A0A5K4EG51_SCHMA Loading...

Putative fun14 domain containing

AlphaFold DB (G4VTA1), UniProt , Accession A0A5K4EG51, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 129 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
1M58.2Low76.2Confident207 Ų207116.7 Ų116.7100%1.0259%0.588SS**  0-9.10-76.6169.6170.600113.4R3 T4M1-R3 PolarHBondContact O-N 2.96Å; M1-T4 PolarHBondContact O-OG1 3.27Å
2T69.1Low76.4Confident117 Ų117115.2 Ų115.272%0.71858%0.582SS**Hα-helixtrans-72.3-22.2-170.850.80000117.1T4 D6T2-T4 PolarHBondContact O-N 3.3Å; T2-D6 PolarHBondContact O-N 3.41Å
3R74Confident76.9Confident192 Ų192111.5 Ų111.573%0.72557%0.569SS**Hα-helixtrans-67.4-38.1-175.5-174.282.214493.85.3112.6M1 Q7M1-R3 PolarHBondContact O-N 2.96Å; R3-Q7 VanDerWaalsContact O-CG 3.31Å; R3-Q7 WeakPolarHBondContact O-CG 3.44Å; R3-Q7 PolarHBondContact O-N 3.38Å
4T76.5Confident77Confident105 Ų105110.2 Ų110.264%0.64457%0.569SS**Hα-helixtrans-78.7-38.2-176.645.90000111.9M1 T2 Q7 S8M1-T4 PolarHBondContact O-OG1 3.27Å; T2-T4 PolarHBondContact O-N 3.3Å; T4-Q7 PolarHBondContact O-N 3.09Å; T4-S8 PolarHBondContact O-N 3.22Å
5E77Confident77.2Confident121 Ų121109.2 Ų109.257%0.56557%0.569SS**Hα-helixtrans-61.6-46.5175.2-74.1166.1108.200110.8Q7 S8 E9E5-Q7 VanDerWaalsContact C-N 3.34Å; E5-Q7 PolarHBondContact O-N 3.24Å; E5-S8 WeakPolarHBondContact O-CB 3.43Å; E5-S8 PolarHBondContact O-N 3.02Å; E5-S8 VanDerWaalsContact O-N 3.16Å; E5-E9 WeakPolarHBondContact O-CG 3.31Å; E5-E9 PolarHBondContact O-N 3.48Å
6D81.7Confident77.4Confident85 Ų85110.1 Ų110.146%0.45557%0.568SS.*Hα-helixtrans-59-42177.2178.184.2000112.7T2 E9 R10T2-D6 PolarHBondContact O-N 3.41Å; D6-E9 PolarHBondContact O-N 2.94Å; D6-R10 WeakPolarHBondContact O-CB 3.41Å; D6-R10 WeakPolarHBondContact O-CG 3.39Å; D6-R10 PolarHBondContact O-N 3.36Å; D6-R10 WeakPolarHBondContact OD2-CD 3.29Å
7Q78.5Confident77.7Confident78 Ų78109.3 Ų109.336%0.36456%0.564SS.*Hα-helixtrans-68.5-37.2177.8-62.2-59.1-82.400112.3R3 T4 E5 A11R3-Q7 VanDerWaalsContact O-CG 3.31Å; R3-Q7 WeakPolarHBondContact O-CG 3.44Å; R3-Q7 PolarHBondContact O-N 3.38Å; T4-Q7 PolarHBondContact O-N 3.09Å; E5-Q7 VanDerWaalsContact C-N 3.34Å; E5-Q7 PolarHBondContact O-N 3.24Å; Q7-A11 VanDerWaalsContact O-CB 3.27Å; Q7-A11 WeakPolarHBondContact O-CB 3.06Å; Q7-A11 PolarHBondContact O-N 3.37Å
8S79.2Confident77.6Confident62 Ų62107.5 Ų107.543%0.43456%0.559SS.*Hα-helixtrans-62.4-49.6173.6-179.90000110.7T4 E5 R10 A11 L12T4-S8 PolarHBondContact O-N 3.22Å; E5-S8 WeakPolarHBondContact O-CB 3.43Å; E5-S8 PolarHBondContact O-N 3.02Å; E5-S8 VanDerWaalsContact O-N 3.16Å; S8-R10 VanDerWaalsContact C-N 3.34Å; S8-R10 PolarHBondContact O-N 3.1Å; S8-A11 PolarHBondContact O-N 3.31Å; S8-L12 WeakPolarHBondContact O-CB 3.35Å; S8-L12 VanDerWaalsContact O-CG 3.24Å; S8-L12 WeakPolarHBondContact O-CG 3.48Å; S8-L12 PolarHBondContact O-N 2.98Å
9E82.9Confident77.3Confident117 Ų117105.2 Ų105.255%0.54755%0.547SS..Hα-helixtrans-60.1-42.9178.4-71.9-64.1122.300111.6E5 D6 L12 T13E5-E9 WeakPolarHBondContact O-CG 3.31Å; E5-E9 PolarHBondContact O-N 3.48Å; D6-E9 PolarHBondContact O-N 2.94Å; E9-L12 PolarHBondContact O-N 3.35Å; E9-T13 VanDerWaalsContact O-CB 3.28Å; E9-T13 WeakPolarHBondContact O-CB 3.26Å; E9-T13 PolarHBondContact O-N 2.97Å; E9-T13 PolarHBondContact O-OG1 3.13Å
10R83.4Confident77.1Confident145 Ų145104 Ų10455%0.54754%0.542SS..Hα-helixtrans-63.3-44.1174.7-70.9176.673.7-130.93111.8D6 S8 T13 V14D6-R10 WeakPolarHBondContact O-CB 3.41Å; D6-R10 WeakPolarHBondContact O-CG 3.39Å; D6-R10 PolarHBondContact O-N 3.36Å; D6-R10 WeakPolarHBondContact OD2-CD 3.29Å; S8-R10 VanDerWaalsContact C-N 3.34Å; S8-R10 PolarHBondContact O-N 3.1Å; R10-T13 PolarHBondContact O-N 3.06Å; R10-V14 WeakPolarHBondContact O-CG2 3.19Å; R10-V14 PolarHBondContact O-N 3.35Å
11A77.1Confident76.9Confident55 Ų55104.2 Ų104.246%0.45554%0.543SS..Hα-helixtrans-64.8-44.7177.400000111.6Q7 S8 T13 V14 V15Q7-A11 VanDerWaalsContact O-CB 3.27Å; Q7-A11 WeakPolarHBondContact O-CB 3.06Å; Q7-A11 PolarHBondContact O-N 3.37Å; S8-A11 PolarHBondContact O-N 3.31Å; A11-T13 VanDerWaalsContact C-N 3.31Å; A11-T13 PolarHBondContact O-N 3.1Å; A11-V14 PolarHBondContact O-N 3.45Å; A11-V15 WeakPolarHBondContact O-CB 3.08Å; A11-V15 VanDerWaalsContact O-CG2 3.23Å; A11-V15 WeakPolarHBondContact O-CG2 3.26Å; A11-V15 PolarHBondContact O-N 2.94Å
12L79.1Confident77.2Confident98 Ų9895.6 Ų95.651%0.51350%0.502SS..Hα-helixtrans-61.3-39.9174.8-71.9174.3000111.3S8 E9 V15 K16S8-L12 WeakPolarHBondContact O-CB 3.35Å; S8-L12 VanDerWaalsContact O-CG 3.24Å; S8-L12 WeakPolarHBondContact O-CG 3.48Å; S8-L12 PolarHBondContact O-N 2.98Å; E9-L12 PolarHBondContact O-N 3.35Å; L12-V15 PolarHBondContact O-N 3.46Å; L12-K16 WeakPolarHBondContact O-CB 3.39Å; L12-K16 PolarHBondContact O-N 3.44Å
13T82.7Confident77Confident67 Ų6796.5 Ų96.541%0.41150%0.495SS..Hα-helixtrans-65-48176.2-58.40000110.8E9 R10 A11 V15 K16 D17E9-T13 VanDerWaalsContact O-CB 3.28Å; E9-T13 WeakPolarHBondContact O-CB 3.26Å; E9-T13 PolarHBondContact O-N 2.97Å; E9-T13 PolarHBondContact O-OG1 3.13Å; R10-T13 PolarHBondContact O-N 3.06Å; A11-T13 VanDerWaalsContact C-N 3.31Å; A11-T13 PolarHBondContact O-N 3.1Å; T13-V15 VanDerWaalsContact C-N 3.31Å; T13-V15 PolarHBondContact O-N 3.01Å; T13-K16 PolarHBondContact O-N 2.97Å; T13-D17 WeakPolarHBondContact O-CB 3.48Å; T13-D17 PolarHBondContact O-N 3.32Å
14V78.5Confident76.5Confident94 Ų9491.9 Ų91.957%0.5749%0.492SS*.Hα-helixtrans-60.8-42.1176.1171.60000111.3R10 A11 T18R10-V14 WeakPolarHBondContact O-CG2 3.19Å; R10-V14 PolarHBondContact O-N 3.35Å; A11-V14 PolarHBondContact O-N 3.45Å; V14-T18 WeakPolarHBondContact O-CB 3.43Å; V14-T18 PolarHBondContact O-N 3.3Å; V14-T18 PolarHBondContact O-OG1 3.38Å
15V80Confident75.7Confident95 Ų9594.9 Ų94.958%0.57649%0.492SS*.Hα-helixtrans-64-43.9176.1169.70000110.8A11 L12 T13 L19A11-V15 WeakPolarHBondContact O-CB 3.08Å; A11-V15 VanDerWaalsContact O-CG2 3.23Å; A11-V15 WeakPolarHBondContact O-CG2 3.26Å; A11-V15 PolarHBondContact O-N 2.94Å; L12-V15 PolarHBondContact O-N 3.46Å; T13-V15 VanDerWaalsContact C-N 3.31Å; T13-V15 PolarHBondContact O-N 3.01Å; V15-L19 WeakPolarHBondContact O-CB 3.5Å; V15-L19 PolarHBondContact O-N 3.27Å
16K80.3Confident74.8Confident124 Ų12494.5 Ų94.554%0.53950%0.5SS..Hα-helixtrans-69.6-43.1-179.9-174.3-175173.6-1670112.3L12 T13 T18 L19 D20L12-K16 WeakPolarHBondContact O-CB 3.39Å; L12-K16 PolarHBondContact O-N 3.44Å; T13-K16 PolarHBondContact O-N 2.97Å; K16-T18 VanDerWaalsContact C-N 3.32Å; K16-L19 CarbonylContact O-C 3.48Å; K16-L19 WeakPolarHBondContact O-CA 3.31Å; K16-L19 VanDerWaalsContact O-CB 3.25Å; K16-L19 WeakPolarHBondContact O-CB 3.43Å; K16-L19 PolarHBondContact O-N 3.43Å; K16-D20 WeakPolarHBondContact O-CB 3.48Å; K16-D20 PolarHBondContact O-N 2.88Å
17D82.3Confident73.5Confident96 Ų9698.1 Ų98.151%0.51351%0.514SS..Hα-helixtrans-63.5-43.2175.8-75.6-8.6000110.2T13 L19 D20 D21T13-D17 WeakPolarHBondContact O-CB 3.48Å; T13-D17 PolarHBondContact O-N 3.32Å; D17-L19 VanDerWaalsContact C-N 3.26Å; D17-L19 PolarHBondContact O-N 3.48Å; D17-D20 PolarHBondContact O-N 3.46Å; D17-D21 WeakPolarHBondContact O-CB 3.49Å; D17-D21 PolarHBondContact O-N 2.75Å
18T76.5Confident72.5Confident77 Ų7798 Ų9847%0.47251%0.51SS..Hα-helixtrans-60.5-40.2171.6-56.50000110.3V14 K16 I22V14-T18 WeakPolarHBondContact O-CB 3.43Å; V14-T18 PolarHBondContact O-N 3.3Å; V14-T18 PolarHBondContact O-OG1 3.38Å; K16-T18 VanDerWaalsContact C-N 3.32Å; T18-I22 HydrophobicContact CG2-CD1 3.8Å; T18-I22 WeakPolarHBondContact O-CB 3.42Å; T18-I22 VanDerWaalsContact O-CD1 3.24Å; T18-I22 WeakPolarHBondContact O-CD1 3.3Å; T18-I22 WeakPolarHBondContact O-CG1 3.4Å; T18-I22 PolarHBondContact O-N 2.87Å
