G4VCI8_SCHMA Loading...

Putative cationic amino acid transporter

AlphaFold DB , UniProt , Accession G4VCI8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 647 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
1M55.4Low69.3Low203 Ų203120.2 Ų120.2100%160%0.601SS**  0-55.30-88.4-175.816100112.7T4 A5M1-T4 PolarHBondContact O-N 3.25Å; M1-A5 WeakPolarHBondContact O-CB 3.12Å; M1-A5 PolarHBondContact O-N 3.2Å
2T72Confident69.3Low108 Ų108112.8 Ų112.866%0.66357%0.567SS**Hα-helixtrans-62.9-40.9179.1440000113.5A5 K6T2-A5 PolarHBondContact O-N 3Å; T2-K6 WeakPolarHBondContact O-CB 3.35Å; T2-K6 WeakPolarHBondContact O-CG 3.44Å; T2-K6 PolarHBondContact O-N 2.99Å
3E70.1Confident69.4Low161 Ų161115.7 Ų115.775%0.75257%0.567SS**Hα-helixtrans-66.3-41.7175.3-71.4-136.2143.500112.9A5 K6 S7E3-A5 VanDerWaalsContact C-N 3.35Å; E3-K6 PolarHBondContact O-N 3.24Å; E3-S7 WeakPolarHBondContact O-CB 3.37Å; E3-S7 PolarHBondContact O-N 3.19Å; E3-S7 PolarHBondContact O-OG 3.36Å
4T71.1Confident69.7Low73 Ų73115 Ų11545%0.44856%0.562SS.*Hα-helixtrans-61.8-44.5175.6-26.30000110.4M1 S7 H8M1-T4 PolarHBondContact O-N 3.25Å; T4-S7 PolarHBondContact O-N 3.31Å; T4-S7 PolarHBondContact O-OG 2.98Å; T4-H8 WeakPolarHBondContact O-CB 3.34Å; T4-H8 PolarHBondContact O-CD2 3.46Å; T4-H8 PolarHBondContact O-N 3.34Å
5A65Low69.4Low49 Ų49107.6 Ų107.641%0.40553%0.526SS..Hα-helixtrans-63.4-43175.300000112.1M1 T2 E3 H8 L9M1-A5 WeakPolarHBondContact O-CB 3.12Å; M1-A5 PolarHBondContact O-N 3.2Å; T2-A5 PolarHBondContact O-N 3Å; E3-A5 VanDerWaalsContact C-N 3.35Å; A5-H8 PolarHBondContact O-N 2.96Å; A5-L9 WeakPolarHBondContact O-CB 3.48Å; A5-L9 VanDerWaalsContact O-CG 3.25Å; A5-L9 WeakPolarHBondContact O-CG 3.47Å; A5-L9 PolarHBondContact O-N 2.93Å
6K71.8Confident69.5Low153 Ų153102.9 Ų102.967%0.66550%0.503SS*.Hα-helixtrans-62.6-42.1175.3-77.8179.6-179.7-178.50112.1T2 E3 L9 K10T2-K6 WeakPolarHBondContact O-CB 3.35Å; T2-K6 WeakPolarHBondContact O-CG 3.44Å; T2-K6 PolarHBondContact O-N 2.99Å; E3-K6 PolarHBondContact O-N 3.24Å; K6-L9 PolarHBondContact O-N 3.33Å; K6-K10 VanDerWaalsContact O-CB 3.29Å; K6-K10 WeakPolarHBondContact O-CB 3.37Å; K6-K10 PolarHBondContact O-N 3.49Å
7S71.6Confident69.7Low51 Ų51104.2 Ų104.236%0.35751%0.506SS..Hα-helixtrans-69.6-39.417971.50000111.5E3 T4 K10 R11E3-S7 WeakPolarHBondContact O-CB 3.37Å; E3-S7 PolarHBondContact O-N 3.19Å; E3-S7 PolarHBondContact O-OG 3.36Å; T4-S7 PolarHBondContact O-N 3.31Å; T4-S7 PolarHBondContact O-OG 2.98Å; S7-K10 PolarHBondContact O-N 3.11Å; S7-R11 WeakPolarHBondContact O-CG 3.34Å; S7-R11 PolarHBondContact O-N 3.09Å
8H70.6Confident70Confident105 Ų105101.9 Ų101.949%0.48649%0.491SS..Hα-helixtrans-61.5-48.3171.1-78.6-64000111.6T4 A5 K10 R11 V12T4-H8 WeakPolarHBondContact O-CB 3.34Å; T4-H8 PolarHBondContact O-CD2 3.46Å; T4-H8 PolarHBondContact O-N 3.34Å; A5-H8 PolarHBondContact O-N 2.96Å; H8-K10 VanDerWaalsContact C-N 3.32Å; H8-K10 PolarHBondContact O-N 3.23Å; H8-R11 PolarHBondContact O-N 3.24Å; H8-V12 WeakPolarHBondContact O-CG2 3.33Å; H8-V12 PolarHBondContact O-N 3.17Å
9L69.5Low70Confident120 Ų12099.4 Ų99.463%0.62849%0.485SS*.Hα-helixtrans-61.2-40176.8-75.6168.3000112.1A5 K6 V12 W13A5-L9 WeakPolarHBondContact O-CB 3.48Å; A5-L9 VanDerWaalsContact O-CG 3.25Å; A5-L9 WeakPolarHBondContact O-CG 3.47Å; A5-L9 PolarHBondContact O-N 2.93Å; K6-L9 PolarHBondContact O-N 3.33Å; L9-V12 PolarHBondContact O-N 3.12Å; L9-W13 VanDerWaalsContact O-CB 3.24Å; L9-W13 WeakPolarHBondContact O-CB 3.16Å; L9-W13 PolarHBondContact O-N 3.23Å
