100.965%0.64555%0.552SS**Hα-helixtrans-63-46.9175.6-82.9-175.6166.2178.8-3.2112I17 L18 L19 W23 S24 I25I17-R21 WeakPolarHBondContact O-CB 3.38Å; I17-R21 PolarHBondContact O-N 2.92Å; L18-R21 PolarHBondContact O-N 3.46Å; L19-R21 VanDerWaalsContact C-N 3.34Å; L19-R21 PolarHBondContact O-N 3.17Å; R21-W23 PolarHBondContact O-N 3.32Å; R21-S24 WeakPolarHBondContact O-CB 3.47Å; R21-S24 PolarHBondContact O-N 2.88Å; R21-I25 VanDerWaalsContact O-CG1 3.26Å; R21-I25 WeakPolarHBondContact O-CG1 3.39Å; R21-I25 PolarHBondContact O-N 2.92Å
22M80.7Confident76.7Confident119 Ų119101.8 Ų101.859%0.58654%0.544SS*.Hα-helixtrans-61.1-45.5179.3-177.6177.271.400111.5L18 L19 S24 I25 L26L18-M22 WeakPolarHBondContact O-CB 3.37Å; L18-M22 PolarHBondContact O-N 3.12Å; L19-M22 HydrophobicContact CD2-CE 3.77Å; L19-M22 PolarHBondContact O-N 3.17Å; M22-S24 VanDerWaalsContact C-N 3.32Å; M22-S24 PolarHBondContact O-N 2.86Å; M22-I25 PolarHBondContact O-N 3.34Å; M22-L26 WeakPolarHBondContact O-CB 3.13Å; M22-L26 PolarHBondContact O-N 3.46Å
23W79.5Confident77.6Confident197 Ų197101.4 Ų101.475%0.74655%0.546SS*.Hα-helixtrans-65.1-38.1178.2-1632.6000111.7L19 R21 L26 A27L19-W23 WeakPolarHBondContact O-CB 3.38Å; L19-W23 PolarHBondContact O-N 3.08Å; R21-W23 PolarHBondContact O-N 3.32Å; W23-L26 PolarHBondContact O-N 2.97Å; W23-A27 WeakPolarHBondContact O-CB 3.36Å; W23-A27 PolarHBondContact O-N 2.83Å
24S80.7Confident77.7Confident72 Ų72102.4 Ų102.450%0.50354%0.541SS..Hα-helixtrans-63.1-44173.3-171.30000112.3K20 R21 M22 A27 V28K20-S24 WeakPolarHBondContact O-CB 3.42Å; K20-S24 PolarHBondContact O-N 3.35Å; R21-S24 WeakPolarHBondContact O-CB 3.47Å; R21-S24 PolarHBondContact O-N 2.88Å; M22-S24 VanDerWaalsContact C-N 3.32Å; M22-S24 PolarHBondContact O-N 2.86Å; S24-A27 PolarHBondContact O-N 3.46Å; S24-V28 VanDerWaalsContact O-CG2 3.31Å; S24-V28 WeakPolarHBondContact O-CG2 3.38Å; S24-V28 PolarHBondContact O-N 3.44Å
25I81.7Confident77.9Confident119 Ų119101.8 Ų101.861%0.6154%0.537SS*.Hα-helixtrans-64.1-44.5177.8-68162.2000110.3R21 M22 A27 V28 A29R21-I25 VanDerWaalsContact O-CG1 3.26Å; R21-I25 WeakPolarHBondContact O-CG1 3.39Å; R21-I25 PolarHBondContact O-N 2.92Å; M22-I25 PolarHBondContact O-N 3.34Å; I25-A27 VanDerWaalsContact C-N 3.33Å; I25-A27 PolarHBondContact O-N 3Å; I25-V28 PolarHBondContact O-N 3.48Å; I25-A29 WeakPolarHBondContact O-CB 3.47Å; I25-A29 PolarHBondContact O-N 2.79Å
26L79.8Confident78.1Confident105 Ų105101.5 Ų101.555%0.5554%0.538SS..Hα-helixtrans-59.8-45177.1-174.668.1000111M22 W23 V28 A29 V30M22-L26 WeakPolarHBondContact O-CB 3.13Å; M22-L26 PolarHBondContact O-N 3.46Å; W23-L26 PolarHBondContact O-N 2.97Å; L26-V28 VanDerWaalsContact C-N 3.35Å; L26-V28 PolarHBondContact O-N 2.88Å; L26-A29 PolarHBondContact O-N 2.9Å; L26-V30 HydrophobicContact CD1-CG2 4.39Å; L26-V30 HydrophobicContact CG-CG2 4.38Å; L26-V30 WeakPolarHBondContact O-CB 3.23Å; L26-V30 VanDerWaalsContact O-CG2 3.23Å; L26-V30 WeakPolarHBondContact O-CG2 3.48Å; L26-V30 PolarHBondContact O-N 3.17Å
27A79.2Confident77.9Confident48 Ų4898.9 Ų98.940%0.39753%0.532SS..Hα-helixtrans-60.8-42.8177.800000112.2W23 S24 I25 T31W23-A27 WeakPolarHBondContact O-CB 3.36Å; W23-A27 PolarHBondContact O-N 2.83Å; S24-A27 PolarHBondContact O-N 3.46Å; I25-A27 VanDerWaalsContact C-N 3.33Å; I25-A27 PolarHBondContact O-N 3Å; A27-T31 WeakPolarHBondContact O-CB 3.33Å; A27-T31 PolarHBondContact O-N 3.26Å; A27-T31 PolarHBondContact O-OG1 2.92Å
28V81.2Confident77.4Confident97 Ų9797 Ų9759%0.58853%0.528SS*.Hα-helixtrans-64.1-46.2176.21730000111S24 I25 L26 T31 F32S24-V28 VanDerWaalsContact O-CG2 3.31Å; S24-V28 WeakPolarHBondContact O-CG2 3.38Å; S24-V28 PolarHBondContact O-N 3.44Å; I25-V28 PolarHBondContact O-N 3.48Å; L26-V28 VanDerWaalsContact C-N 3.35Å; L26-V28 PolarHBondContact O-N 2.88Å; V28-T31 PolarHBondContact O-N 3.26Å; V28-F32 WeakPolarHBondContact O-CB 3.37Å; V28-F32 PolarHBondContact O-N 3.47Å