19L71.5Confident72.1Confident63 Ų63101 Ų10133%0.3352%0.517SS..Hα-helixtrans-66.1-41.3177.7-170.967000113V15 K16 D17 I22 K23 I32V15-L19 WeakPolarHBondContact O-CB 3.5Å; V15-L19 PolarHBondContact O-N 3.27Å; K16-L19 CarbonylContact O-C 3.48Å; K16-L19 WeakPolarHBondContact O-CA 3.31Å; K16-L19 VanDerWaalsContact O-CB 3.25Å; K16-L19 WeakPolarHBondContact O-CB 3.43Å; K16-L19 PolarHBondContact O-N 3.43Å; D17-L19 VanDerWaalsContact C-N 3.26Å; D17-L19 PolarHBondContact O-N 3.48Å; L19-I22 WeakPolarHBondContact O-CB 3.27Å; L19-I22 PolarHBondContact O-N 3.36Å; L19-K23 WeakPolarHBondContact O-CB 3.46Å; L19-K23 PolarHBondContact O-N 3.48Å; L19-I32 HydrophobicContact CD1-CB 4.14Å; L19-I32 HydrophobicContact CD1-CD1 3.53Å; L19-I32 HydrophobicContact CD1-CG1 3.44Å; L19-I32 VanDerWaalsContact CD1-CG1 3.44Å; L19-I32 HydrophobicContact CD1-CG2 3.92Å; L19-I32 HydrophobicContact CG-CD1 4.19Å
20D74.1Confident71.8Confident82 Ų8299.7 Ų99.744%0.43951%0.511SS..Hα-helixtrans-73.5-40.7-178.3-84-11.6000111K16 D17 I22 K23 S24K16-D20 WeakPolarHBondContact O-CB 3.48Å; K16-D20 PolarHBondContact O-N 2.88Å; D17-D20 PolarHBondContact O-N 3.46Å; D20-I22 PolarHBondContact O-N 3.12Å; D20-K23 PolarHBondContact O-N 3.17Å; D20-S24 PolarHBondContact O-N 2.87Å; D20-S24 VanDerWaalsContact O-N 3.16Å
21D73.2Confident71.6Confident108 Ų10893.8 Ų93.858%0.57849%0.491SS*.Hα-helixtrans-61.2-37.4170.2-172.174.7000111.3D17 R28D17-D21 WeakPolarHBondContact O-CB 3.49Å; D17-D21 PolarHBondContact O-N 2.75Å; D21-R28 PolarHBondContact O-NH2 2.89Å; D21-R28 IonicContact OD2-NH2 3.6Å
22I64.1Low71.8Confident27 Ų2793.8 Ų93.814%0.13848%0.483CS..Hα-helixtrans-64-49.3174.8-76.8171.5000111.3T18 L19 D20 S24 R25 R28 V31 I32T18-I22 HydrophobicContact CG2-CD1 3.8Å; T18-I22 WeakPolarHBondContact O-CB 3.42Å; T18-I22 VanDerWaalsContact O-CD1 3.24Å; T18-I22 WeakPolarHBondContact O-CD1 3.3Å; T18-I22 WeakPolarHBondContact O-CG1 3.4Å; T18-I22 PolarHBondContact O-N 2.87Å; L19-I22 WeakPolarHBondContact O-CB 3.27Å; L19-I22 PolarHBondContact O-N 3.36Å; D20-I22 PolarHBondContact O-N 3.12Å; I22-S24 VanDerWaalsContact C-N 3.26Å; I22-S24 PolarHBondContact O-N 3.44Å; I22-R25 PolarHBondContact O-N 3.21Å; I22-R28 HydrophobicContact CG2-CB 3.66Å; I22-R28 HydrophobicContact CG2-CG 4.24Å; I22-R28 VanDerWaalsContact O-CB 3.31Å; I22-R28 WeakPolarHBondContact O-CB 3.45Å; I22-R28 PolarHBondContact O-NE 2.73Å; I22-R28 VanDerWaalsContact O-NE 3.13Å; I22-V31 HydrophobicContact CD1-CG1 4.27Å; I22-V31 HydrophobicContact CG2-CB 4.28Å; I22-V31 HydrophobicContact CG2-CG1 4.42Å; I22-I32 HydrophobicContact CG2-CG1 4.27Å
23K64.6Low72.1Confident136 Ų13694.3 Ų94.359%0.59149%0.485SS*.Hα-helixtrans-62.8-29.1-177.3-173-179.1176.7-172.10113.2L19 D20 R25 I32L19-K23 WeakPolarHBondContact O-CB 3.46Å; L19-K23 PolarHBondContact O-N 3.48Å; D20-K23 PolarHBondContact O-N 3.17Å; K23-R25 PolarHBondContact O-N 3.43Å; K23-I32 HydrophobicContact CB-CD1 4.41Å
24S64.2Low72.3Confident94 Ų9491.1 Ų91.166%0.65747%0.466SS*.THydrogen-bonded Turntrans-58.7-16.5176.3-172.90000113.7D20 I22D20-S24 PolarHBondContact O-N 2.87Å; D20-S24 VanDerWaalsContact O-N 3.16Å; I22-S24 VanDerWaalsContact C-N 3.26Å; I22-S24 PolarHBondContact O-N 3.44Å
25R59.3Low72.8Confident169 Ų16989.1 Ų89.164%0.63845%0.453SS*.SBendtrans-108.9118.1174.3-60-69.9-173.9155.60.2110.6I22 K23 H27 R28I22-R25 PolarHBondContact O-N 3.21Å; K23-R25 PolarHBondContact O-N 3.43Å; R25-H27 PolarHBondContact O-N 2.88Å; R25-R28 VanDerWaalsContact CG-NH2 3.34Å; R25-R28 PolarHBondContact O-N 3.37Å
26P58Low73.3Confident113 Ų11386.5 Ų86.573%0.73445%0.445SS*.G310 helixtrans-59.1-22.1-175.217.7-28.9000114.7R28P26-R28 VanDerWaalsContact C-N 3.29Å; P26-R28 PolarHBondContact O-N 2.76Å
27H53.6Low73.9Confident160 Ų16082.5 Ų82.574%0.74143%0.433SS*.G310 helixtrans-75.9-9.4177.3-15569.6000114.4R25R25-H27 PolarHBondContact O-N 2.88Å
28R58.3Low74.4Confident77 Ų7778 Ų7829%0.29141%0.409SS..G310 helixtrans-99.80.3-172.3-90-167.5-64.6-159.74.1115.7D21 I22 R25 P26 Q30 V31D21-R28 PolarHBondContact O-NH2 2.89Å; D21-R28 IonicContact OD2-NH2 3.6Å; I22-R28 HydrophobicContact CG2-CB 3.66Å; I22-R28 HydrophobicContact CG2-CG 4.24Å; I22-R28 VanDerWaalsContact O-CB 3.31Å; I22-R28 WeakPolarHBondContact O-CB 3.45Å; I22-R28 PolarHBondContact O-NE 2.73Å; I22-R28 VanDerWaalsContact O-NE 3.13Å; R25-R28 VanDerWaalsContact CG-NH2 3.34Å; R25-R28 PolarHBondContact O-N 3.37Å; P26-R28 VanDerWaalsContact C-N 3.29Å; P26-R28 PolarHBondContact O-N 2.76Å; R28-Q30 PolarHBondContact O-N 2.8Å; R28-Q30 VanDerWaalsContact O-N 3.14Å; R28-V31 HydrophobicContact CB-CG2 4.45Å; R28-V31 HydrophobicContact CG-CG2 4.22Å; R28-V31 VanDerWaalsContact O-CB 3.28Å; R28-V31 WeakPolarHBondContact O-CB 3.47Å; R28-V31 PolarHBondContact O-N 2.99Å
29Q70.4Confident75.2Confident124 Ų12477.6 Ų77.658%0.57940%0.404SS*.Hα-helixtrans-55.5-33.1176.1-68.7-176.8-18.600112.9V31 I32 I33Q29-V31 VanDerWaalsContact C-N 3.25Å; Q29-V31 PolarHBondContact O-N 2.72Å; Q29-I32 PolarHBondContact O-N 3.49Å; Q29-I33 PolarHBondContact O-N 3.02Å
30Q76.3Confident76.3Confident89 Ų8980 Ų8042%0.41642%0.416SS..Hα-helixtrans-61.8-30.9175.9-66.3-177-4.300113.3R28 I32 G34R28-Q30 PolarHBondContact O-N 2.8Å; R28-Q30 VanDerWaalsContact O-N 3.14Å; Q30-I32 VanDerWaalsContact C-N 3.34Å; Q30-G34 PolarHBondContact O-N 3.11Å
31V79Confident77.2Confident22 Ų2277.8 Ų77.813%0.13341%0.409CS..Hα-helixtrans-62.3-44.6176.3177.10000110.2I22 R28 Q29 I33 G34 V35 V113 S117I22-V31 HydrophobicContact CD1-CG1 4.27Å; I22-V31 HydrophobicContact CG2-CB 4.28Å; I22-V31 HydrophobicContact CG2-CG1 4.42Å; R28-V31 HydrophobicContact CB-CG2 4.45Å; R28-V31 HydrophobicContact CG-CG2 4.22Å; R28-V31 VanDerWaalsContact O-CB 3.28Å; R28-V31 WeakPolarHBondContact O-CB 3.47Å; R28-V31 PolarHBondContact O-N 2.99Å; Q29-V31 VanDerWaalsContact C-N 3.25Å; Q29-V31 PolarHBondContact O-N 2.72Å; V31-I33 PolarHBondContact O-N 3.37Å; V31-G34 CarbonylContact O-C 3.59Å; V31-G34 WeakPolarHBondContact O-CA 3.04Å; V31-G34 PolarHBondContact O-N 3.27Å; V31-V35 HydrophobicContact CG1-CG2 4.25Å; V31-V35 WeakPolarHBondContact O-CG2 3.14Å; V31-V35 PolarHBondContact O-N 3.39Å; V31-V113 HydrophobicContact CG2-CG1 3.28Å; V31-S117 PolarHBondContact O-OG 3.21Å
32I81.8Confident78.2Confident54 Ų5472.6 Ų72.628%0.27738%0.382SS..Hα-helixtrans-63.8-46.2-177-53.1-172.6000110.5L19 I22 K23 Q29 Q30 G34 V35 G36L19-I32 HydrophobicContact CD1-CB 4.14Å; L19-I32 HydrophobicContact CD1-CD1 3.53Å; L19-I32 HydrophobicContact CD1-CG1 3.44Å; L19-I32 VanDerWaalsContact CD1-CG1 3.44Å; L19-I32 HydrophobicContact CD1-CG2 3.92Å; L19-I32 HydrophobicContact CG-CD1 4.19Å; I22-I32 HydrophobicContact CG2-CG1 4.27Å; K23-I32 HydrophobicContact CB-CD1 4.41Å; Q29-I32 PolarHBondContact O-N 3.49Å; Q30-I32 VanDerWaalsContact C-N 3.34Å; I32-G34 VanDerWaalsContact C-N 3.3Å; I32-G34 PolarHBondContact O-N 2.94Å; I32-V35 PolarHBondContact O-N 3.25Å; I32-G36 PolarHBondContact O-N 2.94Å
33I84.9Confident79.6Confident110 Ų11076.7 Ų76.756%0.56440%0.396SS*.Hα-helixtrans-64-40.5177.1-56.9171.9000109.7Q29 V31 S37 F114Q29-I33 PolarHBondContact O-N 3.02Å; V31-I33 PolarHBondContact O-N 3.37Å; I33-S37 VanDerWaalsContact O-CB 3.24Å; I33-S37 WeakPolarHBondContact O-CB 3.33Å; I33-S37 PolarHBondContact O-N 3Å; I33-S37 PolarHBondContact O-OG 3.42Å; I33-F114 HydrophobicContact CG2-CE2 4.19Å
34G88.2Confident81Confident0 Ų074.2 Ų74.20%039%0.388CS..Hα-helixtrans-57.9-56.8173.800000112.3Q30 V31 I32 G36 S37 G38 F114 F118Q30-G34 PolarHBondContact O-N 3.11Å; V31-G34 CarbonylContact O-C 3.59Å; V31-G34 WeakPolarHBondContact O-CA 3.04Å; V31-G34 PolarHBondContact O-N 3.27Å; I32-G34 VanDerWaalsContact C-N 3.3Å; I32-G34 PolarHBondContact O-N 2.94Å; G34-G36 PolarHBondContact O-N 3.11Å; G34-S37 PolarHBondContact O-N 3.33Å; G34-S37 PolarHBondContact O-OG 3.07Å; G34-S37 VanDerWaalsContact O-OG 3.08Å; G34-G38 PolarHBondContact O-N 3.45Å; G34-F114 VanDerWaalsContact CA-CE2 3.42Å; G34-F118 VanDerWaalsContact O-CA 3.25Å; G34-F118 WeakPolarHBondContact O-CA 3.28Å
35V89.1Confident82.4Confident51 Ų5175.2 Ų75.231%0.30938%0.381SS..Hα-helixtrans-58.2-48.7178.6176.50000111.4V31 I32 G38 L39V31-V35 HydrophobicContact CG1-CG2 4.25Å; V31-V35 WeakPolarHBondContact O-CG2 3.14Å; V31-V35 PolarHBondContact O-N 3.39Å; I32-V35 PolarHBondContact O-N 3.25Å; V35-G38 PolarHBondContact O-N 3.38Å; V35-L39 HydrophobicContact CG1-CD1 3.97Å; V35-L39 HydrophobicContact CG1-CG 4.36Å; V35-L39 WeakPolarHBondContact O-CB 3.4Å; V35-L39 WeakPolarHBondContact O-CG 3.04Å; V35-L39 PolarHBondContact O-N 3.1Å