10K73.8Confident69.7Low130 Ų13096.5 Ų96.557%0.56547%0.468SS*.Hα-helixtrans-64.4-44.4176.3-174.9175.7172.8-178.10111.5K6 S7 H8 W13 E14K6-K10 VanDerWaalsContact O-CB 3.29Å; K6-K10 WeakPolarHBondContact O-CB 3.37Å; K6-K10 PolarHBondContact O-N 3.49Å; S7-K10 PolarHBondContact O-N 3.11Å; H8-K10 VanDerWaalsContact C-N 3.32Å; H8-K10 PolarHBondContact O-N 3.23Å; K10-W13 WeakPolarHBondContact O-CB 3.31Å; K10-W13 PolarHBondContact O-N 3.3Å; K10-E14 WeakPolarHBondContact CE-OE1 3.4Å; K10-E14 IonicContact NZ-OE1 3.96Å; K10-E14 WeakPolarHBondContact O-CB 3.36Å; K10-E14 WeakPolarHBondContact O-CG 3.38Å; K10-E14 PolarHBondContact O-N 2.91Å
11R71.2Confident69.4Low169 Ų16998.2 Ų98.264%0.63847%0.47SS*.Hα-helixtrans-61.8-44.3175.1-74.8177.9-178.9-177.71.3111.9S7 H8 W13 E14 S15S7-R11 WeakPolarHBondContact O-CG 3.34Å; S7-R11 PolarHBondContact O-N 3.09Å; H8-R11 PolarHBondContact O-N 3.24Å; R11-W13 VanDerWaalsContact C-N 3.34Å; R11-E14 PolarHBondContact O-N 3.14Å; R11-S15 WeakPolarHBondContact O-CB 3.26Å; R11-S15 PolarHBondContact O-N 2.91Å; R11-S15 PolarHBondContact O-OG 2.9Å
12V69.2Low69.5Low32 Ų3289.5 Ų89.519%0.19443%0.426CS..Hα-helixtrans-60.4-46.3175.4175.60000109.7H8 L9 E14 S15 M16 W597H8-V12 WeakPolarHBondContact O-CG2 3.33Å; H8-V12 PolarHBondContact O-N 3.17Å; L9-V12 PolarHBondContact O-N 3.12Å; V12-E14 PolarHBondContact O-N 3.28Å; V12-S15 VanDerWaalsContact C-OG 3.31Å; V12-S15 WeakPolarHBondContact CA-OG 3.41Å; V12-S15 PolarHBondContact O-N 2.9Å; V12-S15 PolarHBondContact O-OG 3.37Å; V12-M16 HydrophobicContact CG1-CE 3.77Å; V12-M16 HydrophobicContact CG1-SD 4.21Å; V12-M16 VanDerWaalsContact O-CG 3.29Å; V12-M16 WeakPolarHBondContact O-CG 3.48Å; V12-M16 PolarHBondContact O-N 3.5Å; V12-W597 HydrophobicContact CB-CZ2 4.35Å; V12-W597 HydrophobicContact CG2-CH2 3.75Å; V12-W597 HydrophobicContact CG2-CZ2 3.44Å; V12-W597 VanDerWaalsContact CG2-CZ2 3.44Å
13W70.9Confident68.5Low150 Ų15088.7 Ų88.757%0.56842%0.418SS*.Hα-helixtrans-62-44.1177.5-177.1-106.7000113.9L9 K10 R11 M16 K17L9-W13 VanDerWaalsContact O-CB 3.24Å; L9-W13 WeakPolarHBondContact O-CB 3.16Å; L9-W13 PolarHBondContact O-N 3.23Å; K10-W13 WeakPolarHBondContact O-CB 3.31Å; K10-W13 PolarHBondContact O-N 3.3Å; R11-W13 VanDerWaalsContact C-N 3.34Å; W13-M16 HydrophobicContact CE3-CE 3.92Å; W13-M16 PolarHBondContact O-N 2.93Å; W13-K17 VanDerWaalsContact CZ2-CE 3.45Å; W13-K17 WeakPolarHBondContact O-CG 3.46Å; W13-K17 PolarHBondContact O-N 3.2Å
14E73.4Confident67.4Low106 Ų10691 Ų9150%0.49542%0.42SS..Hα-helixtrans-65.4-40.8176.5-75.2171-179.900111.4K10 R11 V12 K17 R18K10-E14 WeakPolarHBondContact CE-OE1 3.4Å; K10-E14 IonicContact NZ-OE1 3.96Å; K10-E14 WeakPolarHBondContact O-CB 3.36Å; K10-E14 WeakPolarHBondContact O-CG 3.38Å; K10-E14 PolarHBondContact O-N 2.91Å; R11-E14 PolarHBondContact O-N 3.14Å; V12-E14 PolarHBondContact O-N 3.28Å; E14-K17 PolarHBondContact O-N 3.09Å; E14-R18 PolarHBondContact O-N 3.43Å
15S65.1Low66.1Low4 Ų493.9 Ų93.93%0.02843%0.433CS..Hα-helixtrans-65.3-38.9175.660.90000113.1R11 V12 K17 R18 W597R11-S15 WeakPolarHBondContact O-CB 3.26Å; R11-S15 PolarHBondContact O-N 2.91Å; R11-S15 PolarHBondContact O-OG 2.9Å; V12-S15 VanDerWaalsContact C-OG 3.31Å; V12-S15 WeakPolarHBondContact CA-OG 3.41Å; V12-S15 PolarHBondContact O-N 2.9Å; V12-S15 PolarHBondContact O-OG 3.37Å; S15-K17 PolarHBondContact O-N 3.25Å; S15-R18 WeakPolarHBondContact O-CB 3.28Å; S15-R18 WeakPolarHBondContact O-CD 3.46Å; S15-R18 VanDerWaalsContact O-CG 3.23Å; S15-R18 WeakPolarHBondContact O-CG 3.27Å; S15-R18 PolarHBondContact O-N 3.16Å; S15-R18 VanDerWaalsContact O-N 3.15Å; S15-W597 PolarHBondContact OG-NE1 3.42Å