29A84.2Confident76.9Confident53 Ų5394.6 Ų94.644%0.43853%0.529SS..Hα-helixtrans-63.6-43179.700000112.5I25 L26 F32 A33I25-A29 WeakPolarHBondContact O-CB 3.47Å; I25-A29 PolarHBondContact O-N 2.79Å; L26-A29 PolarHBondContact O-N 2.9Å; A29-F32 PolarHBondContact O-N 2.82Å; A29-A33 WeakPolarHBondContact O-CB 3.28Å; A29-A33 PolarHBondContact O-N 3.27Å
30V79.9Confident76.3Confident89 Ų8997.9 Ų97.954%0.53954%0.543SS..Hα-helixtrans-62.1-45176.6169.10000110.7L26 F32 A33 F34L26-V30 HydrophobicContact CD1-CG2 4.39Å; L26-V30 HydrophobicContact CG-CG2 4.38Å; L26-V30 WeakPolarHBondContact O-CB 3.23Å; L26-V30 VanDerWaalsContact O-CG2 3.23Å; L26-V30 WeakPolarHBondContact O-CG2 3.48Å; L26-V30 PolarHBondContact O-N 3.17Å; V30-F32 PolarHBondContact O-N 2.89Å; V30-A33 PolarHBondContact O-N 3.03Å; V30-F34 VanDerWaalsContact O-CB 3.29Å; V30-F34 WeakPolarHBondContact O-CB 3.26Å; V30-F34 PolarHBondContact O-N 2.86Å
31T78.7Confident75.2Confident85 Ų8593.8 Ų93.852%0.52153%0.528SS..Hα-helixtrans-62.8-43.7178.1-54.60000111.2A27 V28 F34 S35A27-T31 WeakPolarHBondContact O-CB 3.33Å; A27-T31 PolarHBondContact O-N 3.26Å; A27-T31 PolarHBondContact O-OG1 2.92Å; V28-T31 PolarHBondContact O-N 3.26Å; T31-F34 PolarHBondContact O-N 3.41Å; T31-S35 PolarHBondContact O-N 3.04Å; T31-S35 PolarHBondContact O-OG 3.45Å
32F79.5Confident74.1Confident159 Ų15990.9 Ų90.970%0.69753%0.534SS*.Hα-helixtrans-64.4-46.6179.1-171.8-96.8000112V28 A29 V30 F34 S35 A36V28-F32 WeakPolarHBondContact O-CB 3.37Å; V28-F32 PolarHBondContact O-N 3.47Å; A29-F32 PolarHBondContact O-N 2.82Å; V30-F32 PolarHBondContact O-N 2.89Å; F32-F34 VanDerWaalsContact C-N 3.3Å; F32-F34 PolarHBondContact O-N 2.88Å; F32-S35 PolarHBondContact O-N 2.75Å; F32-A36 WeakPolarHBondContact O-CB 3.38Å; F32-A36 PolarHBondContact O-N 3.32Å
33A77.4Confident73.4Confident61 Ų6186.8 Ų86.850%0.50452%0.522SS..Hα-helixtrans-61.9-38.8176.300000112A29 V30 S37A29-A33 WeakPolarHBondContact O-CB 3.28Å; A29-A33 PolarHBondContact O-N 3.27Å; V30-A33 PolarHBondContact O-N 3.03Å; A33-S37 WeakPolarHBondContact O-CB 3.42Å; A33-S37 PolarHBondContact O-N 2.91Å
34F70.2Confident72.7Confident94 Ų9483.2 Ų83.241%0.41252%0.524SS..Hα-helixtrans-64.5-48.7176.3-176.4-95.4000111.9V30 T31 F32 A36 S37 A38 L50V30-F34 VanDerWaalsContact O-CB 3.29Å; V30-F34 WeakPolarHBondContact O-CB 3.26Å; V30-F34 PolarHBondContact O-N 2.86Å; T31-F34 PolarHBondContact O-N 3.41Å; F32-F34 VanDerWaalsContact C-N 3.3Å; F32-F34 PolarHBondContact O-N 2.88Å; F34-A36 PolarHBondContact O-N 3.45Å; F34-S37 PolarHBondContact O-N 3.28Å; F34-A38 WeakPolarHBondContact O-CB 3.33Å; F34-A38 PolarHBondContact O-N 3.05Å; F34-L50 HydrophobicContact CE2-CD2 3.79Å; F34-L50 HydrophobicContact CZ-CD2 4.2Å
35S71.9Confident72.1Confident72 Ų7283.6 Ų83.650%0.50353%0.532SS..Hα-helixtrans-63.6-40.2177.9-67.20000112.4T31 F32 S37 A38 G39T31-S35 PolarHBondContact O-N 3.04Å; T31-S35 PolarHBondContact O-OG 3.45Å; F32-S35 PolarHBondContact O-N 2.75Å; S35-S37 VanDerWaalsContact C-N 3.32Å; S35-S37 PolarHBondContact O-N 3.46Å; S35-A38 PolarHBondContact O-N 3.3Å; S35-G39 PolarHBondContact O-N 3.21Å; S35-G39 VanDerWaalsContact O-N 3.11Å
36A72.8Confident71.3Confident56 Ų5678.3 Ų78.346%0.46351%0.506SS..Hα-helixtrans-61.9-40.9174.400000111.6F32 F34F32-A36 WeakPolarHBondContact O-CB 3.38Å; F32-A36 PolarHBondContact O-N 3.32Å; F34-A36 PolarHBondContact O-N 3.45Å
37S66Low70.6Confident53 Ų5378.5 Ų78.537%0.37151%0.507SS..Hα-helixtrans-71.4-37.5176.3-175.30000112.7A33 F34 S35 G39 M40 L41A33-S37 WeakPolarHBondContact O-CB 3.42Å; A33-S37 PolarHBondContact O-N 2.91Å; F34-S37 PolarHBondContact O-N 3.28Å; S35-S37 VanDerWaalsContact C-N 3.32Å; S35-S37 PolarHBondContact O-N 3.46Å; S37-G39 VanDerWaalsContact C-N 3.27Å; S37-G39 PolarHBondContact O-N 2.78Å; S37-M40 WeakPolarHBondContact O-CB 3.23Å; S37-M40 PolarHBondContact O-N 3.37Å; S37-L41 WeakPolarHBondContact O-CB 3.48Å; S37-L41 WeakPolarHBondContact O-CG 3.23Å; S37-L41 PolarHBondContact O-N 2.89Å