36G90.8Very high84Confident40 Ų4067.4 Ų67.441%0.41235%0.352SS..Hα-helixtrans-63.5-46-17800000112.8I32 G34 G38 L39 L40I32-G36 PolarHBondContact O-N 2.94Å; G34-G36 PolarHBondContact O-N 3.11Å; G36-G38 VanDerWaalsContact C-N 3.35Å; G36-L39 PolarHBondContact O-N 3.33Å; G36-L40 PolarHBondContact O-N 2.79Å; G36-L40 VanDerWaalsContact O-N 3.12Å
37S92.2Very high85.5Confident41 Ų4168 Ų6829%0.28734%0.344SS..Hα-helixtrans-66.7-36.8175.559.10000112.1I33 G34 L40 A41 F118I33-S37 VanDerWaalsContact O-CB 3.24Å; I33-S37 WeakPolarHBondContact O-CB 3.33Å; I33-S37 PolarHBondContact O-N 3Å; I33-S37 PolarHBondContact O-OG 3.42Å; G34-S37 PolarHBondContact O-N 3.33Å; G34-S37 PolarHBondContact O-OG 3.07Å; G34-S37 VanDerWaalsContact O-OG 3.08Å; S37-L40 PolarHBondContact O-N 2.95Å; S37-A41 WeakPolarHBondContact O-CB 3.34Å; S37-A41 PolarHBondContact O-N 2.59Å; S37-F118 WeakPolarHBondContact OG-CD2 3.48Å
38G92.9Very high87.3Confident0 Ų065.9 Ų65.90%034%0.336CS..Hα-helixtrans-61.2-47.617400000112.1G34 V35 G36 L40 A41 G42 F118 F122G34-G38 PolarHBondContact O-N 3.45Å; V35-G38 PolarHBondContact O-N 3.38Å; G36-G38 VanDerWaalsContact C-N 3.35Å; G38-L40 PolarHBondContact O-N 2.78Å; G38-A41 PolarHBondContact O-N 2.86Å; G38-G42 PolarHBondContact O-N 3.09Å; G38-F118 VanDerWaalsContact CA-CE2 3.49Å; G38-F118 WeakPolarHBondContact CA-O 3.2Å; G38-F118 VanDerWaalsContact N-CD2 3.33Å; G38-F122 WeakPolarHBondContact O-CA 3.21Å; G38-F122 PolarHBondContact O-N 3.22Å
39L93.2Very high88.9Confident69 Ų6963.1 Ų63.136%0.36133%0.332SS..Hα-helixtrans-60-47.5177.7-78.2170000111.6V35 G36 G42 Y43 G121 I124 A125V35-L39 HydrophobicContact CG1-CD1 3.97Å; V35-L39 HydrophobicContact CG1-CG 4.36Å; V35-L39 WeakPolarHBondContact O-CB 3.4Å; V35-L39 WeakPolarHBondContact O-CG 3.04Å; V35-L39 PolarHBondContact O-N 3.1Å; G36-L39 PolarHBondContact O-N 3.33Å; L39-G42 PolarHBondContact O-N 3.41Å; L39-Y43 WeakPolarHBondContact O-CB 3.22Å; L39-Y43 PolarHBondContact O-N 3.28Å; L39-G121 WeakPolarHBondContact CD2-O 3.24Å; L39-I124 HydrophobicContact CD2-CB 4.22Å; L39-I124 HydrophobicContact CD2-CG2 3.91Å; L39-A125 HydrophobicContact CB-CB 4.47Å; L39-A125 HydrophobicContact CD2-CB 3.93Å; L39-A125 WeakPolarHBondContact O-CB 3.48Å
40L93.5Very high89.8Confident114 Ų11462.8 Ų62.860%0.59733%0.326SS*.Hα-helixtrans-63.5-47.7178.3-179.761000111.8G36 S37 G38 G42 Y43 I44G36-L40 PolarHBondContact O-N 2.79Å; G36-L40 VanDerWaalsContact O-N 3.12Å; S37-L40 PolarHBondContact O-N 2.95Å; G38-L40 PolarHBondContact O-N 2.78Å; L40-G42 VanDerWaalsContact C-N 3.34Å; L40-G42 PolarHBondContact O-N 2.68Å; L40-Y43 PolarHBondContact O-N 3.11Å; L40-I44 HydrophobicContact CD1-CD1 4.14Å; L40-I44 HydrophobicContact CG-CD1 4.13Å; L40-I44 WeakPolarHBondContact O-CG1 3.4Å; L40-I44 PolarHBondContact O-N 3.43Å; L40-I44 VanDerWaalsContact O-N 3.15Å
41A94.4Very high90.5Very high35 Ų3560.9 Ų60.929%0.28933%0.325SS..Hα-helixtrans-62-42.1178.500000111.7S37 G38 I44 F45 F118 F122S37-A41 WeakPolarHBondContact O-CB 3.34Å; S37-A41 PolarHBondContact O-N 2.59Å; G38-A41 PolarHBondContact O-N 2.86Å; A41-I44 PolarHBondContact O-N 2.87Å; A41-F45 VanDerWaalsContact O-CB 3.25Å; A41-F45 WeakPolarHBondContact O-CB 3.34Å; A41-F45 PolarHBondContact O-N 2.77Å; A41-F118 HydrophobicContact CB-CE2 3.97Å; A41-F118 HydrophobicContact CB-CZ 3.87Å; A41-F122 HydrophobicContact CB-CD2 4.36Å
42G93.7Very high91.3Very high0 Ų061.8 Ų61.80%034%0.335CS..Hα-helixtrans-66.9-36.6178.900000112.7G38 L39 L40 F45 A46G38-G42 PolarHBondContact O-N 3.09Å; L39-G42 PolarHBondContact O-N 3.41Å; L40-G42 VanDerWaalsContact C-N 3.34Å; L40-G42 PolarHBondContact O-N 2.68Å; G42-F45 PolarHBondContact O-N 3.18Å; G42-A46 VanDerWaalsContact O-CB 3.26Å; G42-A46 WeakPolarHBondContact O-CB 3.45Å; G42-A46 PolarHBondContact O-N 3.41Å
43Y92.8Very high91.9Very high112 Ų11262.2 Ų62.244%0.43935%0.346SS..Hα-helixtrans-65-45.7175.1-177.9-100.8000112L39 L40 A46 K47 A129L39-Y43 WeakPolarHBondContact O-CB 3.22Å; L39-Y43 PolarHBondContact O-N 3.28Å; L40-Y43 PolarHBondContact O-N 3.11Å; Y43-A46 PolarHBondContact O-N 2.92Å; Y43-K47 HydrophobicContact CE1-CD 3.97Å; Y43-K47 PolarHBondContact O-N 3.16Å; Y43-K47 VanDerWaalsContact O-N 3.07Å; Y43-K47 WeakPolarHBondContact OH-CE 3.41Å; Y43-K47 PolarHBondContact OH-NZ 3.03Å; Y43-A129 HydrophobicContact CD2-CB 4.17Å
44I94.6Very high92.3Very high84 Ų8463.2 Ų63.243%0.43135%0.352SS..Hα-helixtrans-62.9-46.4175.8-64.7164.9000110.1L40 A41 A46 K47 I48L40-I44 HydrophobicContact CD1-CD1 4.14Å; L40-I44 HydrophobicContact CG-CD1 4.13Å; L40-I44 WeakPolarHBondContact O-CG1 3.4Å; L40-I44 PolarHBondContact O-N 3.43Å; L40-I44 VanDerWaalsContact O-N 3.15Å; A41-I44 PolarHBondContact O-N 2.87Å; I44-A46 VanDerWaalsContact C-N 3.33Å; I44-A46 PolarHBondContact O-N 3.35Å; I44-K47 PolarHBondContact O-N 2.9Å; I44-I48 HydrophobicContact CG2-CD1 3.71Å; I44-I48 HydrophobicContact CG2-CG1 4.47Å; I44-I48 WeakPolarHBondContact O-CG1 3.24Å; I44-I48 PolarHBondContact O-N 3.01Å
45F93.9Very high92.6Very high116 Ų11669.5 Ų69.551%0.50939%0.385SS..Hα-helixtrans-61.1-41.2177.5-177.7-92.8000111.8A41 G42 G49 F122 I126A41-F45 VanDerWaalsContact O-CB 3.25Å; A41-F45 WeakPolarHBondContact O-CB 3.34Å; A41-F45 PolarHBondContact O-N 2.77Å; G42-F45 PolarHBondContact O-N 3.18Å; F45-G49 WeakPolarHBondContact O-CA 3.47Å; F45-G49 PolarHBondContact O-N 3.39Å; F45-F122 HydrophobicContact CB-CE2 3.8Å; F45-F122 HydrophobicContact CB-CZ 4.18Å; F45-F122 HydrophobicContact CD1-CE2 4.27Å; F45-F122 AromaticContact CD1-CZ 3.79Å; F45-F122 HydrophobicContact CD1-CZ 3.79Å; F45-F122 HydrophobicContact CD2-CZ 4.35Å; F45-F122 HydrophobicContact CE1-CZ 4.26Å; F45-F122 AromaticContact CG-CE2 3.97Å; F45-F122 HydrophobicContact CG-CE2 3.97Å; F45-F122 AromaticContact CG-CZ 3.83Å; F45-F122 HydrophobicContact CG-CZ 3.83Å; F45-I126 HydrophobicContact CD1-CD1 3.61Å; F45-I126 HydrophobicContact CD1-CG1 4.17Å; F45-I126 HydrophobicContact CE1-CD1 4.04Å
46A92Very high92.9Very high4 Ų473.1 Ų73.13%0.03340%0.402CS..Hα-helixtrans-66.2-43.1178.200000111.7G42 Y43 I44 R50 I126 A129G42-A46 VanDerWaalsContact O-CB 3.26Å; G42-A46 WeakPolarHBondContact O-CB 3.45Å; G42-A46 PolarHBondContact O-N 3.41Å; Y43-A46 PolarHBondContact O-N 2.92Å; I44-A46 VanDerWaalsContact C-N 3.33Å; I44-A46 PolarHBondContact O-N 3.35Å; A46-R50 WeakPolarHBondContact O-CB 3.37Å; A46-R50 WeakPolarHBondContact O-CD 3.3Å; A46-R50 WeakPolarHBondContact O-CG 3.48Å; A46-R50 PolarHBondContact O-N 3.17Å; A46-I126 HydrophobicContact CB-CG1 4.4Å; A46-A129 HydrophobicContact CB-CB 3.18Å
47K89.8Confident93Very high127 Ų12772.7 Ų72.755%0.55240%0.398SS*.Hα-helixtrans-61.8-55.3176.6-80.7-168.7172.7179.40112.6Y43 I44 A51Y43-K47 HydrophobicContact CE1-CD 3.97Å; Y43-K47 PolarHBondContact O-N 3.16Å; Y43-K47 VanDerWaalsContact O-N 3.07Å; Y43-K47 WeakPolarHBondContact OH-CE 3.41Å; Y43-K47 PolarHBondContact OH-NZ 3.03Å; I44-K47 PolarHBondContact O-N 2.9Å; K47-A51 PolarHBondContact O-N 3.47Å
48I91.6Very high93.1Very high114 Ų11472.4 Ų72.459%0.58540%0.401SS*.Hα-helixtrans-74.8-42.9-174.7-58.8175.2000110.2I44 A51 A52I44-I48 HydrophobicContact CG2-CD1 3.71Å; I44-I48 HydrophobicContact CG2-CG1 4.47Å; I44-I48 WeakPolarHBondContact O-CG1 3.24Å; I44-I48 PolarHBondContact O-N 3.01Å; I48-A51 PolarHBondContact O-N 3.18Å; I48-A52 WeakPolarHBondContact O-CB 3.44Å; I48-A52 PolarHBondContact O-N 3.44Å
49G91Very high93.1Very high20 Ų2075.7 Ų75.721%0.20642%0.424CS..Hα-helixtrans-67.7-37.2-178.300000112.9F45 A52 A53F45-G49 WeakPolarHBondContact O-CA 3.47Å; F45-G49 PolarHBondContact O-N 3.39Å; G49-A52 PolarHBondContact O-N 3.36Å; G49-A53 WeakPolarHBondContact O-CB 3.46Å; G49-A53 PolarHBondContact O-N 3.12Å
50R89.3Confident93Very high117 Ų11777.1 Ų77.144%0.44243%0.432SS..Hα-helixtrans-64.2-44172-73.8173-178.8-172.63.4111.5A46 A53 L54 I126 A129A46-R50 WeakPolarHBondContact O-CB 3.37Å; A46-R50 WeakPolarHBondContact O-CD 3.3Å; A46-R50 WeakPolarHBondContact O-CG 3.48Å; A46-R50 PolarHBondContact O-N 3.17Å; R50-A53 PolarHBondContact O-N 3.18Å; R50-L54 WeakPolarHBondContact O-CB 3.09Å; R50-L54 VanDerWaalsContact O-CG 3.26Å; R50-L54 WeakPolarHBondContact O-CG 3.36Å; R50-L54 PolarHBondContact O-N 2.99Å; R50-I126 PolarHBondContact NH2-O 2.87Å; R50-I126 VanDerWaalsContact NH2-O 3.09Å; R50-A129 VanDerWaalsContact CZ-C 3.45Å; R50-A129 PolarHBondContact NH1-O 3Å; R50-A129 PolarHBondContact NH1-OXT 3.28Å; R50-A129 PolarHBondContact NH2-OXT 3.01Å