16M71.8Confident65.3Low33 Ų3396.1 Ų96.116%0.16344%0.438CS..Hα-helixtrans-65-21.3176.4-74.2-173.2-61.300113V12 W13 E110 F111V12-M16 HydrophobicContact CG1-CE 3.77Å; V12-M16 HydrophobicContact CG1-SD 4.21Å; V12-M16 VanDerWaalsContact O-CG 3.29Å; V12-M16 WeakPolarHBondContact O-CG 3.48Å; V12-M16 PolarHBondContact O-N 3.5Å; W13-M16 HydrophobicContact CE3-CE 3.92Å; W13-M16 PolarHBondContact O-N 2.93Å; M16-E110 PolarHBondContact O-N 2.9Å; M16-F111 HydrophobicContact CB-CB 3.7Å; M16-F111 HydrophobicContact CB-CG 4.4Å; M16-F111 HydrophobicContact CG-CB 3.83Å; M16-F111 HydrophobicContact CG-CD2 4.23Å; M16-F111 HydrophobicContact CG-CG 4.14Å; M16-F111 PolarHBondContact O-N 3.48Å; M16-F111 HydrophobicContact SD-CB 4.26Å; M16-F111 HydrophobicContact SD-CD1 4.43Å; M16-F111 HydrophobicContact SD-CD2 3.87Å; M16-F111 HydrophobicContact SD-CE2 4.3Å; M16-F111 HydrophobicContact SD-CG 3.93Å
17K72.7Confident64.5Low124 Ų12491.8 Ų91.854%0.53942%0.421SS..THydrogen-bonded Turntrans-92.2-0.5178-74.9-176.8172.8-173.20114.4W13 E14 S15 S19W13-K17 VanDerWaalsContact CZ2-CE 3.45Å; W13-K17 WeakPolarHBondContact O-CG 3.46Å; W13-K17 PolarHBondContact O-N 3.2Å; E14-K17 PolarHBondContact O-N 3.09Å; S15-K17 PolarHBondContact O-N 3.25Å; K17-S19 PolarHBondContact O-N 3.43Å
18R75.1Confident63.7Low64 Ų6495.9 Ų95.924%0.24244%0.439CS..  trans-54124.8175.8-73168.4-178157.3-1.5108.8E14 S15 Y105 G109 E110 H602E14-R18 PolarHBondContact O-N 3.43Å; S15-R18 WeakPolarHBondContact O-CB 3.28Å; S15-R18 WeakPolarHBondContact O-CD 3.46Å; S15-R18 VanDerWaalsContact O-CG 3.23Å; S15-R18 WeakPolarHBondContact O-CG 3.27Å; S15-R18 PolarHBondContact O-N 3.16Å; S15-R18 VanDerWaalsContact O-N 3.15Å; R18-Y105 WeakPolarHBondContact O-CE2 3.45Å; R18-G109 CarbonylContact O-C 3.49Å; R18-G109 VanDerWaalsContact O-CA 3.29Å; R18-G109 WeakPolarHBondContact O-CA 3.45Å; R18-E110 HydrophobicContact CB-CB 4.22Å; R18-E110 WeakPolarHBondContact CD-OE2 3.36Å; R18-E110 WeakPolarHBondContact O-CB 3.34Å; R18-E110 PolarHBondContact O-N 3.23Å; R18-H602 HydrophobicContact CB-CB 4.26Å; R18-H602 HydrophobicContact CG-CB 4.4Å; R18-H602 PolarHBondContact NE-O 3.2Å
19S69.1Low63.4Low53 Ų5392.6 Ų92.637%0.37143%0.427SS..  trans-113.4148.4176.360.20000109.8K17 Y105K17-S19 PolarHBondContact O-N 3.43Å; S19-Y105 WeakPolarHBondContact CA-O 3.46Å
20R64.8Low63.1Low41 Ų4190.8 Ų90.816%0.15542%0.422CS..  trans-78.8124.7-179.5-171168.7-177.9173.7-0.6108.5F22 Y105 V106 D353R20-F22 HydrophobicContact CG-CE1 4.3Å; R20-F22 HydrophobicContact CG-CE2 4.2Å; R20-F22 HydrophobicContact CG-CZ 3.97Å; R20-F22 VanDerWaalsContact NE-CZ 3.33Å; R20-Y105 HydrophobicContact CB-CD2 3.56Å; R20-Y105 HydrophobicContact CB-CE2 4.01Å; R20-Y105 HydrophobicContact CB-CG 4.08Å; R20-Y105 VanDerWaalsContact N-CD2 3.32Å; R20-V106 HydrophobicContact CB-CG2 4.32Å; R20-D353 IonicContact CZ-OD1 3.13Å; R20-D353 IonicContact CZ-OD2 3.6Å; R20-D353 IonicContact NE-OD1 3.61Å; R20-D353 IonicContact NH1-OD1 3.69Å; R20-D353 PolarHBondContact NH1-OD1 3.42Å; R20-D353 IonicContact NH1-OD2 3.5Å; R20-D353 PolarHBondContact NH1-OD2 3.27Å; R20-D353 IonicContact NH2-OD1 3.83Å
21R62.3Low62.7Low133 Ų13385.3 Ų85.350%0.50240%0.399SS..  trans-97.7127174.6-65.4-174.8-179.7176.7-0108.9