38A64.9Low70.3Confident38 Ų3880.1 Ų80.131%0.31451%0.514SS..Hα-helixtrans-62-34.5176.700000112F34 S35 M40 L41F34-A38 WeakPolarHBondContact O-CB 3.33Å; F34-A38 PolarHBondContact O-N 3.05Å; S35-A38 PolarHBondContact O-N 3.3Å; A38-M40 VanDerWaalsContact C-N 3.32Å; A38-M40 PolarHBondContact O-N 2.9Å; A38-L41 CarbonylContact O-C 3.56Å; A38-L41 PolarHBondContact O-N 2.73Å
39G67.8Low69.8Low55 Ų5581 Ų8157%0.56751%0.514SS*.Hα-helixtrans-64.9-32.7172.500000113.7S35 S37 S42S35-G39 PolarHBondContact O-N 3.21Å; S35-G39 VanDerWaalsContact O-N 3.11Å; S37-G39 VanDerWaalsContact C-N 3.27Å; S37-G39 PolarHBondContact O-N 2.78Å; G39-S42 PolarHBondContact O-OG 3.43Å
40M64.4Low69Low165 Ų16580 Ų8081%0.81350%0.501SS*.Hα-helixtrans-79.9-21.9174.7-63-173.76900113.1S37 A38S37-M40 WeakPolarHBondContact O-CB 3.23Å; S37-M40 PolarHBondContact O-N 3.37Å; A38-M40 VanDerWaalsContact C-N 3.32Å; A38-M40 PolarHBondContact O-N 2.9Å
41L58.3Low68.7Low61 Ų6181.4 Ų81.432%0.31950%0.504SS..THydrogen-bonded Turntrans-100.733.1-175.4-77-179.5000112.2S37 A38 G43 A46 L50S37-L41 WeakPolarHBondContact O-CB 3.48Å; S37-L41 WeakPolarHBondContact O-CG 3.23Å; S37-L41 PolarHBondContact O-N 2.89Å; A38-L41 CarbonylContact O-C 3.56Å; A38-L41 PolarHBondContact O-N 2.73Å; L41-G43 PolarHBondContact O-N 3.17Å; L41-A46 HydrophobicContact CB-CB 3.59Å; L41-A46 HydrophobicContact CD1-CB 4.45Å; L41-A46 HydrophobicContact CD2-CB 3.87Å; L41-A46 HydrophobicContact CG-CB 4.15Å; L41-A46 WeakPolarHBondContact O-CB 3.42Å; L41-L50 HydrophobicContact CD1-CD2 3.95Å; L41-L50 HydrophobicContact CD1-CG 4.25Å
42S57.1Low68.7Low111 Ų11180.4 Ų80.478%0.77650%0.501SS*.  trans-77.450.4-174.453.20000114.2G39G39-S42 PolarHBondContact O-OG 3.43Å
43G67.3Low68.5Low32 Ų3277.5 Ų77.533%0.3349%0.492SS..SBendtrans-136.1148.1174.700000112.3L41 A45 A46L41-G43 PolarHBondContact O-N 3.17Å; G43-A45 PolarHBondContact O-N 2.95Å; G43-A46 WeakPolarHBondContact O-CB 3.42Å; G43-A46 PolarHBondContact O-N 3.27Å
44P63.9Low68.4Low122 Ų12278.8 Ų78.879%0.79249%0.489SS*.THydrogen-bonded Turntrans-53.3-24175.6-23.932000113.8A46P44-A46 VanDerWaalsContact C-N 3.32Å; P44-A46 PolarHBondContact O-N 3.44Å
45A67.5Low68.9Low81 Ų8177 Ų7767%0.66949%0.491SS*.THydrogen-bonded Turntrans-74.2-13.9176.600000114.7G43 P48G43-A45 PolarHBondContact O-N 2.95Å; A45-P48 WeakPolarHBondContact O-CD 3.31Å
46A64.5Low69.1Low7 Ų779.2 Ų79.26%0.05850%0.495CS..Hα-helixtrans-91.3-18.1-178.700000114.1L41 G43 P44 L49 L50L41-A46 HydrophobicContact CB-CB 3.59Å; L41-A46 HydrophobicContact CD1-CB 4.45Å; L41-A46 HydrophobicContact CD2-CB 3.87Å; L41-A46 HydrophobicContact CG-CB 4.15Å; L41-A46 WeakPolarHBondContact O-CB 3.42Å; G43-A46 WeakPolarHBondContact O-CB 3.42Å; G43-A46 PolarHBondContact O-N 3.27Å; P44-A46 VanDerWaalsContact C-N 3.32Å; P44-A46 PolarHBondContact O-N 3.44Å; A46-L49 PolarHBondContact O-N 2.89Å; A46-L50 WeakPolarHBondContact O-CG 3.42Å; A46-L50 PolarHBondContact O-N 3.47Å
47L66.5Low69Low110 Ų11080.8 Ų80.858%0.57650%0.495SS*.Hα-helixtrans-59-45.1175.7-63.4174.5000112.3L49 L50 I51L47-L49 VanDerWaalsContact C-N 3.31Å; L47-L49 PolarHBondContact O-N 3.37Å; L47-L50 PolarHBondContact O-N 2.92Å; L47-I51 WeakPolarHBondContact O-CD1 3.47Å; L47-I51 VanDerWaalsContact O-CG1 3.29Å; L47-I51 WeakPolarHBondContact O-CG1 3.47Å; L47-I51 PolarHBondContact O-N 3.36Å
48P72.8Confident69.4Low82 Ų8282.8 Ų82.853%0.53250%0.501SS..Hα-helixtrans-62.3-37.4175-22.534.3000113A45 I51 S52A45-P48 WeakPolarHBondContact O-CD 3.31Å; P48-I51 PolarHBondContact O-N 3.43Å; P48-S52 WeakPolarHBondContact O-CB 3.47Å; P48-S52 PolarHBondContact O-N 3.36Å