51A92.7Very high92.9Very high48 Ų4876.8 Ų76.840%0.39743%0.429SS..Hα-helixtrans-60.8-47.6175.300000111.5K47 I48 A53 L54 L55K47-A51 PolarHBondContact O-N 3.47Å; I48-A51 PolarHBondContact O-N 3.18Å; A51-A53 PolarHBondContact O-N 2.86Å; A51-L54 PolarHBondContact O-N 3.15Å; A51-L55 VanDerWaalsContact O-CG 3.31Å; A51-L55 WeakPolarHBondContact O-CG 3.38Å; A51-L55 PolarHBondContact O-N 2.89Å
52A95.1Very high92.5Very high42 Ų4277.9 Ų77.935%0.34744%0.438SS..Hα-helixtrans-62.2-42.3176.900000112.4I48 G49 L55 L56I48-A52 WeakPolarHBondContact O-CB 3.44Å; I48-A52 PolarHBondContact O-N 3.44Å; G49-A52 PolarHBondContact O-N 3.36Å; A52-L55 PolarHBondContact O-N 3.41Å; A52-L56 WeakPolarHBondContact O-CB 3.25Å; A52-L56 VanDerWaalsContact O-CG 3.3Å; A52-L56 WeakPolarHBondContact O-CG 3.26Å; A52-L56 PolarHBondContact O-N 3.49Å
53A93.1Very high92.2Very high62 Ų6281.2 Ų81.251%0.51246%0.456SS..Hα-helixtrans-65.4-40.8177.700000112G49 R50 A51 G57G49-A53 WeakPolarHBondContact O-CB 3.46Å; G49-A53 PolarHBondContact O-N 3.12Å; R50-A53 PolarHBondContact O-N 3.18Å; A51-A53 PolarHBondContact O-N 2.86Å; A53-G57 WeakPolarHBondContact O-CA 3.32Å; A53-G57 PolarHBondContact O-N 3.44Å
54L94.1Very high91.7Very high132 Ų13281 Ų8169%0.69146%0.459SS*.Hα-helixtrans-64.1-40174.1-74.3173.5000111.8R50 A51 G58R50-L54 WeakPolarHBondContact O-CB 3.09Å; R50-L54 VanDerWaalsContact O-CG 3.26Å; R50-L54 WeakPolarHBondContact O-CG 3.36Å; R50-L54 PolarHBondContact O-N 2.99Å; A51-L54 PolarHBondContact O-N 3.15Å; L54-G58 VanDerWaalsContact O-CA 3.26Å; L54-G58 WeakPolarHBondContact O-CA 3.46Å; L54-G58 PolarHBondContact O-N 2.86Å
55L95.3Very high91.1Very high132 Ų13279.9 Ų79.969%0.69146%0.458SS*.Hα-helixtrans-66.4-49.6176.4-71.9171.9000111.6A51 A52 S59A51-L55 VanDerWaalsContact O-CG 3.31Å; A51-L55 WeakPolarHBondContact O-CG 3.38Å; A51-L55 PolarHBondContact O-N 2.89Å; A52-L55 PolarHBondContact O-N 3.41Å; L55-S59 WeakPolarHBondContact O-CB 3.47Å; L55-S59 PolarHBondContact O-N 3.45Å; L55-S59 PolarHBondContact O-OG 3.47Å
56L94.5Very high90.6Very high126 Ų12675.2 Ų75.266%0.6644%0.441SS*.Hα-helixtrans-64.9-49179.7-67.7176.1000111.2A52 S59 L60A52-L56 WeakPolarHBondContact O-CB 3.25Å; A52-L56 VanDerWaalsContact O-CG 3.3Å; A52-L56 WeakPolarHBondContact O-CG 3.26Å; A52-L56 PolarHBondContact O-N 3.49Å; L56-S59 PolarHBondContact O-N 2.9Å; L56-S59 PolarHBondContact O-OG 3.49Å; L56-L60 PolarHBondContact O-N 3.12Å; L56-L60 VanDerWaalsContact O-N 3.12Å
57G93.4Very high89.9Confident32 Ų3278.1 Ų78.133%0.3346%0.458SS..Hα-helixtrans-65.8-45178.200000112.7A53 S59 L60 I61A53-G57 WeakPolarHBondContact O-CA 3.32Å; A53-G57 PolarHBondContact O-N 3.44Å; G57-S59 VanDerWaalsContact C-N 3.35Å; G57-S59 PolarHBondContact O-N 3.48Å; G57-L60 WeakPolarHBondContact O-CB 3.23Å; G57-L60 PolarHBondContact O-N 3.36Å; G57-L60 VanDerWaalsContact O-N 3.17Å; G57-I61 WeakPolarHBondContact O-CG1 3.36Å; G57-I61 PolarHBondContact O-N 3.42Å
58G94.6Very high89.4Confident34 Ų3479.8 Ų79.835%0.35147%0.467SS..Hα-helixtrans-62-41.117700000112.3L54 L60 I61 A62L54-G58 VanDerWaalsContact O-CA 3.26Å; L54-G58 WeakPolarHBondContact O-CA 3.46Å; L54-G58 PolarHBondContact O-N 2.86Å; G58-L60 VanDerWaalsContact C-N 3.3Å; G58-L60 PolarHBondContact O-N 2.97Å; G58-I61 PolarHBondContact O-N 2.8Å; G58-A62 WeakPolarHBondContact O-CB 3.27Å; G58-A62 PolarHBondContact O-N 3.28Å
59S92.5Very high88.3Confident70 Ų7081.2 Ų81.249%0.4947%0.472SS..Hα-helixtrans-62-38.8174.4740000112.1L55 L56 G57 L63L55-S59 WeakPolarHBondContact O-CB 3.47Å; L55-S59 PolarHBondContact O-N 3.45Å; L55-S59 PolarHBondContact O-OG 3.47Å; L56-S59 PolarHBondContact O-N 2.9Å; L56-S59 PolarHBondContact O-OG 3.49Å; G57-S59 VanDerWaalsContact C-N 3.35Å; G57-S59 PolarHBondContact O-N 3.48Å; S59-L63 VanDerWaalsContact O-CB 3.29Å; S59-L63 WeakPolarHBondContact O-CB 3.15Å; S59-L63 PolarHBondContact O-N 3.35Å
60L90.9Very high87.1Confident98 Ų9885.9 Ų85.951%0.51349%0.492SS..Hα-helixtrans-68.7-40.3178.7-174.763.1000111.9L56 G57 G58 L63 Q64L56-L60 PolarHBondContact O-N 3.12Å; L56-L60 VanDerWaalsContact O-N 3.12Å; G57-L60 WeakPolarHBondContact O-CB 3.23Å; G57-L60 PolarHBondContact O-N 3.36Å; G57-L60 VanDerWaalsContact O-N 3.17Å; G58-L60 VanDerWaalsContact C-N 3.3Å; G58-L60 PolarHBondContact O-N 2.97Å; L60-L63 PolarHBondContact O-N 2.81Å; L60-Q64 WeakPolarHBondContact O-CG 3.42Å; L60-Q64 PolarHBondContact O-N 3.45Å; L60-Q64 VanDerWaalsContact O-N 3.13Å
61I90.8Very high85.6Confident107 Ų10785.5 Ų85.555%0.54950%0.502SS..Hα-helixtrans-66-48176-65.6167.3000110.4G57 G58 L63 Q64 C65G57-I61 WeakPolarHBondContact O-CG1 3.36Å; G57-I61 PolarHBondContact O-N 3.42Å; G58-I61 PolarHBondContact O-N 2.8Å; I61-L63 VanDerWaalsContact C-N 3.25Å; I61-L63 PolarHBondContact O-N 3.46Å; I61-Q64 PolarHBondContact O-N 2.89Å; I61-Q64 VanDerWaalsContact O-N 3.1Å; I61-C65 PolarHBondContact O-N 2.71Å; I61-C65 PolarHBondContact O-SG 3.45Å
62A87.8Confident84.3Confident58 Ų5887 Ų8748%0.47950%0.503SS..Hα-helixtrans-58.2-39.7177.700000111.9G58 C65 A66G58-A62 WeakPolarHBondContact O-CB 3.27Å; G58-A62 PolarHBondContact O-N 3.28Å; A62-C65 PolarHBondContact O-N 3.12Å; A62-A66 WeakPolarHBondContact O-CB 3.38Å; A62-A66 PolarHBondContact O-N 2.93Å
63L85.9Confident83.1Confident70 Ų7092.5 Ų92.537%0.36652%0.521SS..Hα-helixtrans-62.2-42.9175.6-173.762.7000112.1S59 L60 I61 A66 V67 I74S59-L63 VanDerWaalsContact O-CB 3.29Å; S59-L63 WeakPolarHBondContact O-CB 3.15Å; S59-L63 PolarHBondContact O-N 3.35Å; L60-L63 PolarHBondContact O-N 2.81Å; I61-L63 VanDerWaalsContact C-N 3.25Å; I61-L63 PolarHBondContact O-N 3.46Å; L63-A66 PolarHBondContact O-N 2.77Å; L63-V67 WeakPolarHBondContact O-CG2 3.28Å; L63-V67 PolarHBondContact O-N 3.43Å; L63-V67 VanDerWaalsContact O-N 3.1Å; L63-I74 HydrophobicContact CD1-CD1 3.38Å; L63-I74 HydrophobicContact CD1-CG1 3.97Å; L63-I74 HydrophobicContact CD2-CD1 3.87Å; L63-I74 HydrophobicContact CG-CD1 3.49Å; L63-I74 VanDerWaalsContact CG-CD1 3.49Å
64Q82.8Confident82Confident108 Ų10891.5 Ų91.551%0.50551%0.507SS..Hα-helixtrans-64.7-42.5175.8-70.717841.100112.1L60 I61 A66 V67 Q68L60-Q64 WeakPolarHBondContact O-CG 3.42Å; L60-Q64 PolarHBondContact O-N 3.45Å; L60-Q64 VanDerWaalsContact O-N 3.13Å; I61-Q64 PolarHBondContact O-N 2.89Å; I61-Q64 VanDerWaalsContact O-N 3.1Å; Q64-A66 VanDerWaalsContact C-N 3.33Å; Q64-A66 PolarHBondContact O-N 2.6Å; Q64-V67 PolarHBondContact O-N 3.32Å; Q64-Q68 WeakPolarHBondContact O-CG 3.35Å; Q64-Q68 PolarHBondContact O-N 3.35Å
65C82.6Confident81.2Confident61 Ų6189.8 Ų89.841%0.41250%0.498SS..Hα-helixtrans-60.6-42.7175.1-67.20000111.8I61 A62 V67 Q68 Q69I61-C65 PolarHBondContact O-N 2.71Å; I61-C65 PolarHBondContact O-SG 3.45Å; A62-C65 PolarHBondContact O-N 3.12Å; C65-V67 VanDerWaalsContact C-N 3.33Å; C65-V67 PolarHBondContact O-N 2.92Å; C65-Q68 PolarHBondContact O-N 2.92Å; C65-Q69 WeakPolarHBondContact O-CG 3.32Å; C65-Q69 PolarHBondContact O-N 2.86Å
66A82.5Confident80.6Confident17 Ų1792 Ų9214%0.1450%0.497CS..Hα-helixtrans-66.9-32.9-18000000113.4A62 L63 Q64 V71 I72A62-A66 WeakPolarHBondContact O-CB 3.38Å; A62-A66 PolarHBondContact O-N 2.93Å; L63-A66 PolarHBondContact O-N 2.77Å; Q64-A66 VanDerWaalsContact C-N 3.33Å; Q64-A66 PolarHBondContact O-N 2.6Å; A66-V71 PolarHBondContact O-N 2.86Å; A66-I72 HydrophobicContact CB-CB 4.17Å; A66-I72 HydrophobicContact CB-CD1 3.59Å; A66-I72 HydrophobicContact CB-CG1 3.89Å; A66-I72 PolarHBondContact O-N 3.46Å
67V78.2Confident80.1Confident65 Ų6593.1 Ų93.139%0.39449%0.493SS..Hα-helixtrans-67.7-44.7172171.80000111.1L63 Q64 C65 Q69 D70 I74L63-V67 WeakPolarHBondContact O-CG2 3.28Å; L63-V67 PolarHBondContact O-N 3.43Å; L63-V67 VanDerWaalsContact O-N 3.1Å; Q64-V67 PolarHBondContact O-N 3.32Å; C65-V67 VanDerWaalsContact C-N 3.33Å; C65-V67 PolarHBondContact O-N 2.92Å; V67-Q69 VanDerWaalsContact C-N 3.3Å; V67-Q69 PolarHBondContact O-N 3.42Å; V67-D70 PolarHBondContact O-N 3.09Å; V67-D70 VanDerWaalsContact O-N 3.09Å; V67-I74 HydrophobicContact CG2-CD1 3.19Å; V67-I74 HydrophobicContact CG2-CG1 3.63Å