22F58.3Low62.6Low21 Ų2185.3 Ų85.39%0.09240%0.403CS..  trans-105.8115.9172.1-70.8-66.3000108.2R20 I94 K96 T102 V106 L422R20-F22 HydrophobicContact CG-CE1 4.3Å; R20-F22 HydrophobicContact CG-CE2 4.2Å; R20-F22 HydrophobicContact CG-CZ 3.97Å; R20-F22 VanDerWaalsContact NE-CZ 3.33Å; F22-I94 HydrophobicContact CD2-CG2 4.24Å; F22-I94 HydrophobicContact CE2-CG2 3.65Å; F22-I94 HydrophobicContact CZ-CG2 4.31Å; F22-K96 HydrophobicContact CD1-CG 4.46Å; F22-K96 HydrophobicContact CE1-CD 4.36Å; F22-K96 HydrophobicContact CE1-CG 3.66Å; F22-K96 HydrophobicContact CZ-CB 4.21Å; F22-K96 HydrophobicContact CZ-CG 3.76Å; F22-T102 HydrophobicContact CE2-CG2 4.26Å; F22-T102 HydrophobicContact CZ-CG2 4.04Å; F22-V106 HydrophobicContact CD2-CG2 3.77Å; F22-V106 HydrophobicContact CE2-CG2 3.37Å; F22-V106 HydrophobicContact CZ-CG2 4.5Å; F22-L422 HydrophobicContact CB-CD2 4.44Å
23D50.9Low63.1Low91 Ų9189.1 Ų89.149%0.48741%0.414SS..  trans-77.9156.4161.6-113.3-38.1000109.7D25 N26D23-D25 PolarHBondContact O-N 2.91Å; D23-N26 HydrophobicContact CB-CB 4.44Å; D23-N26 PolarHBondContact O-N 2.97Å
24R47.7Very low63.5Low209 Ų20984 Ų8479%0.78940%0.401SS*.SBendtrans-58.4-30.7-178.7-156.1176.3167.5-177-5.2111.9
25D42.2Very low64Low134 Ų13479.3 Ų79.372%0.71738%0.379SS*.G310 helixtrans-80.6-24.4177.6-61.4-19.3000112.9D23 L27 D28D23-D25 PolarHBondContact O-N 2.91Å; D25-L27 PolarHBondContact O-N 3.38Å; D25-D28 PolarHBondContact O-N 3.44Å
26N49.5Very low65.2Low96 Ų9681.7 Ų81.751%0.51339%0.394SS..G310 helixtrans-75.79.4177.2-78.5-26.3000114.1D23 K96D23-N26 HydrophobicContact CB-CB 4.44Å; D23-N26 PolarHBondContact O-N 2.97Å; N26-K96 VanDerWaalsContact O-CE 3.23Å; N26-K96 WeakPolarHBondContact O-CE 3.45Å; N26-K96 PolarHBondContact O-NZ 3.2Å
27L55.1Low66.1Low61 Ų6181.3 Ų81.332%0.31940%0.396SS..G310 helixtrans-80.9-3.6169.1-68.4176.3000112.9D25 T29 P95D25-L27 PolarHBondContact O-N 3.38Å; L27-T29 PolarHBondContact O-N 2.9Å; L27-P95 HydrophobicContact CD2-CG 3.84Å
28D55.1Low66.9Low137 Ų13780.9 Ų80.973%0.73339%0.394SS*.  trans-56.5134166.4-78.8-19.4000110.1D25 K96D25-D28 PolarHBondContact O-N 3.44Å; D28-K96 PolarHBondContact O-NZ 3.23Å
29T63.7Low67.5Low37 Ų3779.8 Ų79.823%0.22739%0.393CS..  trans-126.4133.8-170167.90000109.6L27 L31 R33 E262L27-T29 PolarHBondContact O-N 2.9Å; T29-L31 WeakPolarHBondContact CG2-O 3.41Å; T29-L31 PolarHBondContact O-N 3.16Å; T29-L31 WeakPolarHBondContact OG1-CA 3.41Å; T29-L31 WeakPolarHBondContact OG1-CB 3.4Å; T29-L31 PolarHBondContact OG1-N 3.2Å; T29-L31 PolarHBondContact OG1-O 3.29Å; T29-R33 HydrophobicContact CG2-CG 4.46Å; T29-E262 WeakPolarHBondContact CB-OE1 3.34Å; T29-E262 HydrophobicContact CG2-CG 4.23Å; T29-E262 VanDerWaalsContact OG1-CD 3.29Å; T29-E262 WeakPolarHBondContact OG1-CG 3.32Å; T29-E262 PolarHBondContact OG1-OE1 3.41Å
30P62.6Low68.5Low81 Ų8177.3 Ų77.353%0.52638%0.376SS..SBendtrans-70.7-15.6168.330.9-33.6000111.8
31L66.5Low69.8Low15 Ų1576.1 Ų76.18%0.07937%0.373CS..SBendtrans-87.6136.3-179-58.9171.9000111.2T29 R33 E262 E263T29-L31 WeakPolarHBondContact CG2-O 3.41Å; T29-L31 PolarHBondContact O-N 3.16Å; T29-L31 WeakPolarHBondContact OG1-CA 3.41Å; T29-L31 WeakPolarHBondContact OG1-CB 3.4Å; T29-L31 PolarHBondContact OG1-N 3.2Å; T29-L31 PolarHBondContact OG1-O 3.29Å; L31-R33 PolarHBondContact O-N 3.04Å; L31-E262 HydrophobicContact CB-CG 4.42Å; L31-E262 HydrophobicContact CD1-CB 4.33Å; L31-E262 HydrophobicContact CD1-CG 4.14Å; L31-E263 HydrophobicContact CB-CG 3.87Å; L31-E263 HydrophobicContact CD1-CG 4.24Å
32K69Low71.2Confident169 Ų16970 Ų7074%0.73535%0.351SS*.  trans-73.3120.1-179.1-173.2174.3-175.8167.10111.5C34K32-C34 HydrophobicContact CG-CB 4.44Å; K32-C34 PolarHBondContact O-N 3.28Å; K32-C34 VanDerWaalsContact O-N 3.08Å; K32-C34 PolarHBondContact O-SG 3.34Å