49L69.8Low69.8Low114 Ų11484.9 Ų84.960%0.59751%0.513SS*.Hα-helixtrans-66.3-41.7177.9-67177000111.5A46 L47 S52 L53A46-L49 PolarHBondContact O-N 2.89Å; L47-L49 VanDerWaalsContact C-N 3.31Å; L47-L49 PolarHBondContact O-N 3.37Å; L49-S52 PolarHBondContact O-N 2.93Å; L49-L53 WeakPolarHBondContact O-CB 3.47Å; L49-L53 PolarHBondContact O-N 3.37Å
50L68.3Low69.7Low32 Ų3285.4 Ų85.417%0.16851%0.508CS..Hα-helixtrans-63.3-44174.9-72.2170.9000111.6F34 L41 A46 L47 L53 M54F34-L50 HydrophobicContact CE2-CD2 3.79Å; F34-L50 HydrophobicContact CZ-CD2 4.2Å; L41-L50 HydrophobicContact CD1-CD2 3.95Å; L41-L50 HydrophobicContact CD1-CG 4.25Å; A46-L50 WeakPolarHBondContact O-CG 3.42Å; A46-L50 PolarHBondContact O-N 3.47Å; L47-L50 PolarHBondContact O-N 2.92Å; L50-L53 PolarHBondContact O-N 3.13Å; L50-M54 VanDerWaalsContact O-CG 3.31Å; L50-M54 WeakPolarHBondContact O-CG 3.15Å; L50-M54 PolarHBondContact O-N 3.32Å
51I73.3Confident69.9Low119 Ų11983 Ų8361%0.6150%0.498SS*.Hα-helixtrans-63.2-44.3177.4-66.5163.5000110.7L47 P48 L53 M54 A55L47-I51 WeakPolarHBondContact O-CD1 3.47Å; L47-I51 VanDerWaalsContact O-CG1 3.29Å; L47-I51 WeakPolarHBondContact O-CG1 3.47Å; L47-I51 PolarHBondContact O-N 3.36Å; P48-I51 PolarHBondContact O-N 3.43Å; I51-L53 VanDerWaalsContact C-N 3.31Å; I51-L53 PolarHBondContact O-N 2.92Å; I51-M54 PolarHBondContact O-N 3.46Å; I51-A55 WeakPolarHBondContact O-CB 3.4Å; I51-A55 PolarHBondContact O-N 3.49Å
52S78.6Confident70.2Confident65 Ų6586 Ų8646%0.45552%0.518SS..Hα-helixtrans-62.3-39176.7-176.60000112.2P48 L49 A55 M56P48-S52 WeakPolarHBondContact O-CB 3.47Å; P48-S52 PolarHBondContact O-N 3.36Å; L49-S52 PolarHBondContact O-N 2.93Å; S52-A55 PolarHBondContact O-N 2.93Å; S52-M56 WeakPolarHBondContact O-CB 3.29Å; S52-M56 PolarHBondContact O-N 3.41Å
53L75.8Confident70.5Confident97 Ų9784.1 Ų84.151%0.50852%0.517SS..Hα-helixtrans-68.8-43.4178.7-169.7124.3000111.2L49 L50 I51 A55 M56 L57L49-L53 WeakPolarHBondContact O-CB 3.47Å; L49-L53 PolarHBondContact O-N 3.37Å; L50-L53 PolarHBondContact O-N 3.13Å; I51-L53 VanDerWaalsContact C-N 3.31Å; I51-L53 PolarHBondContact O-N 2.92Å; L53-A55 VanDerWaalsContact C-N 3.33Å; L53-A55 PolarHBondContact O-N 2.94Å; L53-M56 PolarHBondContact O-N 3.21Å; L53-L57 HydrophobicContact CD2-CD1 3.94Å; L53-L57 WeakPolarHBondContact O-CG 3.4Å; L53-L57 PolarHBondContact O-N 3.26Å
54M75.3Confident70.1Confident88 Ų8884.4 Ų84.443%0.43352%0.52SS..Hα-helixtrans-61.1-41.5173.2-70.3-60.3-67.800111.6L50 I51 L57 I58L50-M54 VanDerWaalsContact O-CG 3.31Å; L50-M54 WeakPolarHBondContact O-CG 3.15Å; L50-M54 PolarHBondContact O-N 3.32Å; I51-M54 PolarHBondContact O-N 3.46Å; M54-L57 PolarHBondContact O-N 2.99Å; M54-L57 HydrophobicContact SD-CD1 4.33Å; M54-I58 WeakPolarHBondContact O-CB 3.44Å; M54-I58 VanDerWaalsContact O-CG1 3.23Å; M54-I58 WeakPolarHBondContact O-CG1 3.1Å; M54-I58 PolarHBondContact O-N 3.38Å
55A79.2Confident69.5Low56 Ų5681.4 Ų81.446%0.46350%0.5SS..Hα-helixtrans-63.2-41.3175.200000112.3I51 S52 L53 I58 S59I51-A55 WeakPolarHBondContact O-CB 3.4Å; I51-A55 PolarHBondContact O-N 3.49Å; S52-A55 PolarHBondContact O-N 2.93Å; L53-A55 VanDerWaalsContact C-N 3.33Å; L53-A55 PolarHBondContact O-N 2.94Å; A55-I58 PolarHBondContact O-N 3.45Å; A55-S59 VanDerWaalsContact O-CB 3.28Å; A55-S59 WeakPolarHBondContact O-CB 3.49Å; A55-S59 PolarHBondContact O-N 3.27Å
56M76.5Confident68.7Low120 Ų12085.8 Ų85.859%0.59151%0.511SS*.Hα-helixtrans-65.1-40.1175.5-170.3179.3-69.500111.8S52 L53 S59 S60S52-M56 WeakPolarHBondContact O-CB 3.29Å; S52-M56 PolarHBondContact O-N 3.41Å; L53-M56 PolarHBondContact O-N 3.21Å; M56-S59 PolarHBondContact O-N 3.38Å; M56-S60 WeakPolarHBondContact O-CB 3.17Å; M56-S60 PolarHBondContact O-N 3.46Å