68Q78.3Confident79.7Confident162 Ų16299.4 Ų99.476%0.75751%0.511SS*.Hα-helixtrans-65.4-33.2179.9-73.5-175.211.600113.1Q64 C65 D70Q64-Q68 WeakPolarHBondContact O-CG 3.35Å; Q64-Q68 PolarHBondContact O-N 3.35Å; C65-Q68 PolarHBondContact O-N 2.92Å; Q68-D70 PolarHBondContact O-N 3.38Å
69Q68.5Low79.1Confident145 Ų145101.7 Ų101.768%0.67852%0.518SS*.THydrogen-bonded Turntrans-74.31.9175.8-70.3-176.7-25.400113.2C65 V67 V71C65-Q69 WeakPolarHBondContact O-CG 3.32Å; C65-Q69 PolarHBondContact O-N 2.86Å; V67-Q69 VanDerWaalsContact C-N 3.3Å; V67-Q69 PolarHBondContact O-N 3.42Å; Q69-V71 HydrophobicContact CB-CG2 3.89Å; Q69-V71 WeakPolarHBondContact O-CG2 3.49Å; Q69-V71 PolarHBondContact O-N 2.91Å
70D66.1Low78.8Confident117 Ų117104.2 Ų104.263%0.62652%0.522SS*.THydrogen-bonded Turntrans57.19-174.6-157.554.5000114.2V67 Q68 I72 H73V67-D70 PolarHBondContact O-N 3.09Å; V67-D70 VanDerWaalsContact O-N 3.09Å; Q68-D70 PolarHBondContact O-N 3.38Å; D70-I72 VanDerWaalsContact C-N 3.34Å; D70-H73 IonicContact OD1-CE1 3.97Å
71V59Low78.6Confident109 Ų109105.7 Ų105.766%0.66152%0.521SS*.SBendtrans-74.8-28.1-178.6-179.20000110.8A66 Q69A66-V71 PolarHBondContact O-N 2.86Å; Q69-V71 HydrophobicContact CB-CG2 3.89Å; Q69-V71 WeakPolarHBondContact O-CG2 3.49Å; Q69-V71 PolarHBondContact O-N 2.91Å
72I64.4Low78.4Confident81 Ų81103 Ų10342%0.41551%0.514SS..  trans-129109.9-175.8-54.4-173.3000111.9A66 D70 I74A66-I72 HydrophobicContact CB-CB 4.17Å; A66-I72 HydrophobicContact CB-CD1 3.59Å; A66-I72 HydrophobicContact CB-CG1 3.89Å; A66-I72 PolarHBondContact O-N 3.46Å; D70-I72 VanDerWaalsContact C-N 3.34Å; I72-I74 HydrophobicContact CG2-CG1 4.31Å; I72-I74 PolarHBondContact O-N 2.81Å
73H69Low78.1Confident157 Ų157102 Ų10273%0.72751%0.511SS*.  trans-78.499.7167.7-71.376.7000110.1D70 N75D70-H73 IonicContact OD1-CE1 3.97Å; H73-N75 PolarHBondContact O-N 3.44Å
74I70Confident77.9Confident40 Ų40102.6 Ų102.621%0.20551%0.514CS..  trans-72.5114.7175.7-59.8175.8000109.7L63 V67 I72 W76L63-I74 HydrophobicContact CD1-CD1 3.38Å; L63-I74 HydrophobicContact CD1-CG1 3.97Å; L63-I74 HydrophobicContact CD2-CD1 3.87Å; L63-I74 HydrophobicContact CG-CD1 3.49Å; L63-I74 VanDerWaalsContact CG-CD1 3.49Å; V67-I74 HydrophobicContact CG2-CD1 3.19Å; V67-I74 HydrophobicContact CG2-CG1 3.63Å; I72-I74 HydrophobicContact CG2-CG1 4.31Å; I72-I74 PolarHBondContact O-N 2.81Å; I74-W76 HydrophobicContact CD1-CZ2 4.26Å; I74-W76 HydrophobicContact CG2-CD2 3.96Å; I74-W76 HydrophobicContact CG2-CE3 4.37Å; I74-W76 HydrophobicContact CG2-CG 4.3Å; I74-W76 HydrophobicContact CG2-CZ2 4.22Å; I74-W76 PolarHBondContact O-N 3.31Å
75N79Confident77.8Confident97 Ų97106.4 Ų106.452%0.51952%0.524SS..  trans-78.685170.8-166.3-37000110.4H73 R77 K78H73-N75 PolarHBondContact O-N 3.44Å; N75-R77 PolarHBondContact O-N 2.92Å; N75-R77 VanDerWaalsContact O-N 3.11Å; N75-R77 VanDerWaalsContact OD1-CB 3.27Å; N75-R77 WeakPolarHBondContact OD1-CB 3.24Å; N75-R77 PolarHBondContact OD1-N 3.44Å; N75-K78 HydrophobicContact CB-CB 4.48Å; N75-K78 WeakPolarHBondContact O-CB 3.2Å; N75-K78 PolarHBondContact O-N 2.79Å; N75-K78 PolarHBondContact OD1-N 3.48Å
76W81.4Confident77.5Confident177 Ų177109.4 Ų109.467%0.6754%0.535SS*.Hα-helixtrans-53.3-30.2177.6-69.2106.9000113.6I74 K78 V79 E80I74-W76 HydrophobicContact CD1-CZ2 4.26Å; I74-W76 HydrophobicContact CG2-CD2 3.96Å; I74-W76 HydrophobicContact CG2-CE3 4.37Å; I74-W76 HydrophobicContact CG2-CG 4.3Å; I74-W76 HydrophobicContact CG2-CZ2 4.22Å; I74-W76 PolarHBondContact O-N 3.31Å; W76-K78 PolarHBondContact O-N 3.43Å; W76-V79 HydrophobicContact CE3-CB 4.49Å; W76-V79 HydrophobicContact CE3-CG2 4.49Å; W76-V79 WeakPolarHBondContact O-CB 3.5Å; W76-V79 PolarHBondContact O-N 3.39Å; W76-V79 VanDerWaalsContact O-N 3.1Å; W76-E80 PolarHBondContact O-N 2.84Å
77R84Confident77.1Confident151 Ų151115.8 Ų115.857%0.5756%0.561SS**Hα-helixtrans-63.8-29176.9-162.4-177.867.6143-1112.7N75 R81N75-R77 PolarHBondContact O-N 2.92Å; N75-R77 VanDerWaalsContact O-N 3.11Å; N75-R77 VanDerWaalsContact OD1-CB 3.27Å; N75-R77 WeakPolarHBondContact OD1-CB 3.24Å; N75-R77 PolarHBondContact OD1-N 3.44Å; R77-R81 WeakPolarHBondContact O-CB 3.21Å; R77-R81 WeakPolarHBondContact O-CD 3.49Å; R77-R81 VanDerWaalsContact O-CG 3.24Å; R77-R81 WeakPolarHBondContact O-CG 3.31Å; R77-R81 PolarHBondContact O-N 3.41Å
78K84.6Confident76.6Confident164 Ų164116.6 Ų116.671%0.71357%0.57SS**Hα-helixtrans-74.7-37.4174.7-167175.1-178.9-1790111.2N75 W76 A82N75-K78 HydrophobicContact CB-CB 4.48Å; N75-K78 WeakPolarHBondContact O-CB 3.2Å; N75-K78 PolarHBondContact O-N 2.79Å; N75-K78 PolarHBondContact OD1-N 3.48Å; W76-K78 PolarHBondContact O-N 3.43Å; K78-A82 WeakPolarHBondContact O-CB 3.39Å; K78-A82 PolarHBondContact O-N 3.46Å; K78-A82 VanDerWaalsContact O-N 3.11Å
79V83.4Confident75.9Confident81 Ų81114.8 Ų114.849%0.49157%0.566SS.*Hα-helixtrans-63.7-48.4176.1-179.20000110.4W76 R81 A82 G83W76-V79 HydrophobicContact CE3-CB 4.49Å; W76-V79 HydrophobicContact CE3-CG2 4.49Å; W76-V79 WeakPolarHBondContact O-CB 3.5Å; W76-V79 PolarHBondContact O-N 3.39Å; W76-V79 VanDerWaalsContact O-N 3.1Å; V79-R81 PolarHBondContact O-N 2.99Å; V79-A82 WeakPolarHBondContact O-CB 3.25Å; V79-A82 PolarHBondContact O-N 3Å; V79-A82 VanDerWaalsContact O-N 3.12Å; V79-G83 PolarHBondContact O-N 3.38Å
80E85.8Confident75.7Confident123 Ų123109.8 Ų109.858%0.57555%0.545SS*.Hα-helixtrans-58.6-50.3178.3-170.762.3-159.100111.7W76 A82 G83 D84W76-E80 PolarHBondContact O-N 2.84Å; E80-A82 PolarHBondContact O-N 2.74Å; E80-G83 WeakPolarHBondContact O-CA 3.17Å; E80-G83 PolarHBondContact O-N 2.96Å; E80-D84 PolarHBondContact O-N 3.28Å
81R87.3Confident75.6Confident129 Ų129108 Ų10849%0.48754%0.539SS..Hα-helixtrans-60.1-30.4177.7-74.6173.7176.8-179-5113.2R77 V79 R85R77-R81 WeakPolarHBondContact O-CB 3.21Å; R77-R81 WeakPolarHBondContact O-CD 3.49Å; R77-R81 VanDerWaalsContact O-CG 3.24Å; R77-R81 WeakPolarHBondContact O-CG 3.31Å; R77-R81 PolarHBondContact O-N 3.41Å; V79-R81 PolarHBondContact O-N 2.99Å; R81-R85 WeakPolarHBondContact O-CG 3.2Å; R81-R85 PolarHBondContact O-N 3.36Å
82A84.9Confident76Confident50 Ų50107.8 Ų107.841%0.41354%0.538SS..Hα-helixtrans-71.2-43.5174.700000110.8K78 V79 E80 R85 I86K78-A82 WeakPolarHBondContact O-CB 3.39Å; K78-A82 PolarHBondContact O-N 3.46Å; K78-A82 VanDerWaalsContact O-N 3.11Å; V79-A82 WeakPolarHBondContact O-CB 3.25Å; V79-A82 PolarHBondContact O-N 3Å; V79-A82 VanDerWaalsContact O-N 3.12Å; E80-A82 PolarHBondContact O-N 2.74Å; A82-R85 PolarHBondContact O-N 3.18Å; A82-I86 WeakPolarHBondContact O-CD1 3.46Å; A82-I86 VanDerWaalsContact O-CG1 3.3Å; A82-I86 WeakPolarHBondContact O-CG1 3.37Å; A82-I86 PolarHBondContact O-N 2.81Å
83G82.3Confident76.3Confident39 Ų39108 Ų10840%0.40254%0.54SS..Hα-helixtrans-58.4-48.2173.100000112.6V79 E80 R85 I86 Q87V79-G83 PolarHBondContact O-N 3.38Å; E80-G83 WeakPolarHBondContact O-CA 3.17Å; E80-G83 PolarHBondContact O-N 2.96Å; G83-R85 VanDerWaalsContact C-N 3.34Å; G83-R85 PolarHBondContact O-N 3.37Å; G83-I86 WeakPolarHBondContact O-CB 3.34Å; G83-I86 PolarHBondContact O-N 3.33Å; G83-I86 VanDerWaalsContact O-N 3.09Å; G83-Q87 PolarHBondContact O-N 3.08Å
84D82.2Confident76.6Confident82 Ų82107 Ų10744%0.43953%0.533SS..Hα-helixtrans-60.5-40.7178.4-82.7-12.6000112.8E80 I86 Q87 S88E80-D84 PolarHBondContact O-N 3.28Å; D84-I86 VanDerWaalsContact C-N 3.28Å; D84-I86 PolarHBondContact O-N 3.19Å; D84-Q87 PolarHBondContact O-N 3.46Å; D84-S88 VanDerWaalsContact O-CB 3.27Å; D84-S88 WeakPolarHBondContact O-CB 3.5Å; D84-S88 PolarHBondContact O-N 2.67Å; D84-S88 PolarHBondContact O-OG 3.48Å
85R79.6Confident76.9Confident188 Ų188112 Ų11271%0.70956%0.556SS**Hα-helixtrans-64.8-34.5176.3-79.2-179.4-173.7-1271.1112.2R81 A82 G83 S88 N89R81-R85 WeakPolarHBondContact O-CG 3.2Å; R81-R85 PolarHBondContact O-N 3.36Å; A82-R85 PolarHBondContact O-N 3.18Å; G83-R85 VanDerWaalsContact C-N 3.34Å; G83-R85 PolarHBondContact O-N 3.37Å; R85-S88 PolarHBondContact O-OG 2.7Å; R85-N89 PolarHBondContact O-ND2 2.9Å