33R78.8Confident72.6Confident112 Ų11269.7 Ų69.742%0.42335%0.35SS..  trans-67.8103.6170-66.8-173.5-176.1171.78.1110.7T29 L31 E262 E263 L265T29-R33 HydrophobicContact CG2-CG 4.46Å; L31-R33 PolarHBondContact O-N 3.04Å; R33-E262 WeakPolarHBondContact CG-O 3.5Å; R33-E263 CarbonylContact C-O 3.55Å; R33-E263 WeakPolarHBondContact CA-O 3.48Å; R33-L265 HydrophobicContact CB-CD2 4.4Å; R33-L265 WeakPolarHBondContact O-CD2 3.5Å
34C80.5Confident74.6Confident42 Ų4265.3 Ų65.328%0.28433%0.326SS..  trans-141.4-4.3-175.858.80000114.8K32 E263K32-C34 HydrophobicContact CG-CB 4.44Å; K32-C34 PolarHBondContact O-N 3.28Å; K32-C34 VanDerWaalsContact O-N 3.08Å; K32-C34 PolarHBondContact O-SG 3.34Å; C34-E263 PolarHBondContact N-O 3.37Å
35L83.1Confident76.7Confident8 Ų855.7 Ų55.74%0.04229%0.291CS..BIsolated β-bridgetrans-93.8127.7-178.2-60.1176000111.4D39 L40 A192 E263 L265L35-D39 HydrophobicContact CD2-CB 4.23Å; L35-L40 HydrophobicContact CB-CD1 4.5Å; L35-L40 HydrophobicContact CB-CD2 4.21Å; L35-L40 HydrophobicContact CB-CG 4.09Å; L35-L40 HydrophobicContact CD1-CD2 3.95Å; L35-A192 HydrophobicContact CD2-CB 3.81Å; L35-E263 HydrophobicContact CD1-CB 3.87Å; L35-E263 HydrophobicContact CG-CB 4.25Å; L35-E263 PolarHBondContact N-O 3Å; L35-L265 PolarHBondContact O-N 3.24Å
36T89.6Confident79Confident54 Ų5449.3 Ų49.333%0.33126%0.256SS..  trans-83.8165.717269.30000111.1F38 D39 L40 L265T36-F38 PolarHBondContact O-N 3.25Å; T36-F38 PolarHBondContact OG1-N 3.37Å; T36-D39 WeakPolarHBondContact CB-OD2 3.41Å; T36-D39 PolarHBondContact N-OD2 3.47Å; T36-D39 PolarHBondContact O-N 2.93Å; T36-D39 PolarHBondContact OG1-N 3.13Å; T36-D39 PolarHBondContact OG1-OD2 2.78Å; T36-L40 WeakPolarHBondContact O-CD1 3.2Å; T36-L40 VanDerWaalsContact O-CG 3.3Å; T36-L40 WeakPolarHBondContact O-CG 3.48Å; T36-L40 PolarHBondContact O-N 3.36Å; T36-L265 HydrophobicContact CG2-CD1 3.81Å
37A90.6Very high81Confident26 Ų2644.9 Ų44.922%0.21523%0.233CC..Hα-helixtrans-57.7-32.1172.400000112.4T41A37-T41 WeakPolarHBondContact O-CB 3.48Å; A37-T41 PolarHBondContact O-N 3.46Å; A37-T41 PolarHBondContact O-OG1 3.01Å
38F90.8Very high82.7Confident114 Ų11442 Ų4250%0.522%0.217SC..Hα-helixtrans-67.5-48.6176.6-179.3-101.6000111.4T36 L40 T41 L42 M200T36-F38 PolarHBondContact O-N 3.25Å; T36-F38 PolarHBondContact OG1-N 3.37Å; F38-L40 VanDerWaalsContact C-N 3.29Å; F38-L40 PolarHBondContact O-N 3.07Å; F38-T41 WeakPolarHBondContact O-CB 3.4Å; F38-T41 PolarHBondContact O-N 2.85Å; F38-T41 VanDerWaalsContact O-N 3.16Å; F38-L42 HydrophobicContact CD1-CD1 4.04Å; F38-L42 HydrophobicContact CE1-CD1 3.39Å; F38-L42 HydrophobicContact CE1-CG 4.32Å; F38-L42 HydrophobicContact CE2-CD1 4.26Å; F38-L42 HydrophobicContact CZ-CD1 3.52Å; F38-L42 HydrophobicContact CZ-CG 4.24Å; F38-L42 PolarHBondContact O-N 2.89Å; F38-M200 HydrophobicContact CZ-CE 4.16Å; F38-M200 HydrophobicContact CZ-SD 4.47Å
39D87.9Confident84.3Confident41 Ų4135.5 Ų35.522%0.21918%0.183CC..Hα-helixtrans-59.1-43.5177.4-55.6-48000111.2L35 T36 L42 L43L35-D39 HydrophobicContact CD2-CB 4.23Å; T36-D39 WeakPolarHBondContact CB-OD2 3.41Å; T36-D39 PolarHBondContact N-OD2 3.47Å; T36-D39 PolarHBondContact O-N 2.93Å; T36-D39 PolarHBondContact OG1-N 3.13Å; T36-D39 PolarHBondContact OG1-OD2 2.78Å; D39-L42 PolarHBondContact O-N 3.19Å; D39-L43 WeakPolarHBondContact O-CB 3.37Å; D39-L43 PolarHBondContact O-N 3.4Å