57L72.1Confident68.1Low88 Ų8888.6 Ų88.646%0.46153%0.53SS..Hα-helixtrans-64-46.1174.3-74.4172.9000111.6L53 M54 S60 I61L53-L57 HydrophobicContact CD2-CD1 3.94Å; L53-L57 WeakPolarHBondContact O-CG 3.4Å; L53-L57 PolarHBondContact O-N 3.26Å; M54-L57 PolarHBondContact O-N 2.99Å; M54-L57 HydrophobicContact SD-CD1 4.33Å; L57-S60 WeakPolarHBondContact O-CB 3.48Å; L57-S60 PolarHBondContact O-N 3.24Å; L57-I61 WeakPolarHBondContact O-CD1 3.49Å; L57-I61 VanDerWaalsContact O-CG1 3.23Å; L57-I61 WeakPolarHBondContact O-CG1 3.34Å; L57-I61 PolarHBondContact O-N 3.39Å
58I73.7Confident67.4Low95 Ų9590.7 Ų90.749%0.48754%0.54SS..Hα-helixtrans-64.5-41.9177.3-66.6164.5000110.5M54 A55 S60 I61 V62M54-I58 WeakPolarHBondContact O-CB 3.44Å; M54-I58 VanDerWaalsContact O-CG1 3.23Å; M54-I58 WeakPolarHBondContact O-CG1 3.1Å; M54-I58 PolarHBondContact O-N 3.38Å; A55-I58 PolarHBondContact O-N 3.45Å; I58-S60 VanDerWaalsContact C-N 3.31Å; I58-S60 PolarHBondContact O-N 3.47Å; I58-I61 PolarHBondContact O-N 3.4Å; I58-V62 HydrophobicContact CG2-CG2 4.1Å; I58-V62 WeakPolarHBondContact O-CB 3.04Å; I58-V62 WeakPolarHBondContact O-CG2 3.39Å; I58-V62 PolarHBondContact O-N 3.41Å
59S73Confident66.7Low82 Ų8290.7 Ų90.757%0.57356%0.555SS**Hα-helixtrans-64.7-35.4175.6-174.70000112.3A55 M56 G63A55-S59 VanDerWaalsContact O-CB 3.28Å; A55-S59 WeakPolarHBondContact O-CB 3.49Å; A55-S59 PolarHBondContact O-N 3.27Å; M56-S59 PolarHBondContact O-N 3.38Å; S59-G63 WeakPolarHBondContact O-CA 3.35Å; S59-G63 PolarHBondContact O-N 3.19Å
60S65.4Low65.9Low66 Ų6696.8 Ų96.846%0.46257%0.57SS.*Hα-helixtrans-63.9-47.4171.9-174.60000109.6M56 L57 I58 G64 P65M56-S60 WeakPolarHBondContact O-CB 3.17Å; M56-S60 PolarHBondContact O-N 3.46Å; L57-S60 WeakPolarHBondContact O-CB 3.48Å; L57-S60 PolarHBondContact O-N 3.24Å; I58-S60 VanDerWaalsContact C-N 3.31Å; I58-S60 PolarHBondContact O-N 3.47Å; S60-G64 CarbonylContact O-C 2.87Å; S60-G64 WeakPolarHBondContact O-CA 3.31Å; S60-G64 PolarHBondContact O-N 3.11Å; S60-P65 WeakPolarHBondContact O-CD 3.27Å
61I68.8Low65Low115 Ų11598 Ų9859%0.5958%0.582SS**Hα-helixtrans-63.8-46.3179.6-64.1161.7000112.7L57 I58L57-I61 WeakPolarHBondContact O-CD1 3.49Å; L57-I61 VanDerWaalsContact O-CG1 3.23Å; L57-I61 WeakPolarHBondContact O-CG1 3.34Å; L57-I61 PolarHBondContact O-N 3.39Å; I58-I61 PolarHBondContact O-N 3.4Å
62V64.7Low64Low123 Ų12399.6 Ų99.675%0.74560%0.596SS**Hα-helixtrans-80-32.8-175.3170.80000112.3I58I58-V62 HydrophobicContact CG2-CG2 4.1Å; I58-V62 WeakPolarHBondContact O-CB 3.04Å; I58-V62 WeakPolarHBondContact O-CG2 3.39Å; I58-V62 PolarHBondContact O-N 3.41Å
63G63.4Low62.9Low73 Ų7399.6 Ų99.675%0.75361%0.607SS**Hα-helixtrans-88-10.8175.500000114.6S59S59-G63 WeakPolarHBondContact O-CA 3.35Å; S59-G63 PolarHBondContact O-N 3.19Å
64G60Low61.8Low38 Ų3897.3 Ų97.339%0.39260%0.601SS.*  trans138114.2173.100000114S60S60-G64 CarbonylContact O-C 2.87Å; S60-G64 WeakPolarHBondContact O-CA 3.31Å; S60-G64 PolarHBondContact O-N 3.11Å
65P49.6Very low60.7Low59 Ų5997 Ų9738%0.38361%0.613SS.*  -127.367.4107.837.7-28.8000109.4S60 S67S60-P65 WeakPolarHBondContact O-CD 3.27Å; P65-S67 PolarHBondContact O-N 3.44Å
66I50.8Low59.3Low173 Ų17399.5 Ų99.589%0.88763%0.627SS**THydrogen-bonded Turntrans-76.264156.8-55.2174.5000107.2
67S53.4Low58.2Low65 Ų65101.5 Ų101.546%0.45564%0.637SS.*THydrogen-bonded Turntrans-132.24.8172.158.70000112.2P65 G69 S71P65-S67 PolarHBondContact O-N 3.44Å; S67-G69 VanDerWaalsContact C-N 3.34Å; S67-S71 WeakPolarHBondContact O-CB 3.39Å; S67-S71 PolarHBondContact O-OG 3.27Å
68I52Low57.4Low154 Ų154103.9 Ų103.979%0.7965%0.649SS**THydrogen-bonded Turntrans-82-11.5177-63.5177.6000112
69G57Low56.6Low83 Ų83102.6 Ų102.686%0.85666%0.66SS**THydrogen-bonded Turntrans-106.3-5.717800000116.6S67S67-G69 VanDerWaalsContact C-N 3.34Å
70R54.1Low55.7Low241 Ų241101.8 Ų101.891%0.90966%0.664SS**THydrogen-bonded Turntrans-135.34.8-170.8-157.3172.5179.2147.10.3115.2
71S49.3Very low55.1Low59 Ų59105.9 Ų105.941%0.41367%0.674SS.*  trans-103.136.4-172.6690000115.6S67 G73 A74S67-S71 WeakPolarHBondContact O-CB 3.39Å; S67-S71 PolarHBondContact O-OG 3.27Å; S71-G73 PolarHBondContact O-N 3.35Å; S71-A74 PolarHBondContact O-N 3.49Å; S71-A74 VanDerWaalsContact O-N 3.08Å