86I77.3Confident77Confident124 Ų124109.2 Ų109.264%0.63655%0.55SS*.Hα-helixtrans-72.2-40.6176.5-64.6163.7000110.1A82 G83 D84 T90A82-I86 WeakPolarHBondContact O-CD1 3.46Å; A82-I86 VanDerWaalsContact O-CG1 3.3Å; A82-I86 WeakPolarHBondContact O-CG1 3.37Å; A82-I86 PolarHBondContact O-N 2.81Å; G83-I86 WeakPolarHBondContact O-CB 3.34Å; G83-I86 PolarHBondContact O-N 3.33Å; G83-I86 VanDerWaalsContact O-N 3.09Å; D84-I86 VanDerWaalsContact C-N 3.28Å; D84-I86 PolarHBondContact O-N 3.19Å; I86-T90 WeakPolarHBondContact O-CB 3.27Å; I86-T90 PolarHBondContact O-OG1 2.66Å
87Q73.1Confident77.1Confident151 Ų151107.1 Ų107.171%0.70655%0.545SS*.Hα-helixtrans-74.2-42.7-179-171.8175.778.600113.1G83 D84 N89 T90G83-Q87 PolarHBondContact O-N 3.08Å; D84-Q87 PolarHBondContact O-N 3.46Å; Q87-N89 VanDerWaalsContact C-N 3.35Å; Q87-N89 PolarHBondContact O-N 3.2Å; Q87-T90 WeakPolarHBondContact O-CB 3.38Å; Q87-T90 PolarHBondContact O-N 3.49Å
88S68.6Low77.2Confident82 Ų82108.2 Ų108.257%0.57355%0.549SS*.Hα-helixtrans-65.3-31.5-175.252.30000114.2D84 R85 T90D84-S88 VanDerWaalsContact O-CB 3.27Å; D84-S88 WeakPolarHBondContact O-CB 3.5Å; D84-S88 PolarHBondContact O-N 2.67Å; D84-S88 PolarHBondContact O-OG 3.48Å; R85-S88 PolarHBondContact O-OG 2.7Å; S88-T90 PolarHBondContact O-N 2.81Å
89N64Low77.5Confident124 Ų124103.4 Ų103.466%0.66354%0.541SS*.THydrogen-bonded Turntrans-83.67.6178.3-71.1-66.7000114R85 Q87R85-N89 PolarHBondContact O-ND2 2.9Å; Q87-N89 VanDerWaalsContact C-N 3.35Å; Q87-N89 PolarHBondContact O-N 3.2Å
90T63.9Low77.7Confident39 Ų39104.3 Ų104.324%0.23954%0.542CS..  trans-118.325.9-164.2-60.50000113.6I86 Q87 S88 V92 I93 F94I86-T90 WeakPolarHBondContact O-CB 3.27Å; I86-T90 PolarHBondContact O-OG1 2.66Å; Q87-T90 WeakPolarHBondContact O-CB 3.38Å; Q87-T90 PolarHBondContact O-N 3.49Å; S88-T90 PolarHBondContact O-N 2.81Å; T90-V92 PolarHBondContact O-N 3.35Å; T90-I93 HydrophobicContact CG2-CB 3.27Å; T90-I93 HydrophobicContact CG2-CD1 4.13Å; T90-I93 HydrophobicContact CG2-CG1 3.89Å; T90-I93 HydrophobicContact CG2-CG2 3.46Å; T90-I93 VanDerWaalsContact CG2-CG2 3.46Å; T90-I93 PolarHBondContact O-N 3.2Å; T90-I93 VanDerWaalsContact O-N 3.15Å; T90-F94 PolarHBondContact O-N 2.91Å
91P63.6Low78Confident79 Ų79104.7 Ų104.751%0.51354%0.542SS..Hα-helixtrans-63.5-41.2175.625.8-31.1000111.6I93 F94 E95P91-I93 PolarHBondContact O-N 3.43Å; P91-F94 PolarHBondContact O-N 3.37Å; P91-E95 PolarHBondContact O-N 3.32Å
92V68Low78.3Confident106 Ų106103.7 Ų103.764%0.64255%0.546SS*.Hα-helixtrans-59.5-33.2173.7-66.40000112.6T90 G96T90-V92 PolarHBondContact O-N 3.35Å; V92-G96 PolarHBondContact O-N 3.12Å
93I71.3Confident78.7Confident86 Ų86108.3 Ų108.344%0.44156%0.557SS.*Hα-helixtrans-78.9-30.8176.5-60.4-151.8000110.5T90 P91 K97T90-I93 HydrophobicContact CG2-CB 3.27Å; T90-I93 HydrophobicContact CG2-CD1 4.13Å; T90-I93 HydrophobicContact CG2-CG1 3.89Å; T90-I93 HydrophobicContact CG2-CG2 3.46Å; T90-I93 VanDerWaalsContact CG2-CG2 3.46Å; T90-I93 PolarHBondContact O-N 3.2Å; T90-I93 VanDerWaalsContact O-N 3.15Å; P91-I93 PolarHBondContact O-N 3.43Å; I93-K97 HydrophobicContact CG2-CD 4.23Å; I93-K97 HydrophobicContact CG2-CG 4.21Å; I93-K97 WeakPolarHBondContact O-CA 3.22Å; I93-K97 WeakPolarHBondContact O-CB 3.25Å; I93-K97 WeakPolarHBondContact O-CG 3.39Å; I93-K97 PolarHBondContact O-N 2.78Å
94F73.7Confident79.2Confident136 Ų136110.5 Ų110.560%0.59656%0.559SS**Hα-helixtrans-69.1-45.2176.4-153.4-91.4000111.5T90 P91 K97 R98T90-F94 PolarHBondContact O-N 2.91Å; P91-F94 PolarHBondContact O-N 3.37Å; F94-K97 WeakPolarHBondContact O-CB 3.38Å; F94-K97 PolarHBondContact O-N 3.34Å; F94-R98 PolarHBondContact O-N 3.34Å
95E77.8Confident79.8Confident145 Ų145109.9 Ų109.968%0.67856%0.555SS**Hα-helixtrans-63.9-46.7171.9-71.5-169.6104.300111.5P91 K97 R98 A99P91-E95 PolarHBondContact O-N 3.32Å; E95-K97 VanDerWaalsContact C-N 3.27Å; E95-K97 PolarHBondContact O-N 3.04Å; E95-R98 WeakPolarHBondContact O-CB 3.25Å; E95-R98 PolarHBondContact O-N 2.74Å; E95-R98 VanDerWaalsContact O-N 3.08Å; E95-A99 PolarHBondContact O-N 2.93Å
96G80.6Confident80.6Confident38 Ų38106.9 Ų106.939%0.39255%0.547SS..Hα-helixtrans-57.8-37.9174.200000112.8V92 A99 L100V92-G96 PolarHBondContact O-N 3.12Å; G96-A99 PolarHBondContact O-N 2.85Å; G96-L100 WeakPolarHBondContact O-CB 3.22Å; G96-L100 PolarHBondContact O-N 2.85Å
97K84Confident81.3Confident132 Ų132103.3 Ų103.357%0.57453%0.531SS*.Hα-helixtrans-65.4-40.6174.3-86.1-177.7-177.2-160.90112I93 F94 E95 K101I93-K97 HydrophobicContact CG2-CD 4.23Å; I93-K97 HydrophobicContact CG2-CG 4.21Å; I93-K97 WeakPolarHBondContact O-CA 3.22Å; I93-K97 WeakPolarHBondContact O-CB 3.25Å; I93-K97 WeakPolarHBondContact O-CG 3.39Å; I93-K97 PolarHBondContact O-N 2.78Å; F94-K97 WeakPolarHBondContact O-CB 3.38Å; F94-K97 PolarHBondContact O-N 3.34Å; E95-K97 VanDerWaalsContact C-N 3.27Å; E95-K97 PolarHBondContact O-N 3.04Å; K97-K101 WeakPolarHBondContact O-CB 3.4Å; K97-K101 PolarHBondContact O-N 2.94Å
98R86.2Confident82.2Confident174 Ų17499.5 Ų99.566%0.65751%0.514SS*.Hα-helixtrans-62.9-48.1174.8-84.7-178.4151171.4-5.1111.1F94 E95 L100 K101 N102F94-R98 PolarHBondContact O-N 3.34Å; E95-R98 WeakPolarHBondContact O-CB 3.25Å; E95-R98 PolarHBondContact O-N 2.74Å; E95-R98 VanDerWaalsContact O-N 3.08Å; R98-L100 PolarHBondContact O-N 2.89Å; R98-K101 PolarHBondContact O-N 3.4Å; R98-N102 PolarHBondContact O-N 3.05Å; R98-N102 PolarHBondContact O-OD1 3.04Å
99A88.9Confident83.3Confident64 Ų64101.3 Ų101.353%0.52951%0.514SS..Hα-helixtrans-60.6-45.6176.700000111.8E95 G96 N102 K103E95-A99 PolarHBondContact O-N 2.93Å; G96-A99 PolarHBondContact O-N 2.85Å; A99-N102 PolarHBondContact O-N 3.01Å; A99-K103 WeakPolarHBondContact O-CB 3.46Å; A99-K103 PolarHBondContact O-N 3.01Å
100L89.1Confident84.5Confident99 Ų99101.2 Ų101.252%0.51851%0.509SS..Hα-helixtrans-63.1-44.5176.7-177.965.1000111.7G96 R98 N102 K103 I104G96-L100 WeakPolarHBondContact O-CB 3.22Å; G96-L100 PolarHBondContact O-N 2.85Å; R98-L100 PolarHBondContact O-N 2.89Å; L100-N102 PolarHBondContact O-N 2.74Å; L100-K103 PolarHBondContact O-N 3.26Å; L100-I104 HydrophobicContact CD1-CD1 4.18Å; L100-I104 HydrophobicContact CD1-CG1 4.37Å; L100-I104 HydrophobicContact CD2-CD1 4.45Å; L100-I104 HydrophobicContact CG-CD1 3.85Å; L100-I104 HydrophobicContact CG-CG1 4.43Å; L100-I104 VanDerWaalsContact O-CG1 3.29Å; L100-I104 WeakPolarHBondContact O-CG1 3Å; L100-I104 PolarHBondContact O-N 3.15Å
101K91.2Very high85.6Confident131 Ų131101.9 Ų101.957%0.5751%0.512SS*.Hα-helixtrans-58.5-49.4176.9-179.7-177.6177.1-175.70110.5K97 R98 K103 I104 I105K97-K101 WeakPolarHBondContact O-CB 3.4Å; K97-K101 PolarHBondContact O-N 2.94Å; R98-K101 PolarHBondContact O-N 3.4Å; K101-K103 VanDerWaalsContact C-N 3.3Å; K101-K103 PolarHBondContact O-N 3.47Å; K101-I104 PolarHBondContact O-N 2.77Å; K101-I105 HydrophobicContact CD-CD1 4.46Å; K101-I105 HydrophobicContact CG-CD1 3.83Å; K101-I105 HydrophobicContact CG-CG1 4.49Å; K101-I105 VanDerWaalsContact O-CG1 3.3Å; K101-I105 WeakPolarHBondContact O-CG1 3.39Å; K101-I105 PolarHBondContact O-N 3.44Å
102N93.8Very high86.7Confident108 Ų108106.6 Ų106.658%0.57852%0.519SS*.Hα-helixtrans-62.1-39.7178.4-70.3-0.5000111.3R98 A99 L100 I105 K106R98-N102 PolarHBondContact O-N 3.05Å; R98-N102 PolarHBondContact O-OD1 3.04Å; A99-N102 PolarHBondContact O-N 3.01Å; L100-N102 PolarHBondContact O-N 2.74Å; N102-I105 PolarHBondContact O-N 3.04Å; N102-K106 VanDerWaalsContact O-CB 3.26Å; N102-K106 WeakPolarHBondContact O-CB 3.24Å; N102-K106 PolarHBondContact O-N 3.08Å
103K93.8Very high87.5Confident147 Ų147105 Ų10564%0.63951%0.509SS*.Hα-helixtrans-63.4-45.7175.5-167.9173.5-176.2179.90112A99 L100 K101 K106 T107A99-K103 WeakPolarHBondContact O-CB 3.46Å; A99-K103 PolarHBondContact O-N 3.01Å; L100-K103 PolarHBondContact O-N 3.26Å; K101-K103 VanDerWaalsContact C-N 3.3Å; K101-K103 PolarHBondContact O-N 3.47Å; K103-K106 PolarHBondContact O-N 3.35Å; K103-T107 WeakPolarHBondContact O-CB 3.14Å; K103-T107 PolarHBondContact O-N 2.82Å; K103-T107 PolarHBondContact O-OG1 2.88Å