40L89.4Confident85.2Confident1 Ų133.8 Ų33.81%0.00517%0.172CC..Hα-helixtrans-65.2-38.4177.6-70.7163.6000112.6L35 T36 F38 L43 G44 I257 A264 M271 A274L35-L40 HydrophobicContact CB-CD1 4.5Å; L35-L40 HydrophobicContact CB-CD2 4.21Å; L35-L40 HydrophobicContact CB-CG 4.09Å; L35-L40 HydrophobicContact CD1-CD2 3.95Å; T36-L40 WeakPolarHBondContact O-CD1 3.2Å; T36-L40 VanDerWaalsContact O-CG 3.3Å; T36-L40 WeakPolarHBondContact O-CG 3.48Å; T36-L40 PolarHBondContact O-N 3.36Å; F38-L40 VanDerWaalsContact C-N 3.29Å; F38-L40 PolarHBondContact O-N 3.07Å; L40-L43 WeakPolarHBondContact O-CB 3.26Å; L40-L43 PolarHBondContact O-N 3.35Å; L40-G44 PolarHBondContact O-N 2.87Å; L40-I257 HydrophobicContact CB-CG2 4.11Å; L40-I257 HydrophobicContact CD2-CG2 4.27Å; L40-A264 HydrophobicContact CD1-CB 3.83Å; L40-M271 HydrophobicContact CD1-CE 3.22Å; L40-M271 HydrophobicContact CD2-CE 3.85Å; L40-M271 HydrophobicContact CG-CE 4.07Å; L40-A274 HydrophobicContact CB-CB 3.63Å
41T92.8Very high85.9Confident16 Ų1630.2 Ų30.210%0.09815%0.15CC..Hα-helixtrans-63.7-46.2176.1-56.40000110A37 F38 G44 I45 A274 V277A37-T41 WeakPolarHBondContact O-CB 3.48Å; A37-T41 PolarHBondContact O-N 3.46Å; A37-T41 PolarHBondContact O-OG1 3.01Å; F38-T41 WeakPolarHBondContact O-CB 3.4Å; F38-T41 PolarHBondContact O-N 2.85Å; F38-T41 VanDerWaalsContact O-N 3.16Å; T41-G44 PolarHBondContact O-N 3.41Å; T41-I45 HydrophobicContact CG2-CD1 3.8Å; T41-I45 HydrophobicContact CG2-CG1 4.42Å; T41-I45 VanDerWaalsContact O-CG1 3.31Å; T41-I45 WeakPolarHBondContact O-CG1 3.26Å; T41-I45 PolarHBondContact O-N 2.99Å; T41-A274 WeakPolarHBondContact OG1-CA 3.45Å; T41-V277 HydrophobicContact CG2-CB 4.13Å; T41-V277 HydrophobicContact CG2-CG1 3.76Å
42L91.4Very high86.6Confident6 Ų629.5 Ų29.53%0.03115%0.146CC..Hα-helixtrans-68.5-33.5178-72-178.3000112.7F38 D39 G44 I45 G46 T196 T199 M200 L203F38-L42 HydrophobicContact CD1-CD1 4.04Å; F38-L42 HydrophobicContact CE1-CD1 3.39Å; F38-L42 HydrophobicContact CE1-CG 4.32Å; F38-L42 HydrophobicContact CE2-CD1 4.26Å; F38-L42 HydrophobicContact CZ-CD1 3.52Å; F38-L42 HydrophobicContact CZ-CG 4.24Å; F38-L42 PolarHBondContact O-N 2.89Å; D39-L42 PolarHBondContact O-N 3.19Å; L42-G44 VanDerWaalsContact C-N 3.34Å; L42-I45 PolarHBondContact O-N 3.26Å; L42-G46 PolarHBondContact O-N 3.41Å; L42-T196 HydrophobicContact CD1-CG2 3.57Å; L42-T199 HydrophobicContact CD2-CG2 4.16Å; L42-M200 HydrophobicContact CD1-CG 3.83Å; L42-M200 HydrophobicContact CD1-SD 4.06Å; L42-M200 HydrophobicContact CD2-CG 4.29Å; L42-M200 HydrophobicContact CD2-SD 3.88Å; L42-L203 HydrophobicContact CD2-CD1 4.21Å
43L88.4Confident87.6Confident13 Ų1321.5 Ų21.57%0.06811%0.111CC..Hα-helixtrans-57.2-49.2169.9-16979000110.7D39 L40 N47 T338D39-L43 WeakPolarHBondContact O-CB 3.37Å; D39-L43 PolarHBondContact O-N 3.4Å; L40-L43 WeakPolarHBondContact O-CB 3.26Å; L40-L43 PolarHBondContact O-N 3.35Å; L43-N47 PolarHBondContact O-N 3.15Å; L43-N47 VanDerWaalsContact O-N 3.1Å; L43-T338 HydrophobicContact CD1-CG2 3.8Å; L43-T338 HydrophobicContact CG-CG2 3.75Å
44G91Very high88.1Confident0 Ų016.6 Ų16.60%09%0.093CC..Hα-helixtrans-62.9-46.4177.100000113.9L40 T41 L42 N47 M48 I257L40-G44 PolarHBondContact O-N 2.87Å; T41-G44 PolarHBondContact O-N 3.41Å; L42-G44 VanDerWaalsContact C-N 3.34Å; G44-N47 PolarHBondContact O-N 3.25Å; G44-M48 VanDerWaalsContact O-CE 3.27Å; G44-M48 WeakPolarHBondContact O-CE 3.25Å; G44-M48 PolarHBondContact O-N 2.74Å; G44-M48 VanDerWaalsContact O-N 3.15Å; G44-I257 VanDerWaalsContact CA-CG1 3.46Å