72V50.5Low54.2Low152 Ų152106 Ų10692%0.92169%0.685SS**THydrogen-bonded Turntrans-60.1-10.8167.81690000112.6
73G57.3Low53.6Low65 Ų65102.5 Ų102.567%0.6767%0.674SS**THydrogen-bonded Turntrans-100.1-6.4173.200000116.7S71S71-G73 PolarHBondContact O-N 3.35Å
74A51.1Low53.1Low48 Ų48104.3 Ų104.340%0.39768%0.682SS.*THydrogen-bonded Turntrans-97.4-15.6-174.500000114S71 S76 M77S71-A74 PolarHBondContact O-N 3.49Å; S71-A74 VanDerWaalsContact O-N 3.08Å; A74-S76 PolarHBondContact O-N 2.81Å; A74-S76 VanDerWaalsContact O-N 3.17Å; A74-M77 PolarHBondContact O-N 2.8Å; A74-M77 VanDerWaalsContact O-N 3.17Å
75A52.4Low53.1Low83 Ų83105.7 Ų105.769%0.68670%0.696SS**THydrogen-bonded Turntrans-61-22.5175.300000112.9
76S50.9Low53.3Low108 Ų108113.6 Ų113.676%0.75572%0.719SS**THydrogen-bonded Turntrans-78.9-22.3178.4-1670000113.8A74A74-S76 PolarHBondContact O-N 2.81Å; A74-S76 VanDerWaalsContact O-N 3.17Å
77M53.4Low53.3Low161 Ų161110.2 Ų110.279%0.79370%0.697SS**THydrogen-bonded Turntrans-90.6-12.2-177.9-62.6-178.8104.300113.7A74A74-M77 PolarHBondContact O-N 2.8Å; A74-M77 VanDerWaalsContact O-N 3.17Å
78L53.7Low53.4Low138 Ų138115.2 Ų115.272%0.72371%0.711SS**SBendtrans-93.2-13.3178.6-119.4141.3000113.2G80L78-G80 PolarHBondContact O-N 3.42Å
79G57.7Low53.6Low68 Ų68112.2 Ų112.270%0.70170%0.704SS**THydrogen-bonded Turntrans-76.2-1.7175.300000115.4
80G54Low53.5Low65 Ų65111.5 Ų111.567%0.6769%0.685SS**THydrogen-bonded Turntrans-99.1-5178.900000115.2L78 S82L78-G80 PolarHBondContact O-N 3.42Å; G80-S82 PolarHBondContact O-N 2.66Å
81F52.5Low53.6Low152 Ų152105.4 Ų105.467%0.66767%0.671SS**  trans-85.151.6176.9-84.9-81.2000111.6F87F81-F87 HydrophobicContact CB-CZ 4.45Å; F81-F87 AromaticContact CD1-CE1 3.69Å; F81-F87 HydrophobicContact CD1-CE1 3.69Å; F81-F87 AromaticContact CD1-CZ 3.52Å; F81-F87 HydrophobicContact CD1-CZ 3.52Å; F81-F87 AromaticContact CE1-CE1 3.87Å; F81-F87 HydrophobicContact CE1-CE1 3.87Å; F81-F87 HydrophobicContact CE1-CZ 4.18Å; F81-F87 HydrophobicContact CG-CZ 4.36Å
82S50.4Low54Low118 Ų118110 Ų11083%0.82568%0.683SS**  trans-10098.5168.8-177.90000108.3G80G80-S82 PolarHBondContact O-N 2.66Å
83G52.6Low54.6Low49 Ų49106.4 Ų106.451%0.50566%0.663SS.*  trans163.880.5-179.700000111.7G85G83-G85 PolarHBondContact O-N 3.04Å
84A51.8Low54.7Low111 Ų111106 Ų10692%0.91765%0.651SS**THydrogen-bonded Turntrans-63.234.8-178.700000115.5
85G60.4Low55.2Low68 Ų68108 Ų10870%0.70166%0.658SS**THydrogen-bonded Turntrans-133.7-0.6-174.800000116.3G83G83-G85 PolarHBondContact O-N 3.04Å
86R53.7Low56.1Low225 Ų225110.2 Ų110.285%0.84965%0.654SS**SBendtrans-114-10-175.7-70.7-175176.5157.2-0.7116K88 S89R86-K88 PolarHBondContact O-N 2.77Å; R86-S89 PolarHBondContact O-N 3.16Å
87F50.9Low56.5Low101 Ų101110.4 Ų110.444%0.44365%0.646SS.*Hα-helixtrans-73.6-5-177.7-60.9-68.3000115.1F81 S89 S90F81-F87 HydrophobicContact CB-CZ 4.45Å; F81-F87 AromaticContact CD1-CE1 3.69Å; F81-F87 HydrophobicContact CD1-CE1 3.69Å; F81-F87 AromaticContact CD1-CZ 3.52Å; F81-F87 HydrophobicContact CD1-CZ 3.52Å; F81-F87 AromaticContact CE1-CE1 3.87Å; F81-F87 HydrophobicContact CE1-CE1 3.87Å; F81-F87 HydrophobicContact CE1-CZ 4.18Å; F81-F87 HydrophobicContact CG-CZ 4.36Å; F87-S89 PolarHBondContact O-N 2.81Å; F87-S90 PolarHBondContact O-OG 3.18Å
88K56.1Low56.9Low171 Ų171109.3 Ų109.374%0.74364%0.637SS**Hα-helixtrans-70-22.3174.3-162.2172.4-175.7-179.80112.7R86R86-K88 PolarHBondContact O-N 2.77Å
89S55.8Low57.2Low91 Ų91112.5 Ų112.564%0.63664%0.639SS**Hα-helixtrans-83.3-38.5178.6-173.90000112.6R86 F87 L91 K92 C93R86-S89 PolarHBondContact O-N 3.16Å; F87-S89 PolarHBondContact O-N 2.81Å; S89-L91 PolarHBondContact O-N 2.9Å; S89-K92 PolarHBondContact O-N 3.14Å; S89-C93 PolarHBondContact O-N 3.29Å