104I93.2Very high88.3Confident86 Ų86103.3 Ų103.344%0.44150%0.499SS..Hα-helixtrans-61.4-48.7177-70.7167.3000110.6L100 K101 K106 T107 I108L100-I104 HydrophobicContact CD1-CD1 4.18Å; L100-I104 HydrophobicContact CD1-CG1 4.37Å; L100-I104 HydrophobicContact CD2-CD1 4.45Å; L100-I104 HydrophobicContact CG-CD1 3.85Å; L100-I104 HydrophobicContact CG-CG1 4.43Å; L100-I104 VanDerWaalsContact O-CG1 3.29Å; L100-I104 WeakPolarHBondContact O-CG1 3Å; L100-I104 PolarHBondContact O-N 3.15Å; K101-I104 PolarHBondContact O-N 2.77Å; I104-K106 VanDerWaalsContact C-N 3.33Å; I104-K106 PolarHBondContact O-N 3.31Å; I104-T107 PolarHBondContact O-N 3.23Å; I104-I108 HydrophobicContact CG2-CD1 3.76Å; I104-I108 HydrophobicContact CG2-CG1 4.38Å; I104-I108 WeakPolarHBondContact O-CG1 3.47Å; I104-I108 PolarHBondContact O-N 2.82Å
105I94.9Very high89.1Confident69 Ų69100.1 Ų100.135%0.35449%0.485SS..Hα-helixtrans-58.3-48.8178.5-69.2168.9000109.8K101 N102 T107 I108 E109K101-I105 HydrophobicContact CD-CD1 4.46Å; K101-I105 HydrophobicContact CG-CD1 3.83Å; K101-I105 HydrophobicContact CG-CG1 4.49Å; K101-I105 VanDerWaalsContact O-CG1 3.3Å; K101-I105 WeakPolarHBondContact O-CG1 3.39Å; K101-I105 PolarHBondContact O-N 3.44Å; N102-I105 PolarHBondContact O-N 3.04Å; I105-T107 VanDerWaalsContact C-N 3.33Å; I105-T107 PolarHBondContact O-N 3.49Å; I105-I108 PolarHBondContact O-N 3.32Å; I105-E109 HydrophobicContact CG2-CG 4.41Å; I105-E109 WeakPolarHBondContact O-CG 3.17Å; I105-E109 PolarHBondContact O-N 2.89Å
106K95.4Very high89.7Confident125 Ų12595.7 Ų95.754%0.54348%0.479SS..Hα-helixtrans-58.2-44.1177.6-176.7172.9175.4175.30112N102 K103 I104 I108 E109 E110N102-K106 VanDerWaalsContact O-CB 3.26Å; N102-K106 WeakPolarHBondContact O-CB 3.24Å; N102-K106 PolarHBondContact O-N 3.08Å; K103-K106 PolarHBondContact O-N 3.35Å; I104-K106 VanDerWaalsContact C-N 3.33Å; I104-K106 PolarHBondContact O-N 3.31Å; K106-I108 PolarHBondContact O-N 2.94Å; K106-E109 PolarHBondContact O-N 2.75Å; K106-E110 WeakPolarHBondContact CE-OE1 3.5Å; K106-E110 HydrophobicContact CG-CG 4.43Å; K106-E110 WeakPolarHBondContact O-CB 3.12Å; K106-E110 VanDerWaalsContact O-CG 3.26Å; K106-E110 WeakPolarHBondContact O-CG 3.46Å; K106-E110 PolarHBondContact O-N 2.92Å
107T91.7Very high90.2Very high49 Ų4994.7 Ų94.730%0.30147%0.466SS..Hα-helixtrans-66.9-35.8178-60.10000112.9K103 I104 I105 N111 F115K103-T107 WeakPolarHBondContact O-CB 3.14Å; K103-T107 PolarHBondContact O-N 2.82Å; K103-T107 PolarHBondContact O-OG1 2.88Å; I104-T107 PolarHBondContact O-N 3.23Å; I105-T107 VanDerWaalsContact C-N 3.33Å; I105-T107 PolarHBondContact O-N 3.49Å; T107-N111 WeakPolarHBondContact O-CB 3.29Å; T107-N111 PolarHBondContact O-N 3.44Å; T107-N111 PolarHBondContact O-ND2 3.16Å; T107-F115 HydrophobicContact CG2-CE2 3.84Å; T107-F115 HydrophobicContact CG2-CZ 4.05Å; T107-F115 WeakPolarHBondContact O-CE2 3.47Å
108I91.7Very high90.6Very high70 Ų7091.2 Ų91.236%0.35945%0.45SS..Hα-helixtrans-65.7-43.1172.5-70169.4000110.4I104 I105 K106 N111 R112 F115I104-I108 HydrophobicContact CG2-CD1 3.76Å; I104-I108 HydrophobicContact CG2-CG1 4.38Å; I104-I108 WeakPolarHBondContact O-CG1 3.47Å; I104-I108 PolarHBondContact O-N 2.82Å; I105-I108 PolarHBondContact O-N 3.32Å; K106-I108 PolarHBondContact O-N 2.94Å; I108-N111 CarbonylContact O-C 3.34Å; I108-N111 PolarHBondContact O-N 3.01Å; I108-R112 WeakPolarHBondContact O-CA 3.13Å; I108-R112 PolarHBondContact O-N 3.14Å; I108-F115 HydrophobicContact CB-CD2 4.36Å; I108-F115 HydrophobicContact CB-CG 4.43Å; I108-F115 HydrophobicContact CG1-CB 4.48Å; I108-F115 HydrophobicContact CG1-CD1 4Å; I108-F115 HydrophobicContact CG1-CD2 4.1Å; I108-F115 HydrophobicContact CG1-CE1 4.23Å; I108-F115 HydrophobicContact CG1-CE2 4.35Å; I108-F115 HydrophobicContact CG1-CG 3.92Å; I108-F115 HydrophobicContact CG1-CZ 4.4Å; I108-F115 HydrophobicContact CG2-CB 4.3Å
109E91.5Very high90.9Very high121 Ų12184.1 Ų84.157%0.56543%0.431SS*.Hα-helixtrans-65.1-44178.2-73.4178.5156.600111.8I105 K106 N111I105-E109 HydrophobicContact CG2-CG 4.41Å; I105-E109 WeakPolarHBondContact O-CG 3.17Å; I105-E109 PolarHBondContact O-N 2.89Å; K106-E109 PolarHBondContact O-N 2.75Å; E109-N111 VanDerWaalsContact C-N 3.31Å; E109-N111 PolarHBondContact O-N 3.11Å
110E90Very high91.1Very high121 Ų12182.5 Ų82.557%0.56542%0.421SS*.Hα-helixtrans-63.8-34.2176.7-75.2170.8173.800112.6K106K106-E110 WeakPolarHBondContact CE-OE1 3.5Å; K106-E110 HydrophobicContact CG-CG 4.43Å; K106-E110 WeakPolarHBondContact O-CB 3.12Å; K106-E110 VanDerWaalsContact O-CG 3.26Å; K106-E110 WeakPolarHBondContact O-CG 3.46Å; K106-E110 PolarHBondContact O-N 2.92Å
111N87Confident91.3Very high54 Ų5477.9 Ų77.929%0.28940%0.397SS..THydrogen-bonded Turntrans-120.240.7-176.4-59.6-80.4000112T107 I108 E109 V113 F114 F115T107-N111 WeakPolarHBondContact O-CB 3.29Å; T107-N111 PolarHBondContact O-N 3.44Å; T107-N111 PolarHBondContact O-ND2 3.16Å; I108-N111 CarbonylContact O-C 3.34Å; I108-N111 PolarHBondContact O-N 3.01Å; E109-N111 VanDerWaalsContact C-N 3.31Å; E109-N111 PolarHBondContact O-N 3.11Å; N111-V113 PolarHBondContact O-N 2.86Å; N111-V113 VanDerWaalsContact O-N 3.11Å; N111-F114 HydrophobicContact CB-CB 4.19Å; N111-F114 PolarHBondContact O-N 3.31Å; N111-F115 HydrophobicContact CB-CD2 3.84Å; N111-F115 HydrophobicContact CB-CE2 3.97Å; N111-F115 WeakPolarHBondContact O-CD2 3.49Å; N111-F115 PolarHBondContact O-N 3.13Å
112R86.6Confident91.5Very high178 Ų17874 Ų7467%0.67238%0.38SS*.Hα-helixtrans-52.3-39.4-173.3-174-176.8-71.9-127.1-0.3113I108 G116I108-R112 WeakPolarHBondContact O-CA 3.13Å; I108-R112 PolarHBondContact O-N 3.14Å; R112-G116 PolarHBondContact O-N 3.28Å
113V85.4Confident91.5Very high72 Ų7274.4 Ų74.444%0.43638%0.382SS..Hα-helixtrans-66-45.4179.3177.10000111.6V31 N111 S117V31-V113 HydrophobicContact CG2-CG1 3.28Å; N111-V113 PolarHBondContact O-N 2.86Å; N111-V113 VanDerWaalsContact O-N 3.11Å; V113-S117 WeakPolarHBondContact O-CB 3.33Å; V113-S117 PolarHBondContact O-N 3.2Å; V113-S117 VanDerWaalsContact O-N 3.12Å; V113-S117 PolarHBondContact O-OG 3.41Å
114F87.8Confident91.5Very high51 Ų5171.7 Ų71.722%0.22437%0.374CS..Hα-helixtrans-64.2-50.6175.6171.7-93.4000111.1I33 G34 N111 G116 S117 F118I33-F114 HydrophobicContact CG2-CE2 4.19Å; G34-F114 VanDerWaalsContact CA-CE2 3.42Å; N111-F114 HydrophobicContact CB-CB 4.19Å; N111-F114 PolarHBondContact O-N 3.31Å; F114-G116 PolarHBondContact O-N 3.05Å; F114-S117 PolarHBondContact O-N 3.38Å; F114-S117 PolarHBondContact O-OG 2.94Å; F114-F118 HydrophobicContact CE1-CB 4.39Å; F114-F118 HydrophobicContact CZ-CD2 4.4Å; F114-F118 WeakPolarHBondContact O-CB 3.31Å; F114-F118 PolarHBondContact O-N 3Å
115F90.4Very high91.4Very high68 Ų6867.9 Ų67.930%0.29836%0.355SS..Hα-helixtrans-68.2-34.6-177.7-80.7-79000113T107 I108 N111 G119T107-F115 HydrophobicContact CG2-CE2 3.84Å; T107-F115 HydrophobicContact CG2-CZ 4.05Å; T107-F115 WeakPolarHBondContact O-CE2 3.47Å; I108-F115 HydrophobicContact CB-CD2 4.36Å; I108-F115 HydrophobicContact CB-CG 4.43Å; I108-F115 HydrophobicContact CG1-CB 4.48Å; I108-F115 HydrophobicContact CG1-CD1 4Å; I108-F115 HydrophobicContact CG1-CD2 4.1Å; I108-F115 HydrophobicContact CG1-CE1 4.23Å; I108-F115 HydrophobicContact CG1-CE2 4.35Å; I108-F115 HydrophobicContact CG1-CG 3.92Å; I108-F115 HydrophobicContact CG1-CZ 4.4Å; I108-F115 HydrophobicContact CG2-CB 4.3Å; N111-F115 HydrophobicContact CB-CD2 3.84Å; N111-F115 HydrophobicContact CB-CE2 3.97Å; N111-F115 WeakPolarHBondContact O-CD2 3.49Å; N111-F115 PolarHBondContact O-N 3.13Å; F115-G119 PolarHBondContact O-N 3.34Å
116G91.3Very high91.1Very high53 Ų5366.8 Ų66.855%0.54635%0.35SS..Hα-helixtrans-63.5-44.3174.100000112.1R112 F114 G120R112-G116 PolarHBondContact O-N 3.28Å; F114-G116 PolarHBondContact O-N 3.05Å; G116-G120 PolarHBondContact O-N 2.96Å