45I93.2Very high88.2Confident7 Ų715.4 Ų15.44%0.0368%0.084CC..Hα-helixtrans-65-44.4179.1-65.9169000110.7T41 L42 N47 M48 A49 T199 L203 V281 V282T41-I45 HydrophobicContact CG2-CD1 3.8Å; T41-I45 HydrophobicContact CG2-CG1 4.42Å; T41-I45 VanDerWaalsContact O-CG1 3.31Å; T41-I45 WeakPolarHBondContact O-CG1 3.26Å; T41-I45 PolarHBondContact O-N 2.99Å; L42-I45 PolarHBondContact O-N 3.26Å; I45-N47 VanDerWaalsContact C-N 3.25Å; I45-N47 PolarHBondContact O-N 2.86Å; I45-M48 PolarHBondContact O-N 3.44Å; I45-A49 HydrophobicContact CG2-CB 4.28Å; I45-A49 WeakPolarHBondContact O-CB 3.4Å; I45-A49 PolarHBondContact O-N 3.48Å; I45-T199 HydrophobicContact CB-CG2 4.33Å; I45-T199 HydrophobicContact CG2-CG2 4.11Å; I45-L203 HydrophobicContact CG2-CD1 3.88Å; I45-L203 HydrophobicContact CG2-CD2 3.73Å; I45-L203 HydrophobicContact CG2-CG 4.13Å; I45-V281 HydrophobicContact CD1-CB 4.16Å; I45-V281 HydrophobicContact CD1-CG1 3.97Å; I45-V282 HydrophobicContact CB-CG2 4.32Å; I45-V282 HydrophobicContact CG1-CG2 4.18Å; I45-V282 HydrophobicContact CG2-CG2 4.02Å
46G89.8Confident88.1Confident0 Ų015.4 Ų15.40%08%0.084CC..Hα-helixtrans-57.7-40.6177.800000112L42 T199 S335L42-G46 PolarHBondContact O-N 3.41Å; G46-T199 WeakPolarHBondContact CA-OG1 3.39Å; G46-S335 PolarHBondContact O-N 2.88Å
47N91.1Very high88.2Confident3 Ų312.9 Ų12.92%0.0167%0.068CC..Hα-helixtrans-66.1-53178.2-154.316.1000113.4L43 G44 I45 G253 A256 S335 T338 S339L43-N47 PolarHBondContact O-N 3.15Å; L43-N47 VanDerWaalsContact O-N 3.1Å; G44-N47 PolarHBondContact O-N 3.25Å; I45-N47 VanDerWaalsContact C-N 3.25Å; I45-N47 PolarHBondContact O-N 2.86Å; N47-G253 WeakPolarHBondContact ND2-CA 3.29Å; N47-G253 PolarHBondContact ND2-O 3.25Å; N47-A256 WeakPolarHBondContact ND2-CB 3.38Å; N47-S335 WeakPolarHBondContact O-CB 3.35Å; N47-S335 PolarHBondContact O-OG 2.99Å; N47-S335 PolarHBondContact OD1-O 3.31Å; N47-T338 HydrophobicContact CB-CG2 3.63Å; N47-S339 PolarHBondContact OD1-OG 3.16Å
48M92.3Very high88.2Confident0 Ų011.7 Ų11.70%06%0.059CC..Hα-helixtrans-73.2-45.8-175.3-67.4-178.9-81.900112.4G44 I45 G50 G52 F254 V279 V282G44-M48 VanDerWaalsContact O-CE 3.27Å; G44-M48 WeakPolarHBondContact O-CE 3.25Å; G44-M48 PolarHBondContact O-N 2.74Å; G44-M48 VanDerWaalsContact O-N 3.15Å; I45-M48 PolarHBondContact O-N 3.44Å; M48-G50 PolarHBondContact O-N 3.33Å; M48-G52 PolarHBondContact O-N 2.71Å; M48-F254 HydrophobicContact CE-CB 3.87Å; M48-F254 HydrophobicContact SD-CB 3.75Å; M48-F254 HydrophobicContact SD-CD1 4.43Å; M48-V279 HydrophobicContact CE-CG2 3.97Å; M48-V279 HydrophobicContact SD-CG2 3.99Å; M48-V282 HydrophobicContact CB-CG1 4.03Å; M48-V282 HydrophobicContact CB-CG2 4.17Å; M48-V282 HydrophobicContact CE-CB 4.48Å; M48-V282 HydrophobicContact CE-CG2 4.03Å
49A88.1Confident88.1Confident1 Ų16.9 Ų6.91%0.0084%0.039CC..Hα-helixtrans-62.3-44.9-170.700000112I45 I53I45-A49 HydrophobicContact CG2-CB 4.28Å; I45-A49 WeakPolarHBondContact O-CB 3.4Å; I45-A49 PolarHBondContact O-N 3.48Å; A49-I53 WeakPolarHBondContact O-CG2 3.29Å; A49-I53 PolarHBondContact O-N 3.2Å; A49-I53 VanDerWaalsContact O-N 3.15Å
50G82.5Confident88.3Confident0 Ų04.9 Ų4.90%03%0.028CC..Hα-helixtrans-60.4-63.8-176.800000113.4M48 G52 Y54 G331 L332M48-G50 PolarHBondContact O-N 3.33Å; G50-G52 PolarHBondContact O-N 3.41Å; G50-Y54 WeakPolarHBondContact O-CD2 3.23Å; G50-G331 VanDerWaalsContact CA-C 3.48Å; G50-G331 VanDerWaalsContact CA-O 3.28Å; G50-G331 WeakPolarHBondContact CA-O 3.37Å; G50-L332 WeakPolarHBondContact O-CD2 3.35Å
51A77.3Confident88.6Confident6 Ų64.9 Ų4.95%0.053%0.028CC..Hα-helixtrans-60.8-33.3179.400000112.4V55 V131 Y249A51-V55 VanDerWaalsContact O-CB 3.28Å; A51-V55 WeakPolarHBondContact O-CB 3.42Å; A51-V55 WeakPolarHBondContact O-CG2 3.33Å; A51-V131 HydrophobicContact CB-CG2 3.51Å; A51-Y249 HydrophobicContact CB-CE1 4.21Å