90S55.7Low57.3Low67 Ų67112.9 Ų112.947%0.46963%0.63SS.*Hα-helixtrans-69.1-33.4-179.163.50000112.9F87 K92 C93 S94F87-S90 PolarHBondContact O-OG 3.18Å; S90-K92 PolarHBondContact O-N 3.14Å; S90-C93 PolarHBondContact O-N 2.94Å; S90-S94 PolarHBondContact O-N 2.92Å
91L55Low57.6Low114 Ų114113.2 Ų113.260%0.59762%0.623SS**Hα-helixtrans-61.8-41176-97.6155.3000112.7S89 S94 T95S89-L91 PolarHBondContact O-N 2.9Å; L91-S94 PolarHBondContact O-N 3.31Å; L91-S94 PolarHBondContact O-OG 2.93Å; L91-T95 PolarHBondContact O-N 3.38Å; L91-T95 VanDerWaalsContact O-N 3.16Å; L91-T95 PolarHBondContact O-OG1 3.42Å
92K59.1Low57.7Low156 Ų156108.1 Ų108.168%0.67861%0.606SS**Hα-helixtrans-65.8-37.2176.2-71.2-178.3171.7-172.70112.4S89 S90 T95 H96S89-K92 PolarHBondContact O-N 3.14Å; S90-K92 PolarHBondContact O-N 3.14Å; K92-T95 PolarHBondContact O-N 3.41Å; K92-H96 PolarHBondContact O-N 2.8Å
93C61.4Low57.9Low75 Ų75109.4 Ų109.451%0.50760%0.6SS.*Hα-helixtrans-66.2-38.8174.3-171.10000111.5S89 S90 T95 H96 L97S89-C93 PolarHBondContact O-N 3.29Å; S90-C93 PolarHBondContact O-N 2.94Å; C93-T95 VanDerWaalsContact C-N 3.3Å; C93-T95 PolarHBondContact O-N 3Å; C93-H96 PolarHBondContact O-N 3.2Å; C93-L97 PolarHBondContact O-N 2.97Å; C93-L97 VanDerWaalsContact O-N 3.13Å
94S59.9Low57.9Low58 Ų58110.4 Ų110.441%0.40660%0.599SS.*Hα-helixtrans-63.1-35.717688.80000112.4S90 L91 H96 L97 F98S90-S94 PolarHBondContact O-N 2.92Å; L91-S94 PolarHBondContact O-N 3.31Å; L91-S94 PolarHBondContact O-OG 2.93Å; S94-H96 VanDerWaalsContact C-N 3.32Å; S94-H96 PolarHBondContact O-N 3.47Å; S94-L97 PolarHBondContact O-N 3.25Å; S94-F98 WeakPolarHBondContact O-CB 3.5Å; S94-F98 PolarHBondContact O-N 2.93Å
95T61.8Low58.1Low89 Ų89109.8 Ų109.855%0.54658%0.584SS.*Hα-helixtrans-65.6-34.2177.4-50.50000112.2L91 K92 C93 R99L91-T95 PolarHBondContact O-N 3.38Å; L91-T95 VanDerWaalsContact O-N 3.16Å; L91-T95 PolarHBondContact O-OG1 3.42Å; K92-T95 PolarHBondContact O-N 3.41Å; C93-T95 VanDerWaalsContact C-N 3.3Å; C93-T95 PolarHBondContact O-N 3Å; T95-R99 PolarHBondContact O-N 3.4Å
96H71.2Confident58Low129 Ų129112.8 Ų112.860%0.59758%0.583SS**Hα-helixtrans-71.7-43.7175.6-169.3-94.1000112K92 C93 S94 F98 R99 C100K92-H96 PolarHBondContact O-N 2.8Å; C93-H96 PolarHBondContact O-N 3.2Å; S94-H96 VanDerWaalsContact C-N 3.32Å; S94-H96 PolarHBondContact O-N 3.47Å; H96-F98 VanDerWaalsContact C-N 3.34Å; H96-R99 PolarHBondContact O-N 3.36Å; H96-C100 PolarHBondContact O-N 3.42Å
97L59.6Low58.1Low112 Ų112106.7 Ų106.759%0.58657%0.571SS**Hα-helixtrans-67.3-35.6175.9-69.4177.2000112.1C93 S94 C100 S101C93-L97 PolarHBondContact O-N 2.97Å; C93-L97 VanDerWaalsContact O-N 3.13Å; S94-L97 PolarHBondContact O-N 3.25Å; L97-C100 PolarHBondContact O-N 3.21Å; L97-S101 WeakPolarHBondContact O-CB 3.35Å; L97-S101 PolarHBondContact O-N 3.25Å
98F60.9Low58.4Low138 Ų138106.7 Ų106.761%0.60558%0.575SS**Hα-helixtrans-67.9-37.2175.2-165.1-99000111S94 H96 S102S94-F98 WeakPolarHBondContact O-CB 3.5Å; S94-F98 PolarHBondContact O-N 2.93Å; H96-F98 VanDerWaalsContact C-N 3.34Å; F98-S102 WeakPolarHBondContact O-CA 3.29Å; F98-S102 WeakPolarHBondContact O-CB 3.37Å; F98-S102 PolarHBondContact O-N 3.48Å; F98-S102 PolarHBondContact O-OG 3.38Å
99R61.6Low58.5Low206 Ų206102.2 Ų102.278%0.77756%0.563SS**Hα-helixtrans-67.7-42.4171.9-104.8-161.8172.7-157.7-0.5113.2T95 H96 S102 M103T95-R99 PolarHBondContact O-N 3.4Å; H96-R99 PolarHBondContact O-N 3.36Å; R99-S102 PolarHBondContact O-N 3.38Å; R99-M103 PolarHBondContact O-N 3.11Å
100C59.4Low58.5Low75 Ų75101.5 Ų101.551%0.50756%0.558SS.*Hα-helixtrans-66.8-38.8175.8-82.30000112.2H96 L97H96-C100 PolarHBondContact O-N 3.42Å; L97-C100 PolarHBondContact O-N 3.21Å
101S59.5Low58.5Low73 Ų73104.8 Ų104.851%0.5157%0.57SS.*Hα-helixtrans-72.7-35.8176.4-169.80000112L97 M103 S104L97-S101 WeakPolarHBondContact O-CB 3.35Å; L97-S101 PolarHBondContact O-N 3.25Å; S101-M103 PolarHBondContact O-N 3.35Å; S101-S104 PolarHBondContact O-N 3.02Å; S101-S104 VanDerWaalsContact O-N 3.11Å