117S89.4Confident90.9Very high17 Ų1765.3 Ų65.312%0.11936%0.355CS..Hα-helixtrans-73-36.8177.656.30000113.3V31 V113 F114 G120 G121V31-S117 PolarHBondContact O-OG 3.21Å; V113-S117 WeakPolarHBondContact O-CB 3.33Å; V113-S117 PolarHBondContact O-N 3.2Å; V113-S117 VanDerWaalsContact O-N 3.12Å; V113-S117 PolarHBondContact O-OG 3.41Å; F114-S117 PolarHBondContact O-N 3.38Å; F114-S117 PolarHBondContact O-OG 2.94Å; S117-G120 PolarHBondContact O-N 2.83Å; S117-G121 PolarHBondContact O-N 3.49Å
118F92.5Very high90.4Very high58 Ų5871.3 Ų71.325%0.25438%0.377SS..Hα-helixtrans-58.3-50169.3176.1-88.6000111.5G34 S37 G38 A41 F114 G120 G121 F122G34-F118 VanDerWaalsContact O-CA 3.25Å; G34-F118 WeakPolarHBondContact O-CA 3.28Å; S37-F118 WeakPolarHBondContact OG-CD2 3.48Å; G38-F118 VanDerWaalsContact CA-CE2 3.49Å; G38-F118 WeakPolarHBondContact CA-O 3.2Å; G38-F118 VanDerWaalsContact N-CD2 3.33Å; A41-F118 HydrophobicContact CB-CE2 3.97Å; A41-F118 HydrophobicContact CB-CZ 3.87Å; F114-F118 HydrophobicContact CE1-CB 4.39Å; F114-F118 HydrophobicContact CZ-CD2 4.4Å; F114-F118 WeakPolarHBondContact O-CB 3.31Å; F114-F118 PolarHBondContact O-N 3Å; F118-G120 VanDerWaalsContact C-N 3.31Å; F118-G120 PolarHBondContact O-N 3.47Å; F118-G121 PolarHBondContact O-N 2.94Å; F118-F122 HydrophobicContact CE1-CB 4.37Å; F118-F122 WeakPolarHBondContact O-CB 3.39Å; F118-F122 PolarHBondContact O-N 2.89Å
119G94.1Very high89.8Confident25 Ų2570.1 Ų70.126%0.25838%0.378SS..Hα-helixtrans-59.5-42.2177.500000112.1F115 F122 L123F115-G119 PolarHBondContact O-N 3.34Å; G119-F122 PolarHBondContact O-N 3.38Å; G119-L123 WeakPolarHBondContact O-CB 3.43Å; G119-L123 VanDerWaalsContact O-CG 3.31Å; G119-L123 WeakPolarHBondContact O-CG 3.26Å; G119-L123 PolarHBondContact O-N 3.45Å
120G93.2Very high89.7Confident31 Ų3167.6 Ų67.632%0.3237%0.368SS..Hα-helixtrans-59.5-52.6173.400000112.7G116 S117 F118 F122 L123 I124G116-G120 PolarHBondContact O-N 2.96Å; S117-G120 PolarHBondContact O-N 2.83Å; F118-G120 VanDerWaalsContact C-N 3.31Å; F118-G120 PolarHBondContact O-N 3.47Å; G120-F122 VanDerWaalsContact C-N 3.33Å; G120-F122 PolarHBondContact O-N 2.92Å; G120-L123 PolarHBondContact O-N 3.5Å; G120-I124 VanDerWaalsContact O-CG1 3.25Å; G120-I124 WeakPolarHBondContact O-CG1 3.3Å; G120-I124 PolarHBondContact O-N 2.9Å
121G92.4Very high89.7Confident1 Ų164.7 Ų64.71%0.0136%0.358CS..Hα-helixtrans-61.4-40.5177.600000112.8L39 S117 F118 I124 A125L39-G121 WeakPolarHBondContact CD2-O 3.24Å; S117-G121 PolarHBondContact O-N 3.49Å; F118-G121 PolarHBondContact O-N 2.94Å; G121-I124 PolarHBondContact O-N 3.38Å; G121-A125 PolarHBondContact O-N 3.28Å
122F94.7Very high89.9Confident49 Ų4965.3 Ų65.322%0.21536%0.362CS..Hα-helixtrans-60.4-47.6176.8177-97.9000112.4G38 A41 F45 F118 G119 G120 A125 I126G38-F122 WeakPolarHBondContact O-CA 3.21Å; G38-F122 PolarHBondContact O-N 3.22Å; A41-F122 HydrophobicContact CB-CD2 4.36Å; F45-F122 HydrophobicContact CB-CE2 3.8Å; F45-F122 HydrophobicContact CB-CZ 4.18Å; F45-F122 HydrophobicContact CD1-CE2 4.27Å; F45-F122 AromaticContact CD1-CZ 3.79Å; F45-F122 HydrophobicContact CD1-CZ 3.79Å; F45-F122 HydrophobicContact CD2-CZ 4.35Å; F45-F122 HydrophobicContact CE1-CZ 4.26Å; F45-F122 AromaticContact CG-CE2 3.97Å; F45-F122 HydrophobicContact CG-CE2 3.97Å; F45-F122 AromaticContact CG-CZ 3.83Å; F45-F122 HydrophobicContact CG-CZ 3.83Å; F118-F122 HydrophobicContact CE1-CB 4.37Å; F118-F122 WeakPolarHBondContact O-CB 3.39Å; F118-F122 PolarHBondContact O-N 2.89Å; G119-F122 PolarHBondContact O-N 3.38Å; G120-F122 VanDerWaalsContact C-N 3.33Å; G120-F122 PolarHBondContact O-N 2.92Å; F122-A125 PolarHBondContact O-N 3.42Å; F122-I126 HydrophobicContact CD1-CD1 3.72Å; F122-I126 HydrophobicContact CD2-CD1 4.47Å; F122-I126 HydrophobicContact CE1-CD1 3.19Å; F122-I126 HydrophobicContact CE1-CG1 4.42Å; F122-I126 HydrophobicContact CE2-CD1 4.01Å; F122-I126 HydrophobicContact CG-CD1 4.34Å; F122-I126 HydrophobicContact CZ-CD1 3.37Å; F122-I126 HydrophobicContact CZ-CG1 4.45Å; F122-I126 WeakPolarHBondContact O-CG1 3.39Å; F122-I126 PolarHBondContact O-N 3.03Å
123L95.1Very high90.1Very high118 Ų11858.7 Ų58.762%0.61834%0.344SS*.Hα-helixtrans-66.3-41.2178-70.9172.8000112G119 G120 A125 I126 S127G119-L123 WeakPolarHBondContact O-CB 3.43Å; G119-L123 VanDerWaalsContact O-CG 3.31Å; G119-L123 WeakPolarHBondContact O-CG 3.26Å; G119-L123 PolarHBondContact O-N 3.45Å; G120-L123 PolarHBondContact O-N 3.5Å; L123-A125 VanDerWaalsContact C-N 3.34Å; L123-A125 PolarHBondContact O-N 3.18Å; L123-I126 PolarHBondContact O-N 2.87Å; L123-S127 WeakPolarHBondContact O-CB 3.16Å; L123-S127 PolarHBondContact O-N 2.95Å
124I93Very high90.4Very high89 Ų8957.9 Ų57.946%0.45634%0.338SS..Hα-helixtrans-58.8-47.8174.6-69.5167.6000110L39 G120 G121 I126 S127 F128L39-I124 HydrophobicContact CD2-CB 4.22Å; L39-I124 HydrophobicContact CD2-CG2 3.91Å; G120-I124 VanDerWaalsContact O-CG1 3.25Å; G120-I124 WeakPolarHBondContact O-CG1 3.3Å; G120-I124 PolarHBondContact O-N 2.9Å; G121-I124 PolarHBondContact O-N 3.38Å; I124-I126 PolarHBondContact O-N 3.27Å; I124-S127 WeakPolarHBondContact O-CB 3.26Å; I124-S127 PolarHBondContact O-N 3.5Å; I124-S127 VanDerWaalsContact O-N 3.12Å; I124-F128 HydrophobicContact CG2-CD2 3.84Å; I124-F128 HydrophobicContact CG2-CE2 3.99Å; I124-F128 WeakPolarHBondContact O-CD2 3.38Å; I124-F128 PolarHBondContact O-N 3.18Å; I124-F128 VanDerWaalsContact O-N 3.11Å
125A90.4Very high90.5Very high7 Ų758.3 Ų58.36%0.05835%0.345CS..Hα-helixtrans-63-39.6178.100000113L39 G121 F122 L123 S127 F128 A129L39-A125 HydrophobicContact CB-CB 4.47Å; L39-A125 HydrophobicContact CD2-CB 3.93Å; L39-A125 WeakPolarHBondContact O-CB 3.48Å; G121-A125 PolarHBondContact O-N 3.28Å; F122-A125 PolarHBondContact O-N 3.42Å; L123-A125 VanDerWaalsContact C-N 3.34Å; L123-A125 PolarHBondContact O-N 3.18Å; A125-S127 VanDerWaalsContact C-N 3.25Å; A125-S127 PolarHBondContact O-N 3.44Å; A125-F128 PolarHBondContact O-N 3.41Å; A125-A129 WeakPolarHBondContact O-CB 2.94Å; A125-A129 PolarHBondContact O-N 3.39Å
126I90.4Very high90.5Very high46 Ų4657.6 Ų57.624%0.23635%0.349CS..Hα-helixtrans-62.9-36174.6-72.3173.9000111.7F45 A46 R50 F122 L123 I124 F128F45-I126 HydrophobicContact CD1-CD1 3.61Å; F45-I126 HydrophobicContact CD1-CG1 4.17Å; F45-I126 HydrophobicContact CE1-CD1 4.04Å; A46-I126 HydrophobicContact CB-CG1 4.4Å; R50-I126 PolarHBondContact NH2-O 2.87Å; R50-I126 VanDerWaalsContact NH2-O 3.09Å; F122-I126 HydrophobicContact CD1-CD1 3.72Å; F122-I126 HydrophobicContact CD2-CD1 4.47Å; F122-I126 HydrophobicContact CE1-CD1 3.19Å; F122-I126 HydrophobicContact CE1-CG1 4.42Å; F122-I126 HydrophobicContact CE2-CD1 4.01Å; F122-I126 HydrophobicContact CG-CD1 4.34Å; F122-I126 HydrophobicContact CZ-CD1 3.37Å; F122-I126 HydrophobicContact CZ-CG1 4.45Å; F122-I126 WeakPolarHBondContact O-CG1 3.39Å; F122-I126 PolarHBondContact O-N 3.03Å; L123-I126 PolarHBondContact O-N 2.87Å; I124-I126 PolarHBondContact O-N 3.27Å; I126-F128 VanDerWaalsContact C-N 3.33Å
127S89.4Confident90.5Very high94 Ų9458 Ų5866%0.65733%0.334SS*.Hα-helixtrans-68-31.3178.4-170.70000113L123 I124 A125L123-S127 WeakPolarHBondContact O-CB 3.16Å; L123-S127 PolarHBondContact O-N 2.95Å; I124-S127 WeakPolarHBondContact O-CB 3.26Å; I124-S127 PolarHBondContact O-N 3.5Å; I124-S127 VanDerWaalsContact O-N 3.12Å; A125-S127 VanDerWaalsContact C-N 3.25Å; A125-S127 PolarHBondContact O-N 3.44Å
128F82Confident90.6Very high174 Ų17461.4 Ų61.476%0.76335%0.351SS*.Hα-helixtrans-99.4-21.4-177.9-79.9-74.7000114.8I124 A125 I126I124-F128 HydrophobicContact CG2-CD2 3.84Å; I124-F128 HydrophobicContact CG2-CE2 3.99Å; I124-F128 WeakPolarHBondContact O-CD2 3.38Å; I124-F128 PolarHBondContact O-N 3.18Å; I124-F128 VanDerWaalsContact O-N 3.11Å; A125-F128 PolarHBondContact O-N 3.41Å; I126-F128 VanDerWaalsContact C-N 3.33Å
129A79.7Confident90.4Very high45 Ų4561.7 Ų61.737%0.37236%0.36SS..  trans-67.30173.600000111.4Y43 A46 R50 A125Y43-A129 HydrophobicContact CD2-CB 4.17Å; A46-A129 HydrophobicContact CB-CB 3.18Å; R50-A129 VanDerWaalsContact CZ-C 3.45Å; R50-A129 PolarHBondContact NH1-O 3Å; R50-A129 PolarHBondContact NH1-OXT 3.28Å; R50-A129 PolarHBondContact NH2-OXT 3.01Å; A125-A129 WeakPolarHBondContact O-CB 2.94Å; A125-A129 PolarHBondContact O-N 3.39Å

Retrieved 129 of 129 residues in 214.2 ms (Link to these results)