102S54.5Low58.7Low45 Ų45107.9 Ų107.932%0.31558%0.579SS.*Hα-helixtrans-65.4-23.4177.1-670000113.3F98 R99 I106F98-S102 WeakPolarHBondContact O-CA 3.29Å; F98-S102 WeakPolarHBondContact O-CB 3.37Å; F98-S102 PolarHBondContact O-N 3.48Å; F98-S102 PolarHBondContact O-OG 3.38Å; R99-S102 PolarHBondContact O-N 3.38Å; S102-I106 WeakPolarHBondContact O-CD1 3.41Å; S102-I106 WeakPolarHBondContact O-CG1 3.45Å
103M55.9Low58.5Low144 Ų144109.3 Ų109.371%0.70959%0.585SS**Hα-helixtrans-70.2-35.3172-99.9-173.2151.600112.6R99 S101 V105R99-M103 PolarHBondContact O-N 3.11Å; S101-M103 PolarHBondContact O-N 3.35Å; M103-V105 VanDerWaalsContact C-N 3.34Å; M103-V105 PolarHBondContact O-N 3.06Å
104S52.8Low58.4Low70 Ų70110.8 Ų110.849%0.4959%0.592SS.*Hα-helixtrans-71.5-26.7-179.4-75.10000113.6S101 L108S101-S104 PolarHBondContact O-N 3.02Å; S101-S104 VanDerWaalsContact O-N 3.11Å; S104-L108 WeakPolarHBondContact O-CB 3.1Å; S104-L108 WeakPolarHBondContact O-CD1 3.36Å; S104-L108 PolarHBondContact O-N 3.47Å
105V56Low58.2Low98 Ų98111.3 Ų111.359%0.59461%0.606SS**Hα-helixtrans-81.6-14.8-176.4-168.80000112.7M103 P109M103-V105 VanDerWaalsContact C-N 3.34Å; M103-V105 PolarHBondContact O-N 3.06Å; V105-P109 VanDerWaalsContact O-CD 3.27Å; V105-P109 WeakPolarHBondContact O-CD 3.38Å; V105-P109 WeakPolarHBondContact O-CG 3.41Å
106I56.9Low58.2Low131 Ų131114.9 Ų114.967%0.67262%0.622SS**Hα-helixtrans-90-18.7175.3-12.7179.4000112.2S102 P109S102-I106 WeakPolarHBondContact O-CD1 3.41Å; S102-I106 WeakPolarHBondContact O-CG1 3.45Å; I106-P109 VanDerWaalsContact C-CD 3.49Å; I106-P109 WeakPolarHBondContact O-CD 3.46Å
107T55.9Low57.3Low97 Ų97113.9 Ų113.960%0.59563%0.629SS**Hα-helixtrans-102.3-25.7-178.2-51.80000113.3S110T107-S110 PolarHBondContact O-OG 3.48Å; T107-S110 VanDerWaalsContact O-OG 3.14Å
108L58.3Low56.6Low101 Ų101115.6 Ų115.653%0.52967%0.674SS.*Hα-helixtrans-65.8-27173.4-86.4161.2000116.5S104 S110 L111 F112S104-L108 WeakPolarHBondContact O-CB 3.1Å; S104-L108 WeakPolarHBondContact O-CD1 3.36Å; S104-L108 PolarHBondContact O-N 3.47Å; L108-S110 PolarHBondContact O-N 2.89Å; L108-L111 PolarHBondContact O-N 2.97Å; L108-F112 PolarHBondContact O-N 2.84Å
109P57.6Low56.4Low77 Ų77114.5 Ų114.550%0.568%0.677SS.*Hα-helixtrans-62.7-23.8-178.5-22.232.9000114.4V105 I106V105-P109 VanDerWaalsContact O-CD 3.27Å; V105-P109 WeakPolarHBondContact O-CD 3.38Å; V105-P109 WeakPolarHBondContact O-CG 3.41Å; I106-P109 VanDerWaalsContact C-CD 3.49Å; I106-P109 WeakPolarHBondContact O-CD 3.46Å
110S55.7Low56.1Low76 Ų76109.7 Ų109.753%0.53167%0.672SS.*Hα-helixtrans-88.8-20.9179.127.90000113.9T107 L108 T114T107-S110 PolarHBondContact O-OG 3.48Å; T107-S110 VanDerWaalsContact O-OG 3.14Å; L108-S110 PolarHBondContact O-N 2.89Å; S110-T114 WeakPolarHBondContact O-CB 3.5Å; S110-T114 PolarHBondContact O-OG1 3.47Å
111L55.4Low55.9Low136 Ų136111.6 Ų111.671%0.71268%0.681SS**Hα-helixtrans-86.2-27.2-178.7-135.4138.8000112.2L108L108-L111 PolarHBondContact O-N 2.97Å
112F58.9Low55.7Low180 Ų180113.9 Ų113.979%0.78969%0.691SS**Hα-helixtrans-81.8-23.2177.8-127.7-91.8000113.8L108L108-F112 PolarHBondContact O-N 2.84Å
113F56Low55.8Low185 Ų185118.2 Ų118.281%0.81172%0.715SS**Hα-helixtrans-93.5-12.5178.5-91.4-83.5000114.6
114T58Low55.8Low107 Ų107116.5 Ų116.566%0.65672%0.715SS**SBendtrans-99.95.2-175.5-48.80000113.3S110S110-T114 WeakPolarHBondContact O-CB 3.5Å; S110-T114 PolarHBondContact O-OG1 3.47Å
115G57.4Low56Low68 Ų68119.8 Ų119.870%0.70173%0.731SS**SBendtrans-102.71.3-179.600000116.2
116L61Low56Low165 Ų165121.5 Ų121.586%0.86474%0.742SS**  trans-128.625.1-174.1-96.3161.7000113.5
117S52.1Low56Low107 Ų107120.7 Ų120.775%0.74875%0.748SS**  trans-98.377.8162.959.40000109.1
118G45.1Very low56Low149 Ų149122.8 Ų122.8100%1.53676%0.762SS**  trans-99.7015700000109.2

Retrieved 118 of 118 residues in 67.5 ms (Link to these results)