52G81.9Confident88.6Confident0 Ų05.4 Ų5.40%03%0.028CC..Hα-helixtrans-76.5-61.3-171.300000115.1M48 G50 A250M48-G52 PolarHBondContact O-N 2.71Å; G50-G52 PolarHBondContact O-N 3.41Å; G52-A250 VanDerWaalsContact CA-CA 3.42Å
53I90Very high88.6Confident1 Ų18.6 Ų8.61%0.0055%0.045CC..Hα-helixtrans-77.2-34.4-170.2-160.2161.8000112.6A49 T57 I206 L285 F286 A289 F308A49-I53 WeakPolarHBondContact O-CG2 3.29Å; A49-I53 PolarHBondContact O-N 3.2Å; A49-I53 VanDerWaalsContact O-N 3.15Å; I53-T57 WeakPolarHBondContact CA-OG1 3.48Å; I53-T57 WeakPolarHBondContact O-CB 3.28Å; I53-T57 PolarHBondContact O-OG1 2.85Å; I53-I206 HydrophobicContact CD1-CD1 3.89Å; I53-I206 HydrophobicContact CD1-CG1 3.91Å; I53-L285 HydrophobicContact CD1-CG 4.49Å; I53-F286 HydrophobicContact CB-CD1 3.86Å; I53-F286 HydrophobicContact CB-CE1 3.56Å; I53-F286 HydrophobicContact CB-CZ 4.35Å; I53-F286 HydrophobicContact CD1-CD1 3.82Å; I53-F286 HydrophobicContact CD1-CE1 4.28Å; I53-F286 HydrophobicContact CG1-CD1 4.14Å; I53-F286 HydrophobicContact CG1-CE1 4.34Å; I53-F286 HydrophobicContact CG2-CE1 4.32Å; I53-A289 HydrophobicContact CD1-CB 3.4Å; I53-A289 VanDerWaalsContact CD1-CB 3.4Å; I53-F308 HydrophobicContact CD1-CE2 4.22Å; I53-F308 HydrophobicContact CD1-CZ 3.83Å; I53-F308 HydrophobicContact CG1-CE2 3.55Å; I53-F308 HydrophobicContact CG1-CZ 3.6Å
54Y88.4Confident88.6Confident10 Ų1011.5 Ų11.54%0.0396%0.057CC..Hα-helixtrans-85.3-34.7-173-61.6-59000112.7G50 N202 I206 F308 S328 L332G50-Y54 WeakPolarHBondContact O-CD2 3.23Å; Y54-N202 WeakPolarHBondContact CE2-OD1 3.47Å; Y54-N202 PolarHBondContact OH-OD1 2.8Å; Y54-I206 HydrophobicContact CE1-CD1 4.06Å; Y54-F308 HydrophobicContact CD1-CD2 4.22Å; Y54-F308 HydrophobicContact CE1-CD2 4.39Å; Y54-S328 WeakPolarHBondContact CD1-OG 3.47Å; Y54-S328 WeakPolarHBondContact CE1-OG 3.39Å; Y54-L332 HydrophobicContact CD2-CG 4.45Å
55V81.9Confident88.7Confident16 Ų1611.5 Ų11.510%0.0976%0.057CC..Hα-helixtrans-84.6-40.1-175.2-175.30000112.7A51 L332 I390A51-V55 VanDerWaalsContact O-CB 3.28Å; A51-V55 WeakPolarHBondContact O-CB 3.42Å; A51-V55 WeakPolarHBondContact O-CG2 3.33Å; V55-L332 HydrophobicContact CG2-CD2 3.63Å; V55-I390 HydrophobicContact CG1-CD1 3.49Å; V55-I390 VanDerWaalsContact CG1-CD1 3.49Å; V55-I390 HydrophobicContact CG1-CG1 4.15Å
56L82.3Confident88.7Confident8 Ų811.1 Ų11.14%0.0426%0.056CC..THydrogen-bonded Turntrans-111.5-25.2-165.4-72.6168.4000115.2G58 T59 V60 T246 Y249L56-G58 VanDerWaalsContact C-N 3.28Å; L56-G58 PolarHBondContact O-N 2.7Å; L56-T59 PolarHBondContact O-N 2.7Å; L56-T59 VanDerWaalsContact O-N 3.13Å; L56-V60 WeakPolarHBondContact O-CG2 3.2Å; L56-V60 PolarHBondContact O-N 3.38Å; L56-T246 HydrophobicContact CD2-CG2 4.13Å; L56-Y249 HydrophobicContact CD1-CD1 3.02Å; L56-Y249 HydrophobicContact CD1-CE1 3.69Å; L56-Y249 HydrophobicContact CD1-CG 3.49Å; L56-Y249 VanDerWaalsContact CD1-CG 3.49Å; L56-Y249 HydrophobicContact CG-CD1 4.22Å
57T91.3Very high88.9Confident1 Ų111.1 Ų11.11%0.0066%0.056CC..Hα-helixtrans-55.6-44.5-173-62.50000111.9I53 T59 V60 I61 Y73 L293 F308I53-T57 WeakPolarHBondContact CA-OG1 3.48Å; I53-T57 WeakPolarHBondContact O-CB 3.28Å; I53-T57 PolarHBondContact O-OG1 2.85Å; T57-T59 PolarHBondContact O-N 3.27Å; T57-V60 PolarHBondContact O-N 3.48Å; T57-I61 HydrophobicContact CG2-CD1 3.64Å; T57-I61 HydrophobicContact CG2-CG1 4.38Å; T57-I61 VanDerWaalsContact O-CG1 3.3Å; T57-I61 WeakPolarHBondContact O-CG1 3.34Å; T57-I61 PolarHBondContact O-N 3.36Å; T57-Y73 HydrophobicContact CG2-CE2 4.29Å; T57-Y73 PolarHBondContact OG1-OH 3.27Å; T57-L293 HydrophobicContact CG2-CD2 4.14Å; T57-F308 HydrophobicContact CG2-CE2 4.31Å; T57-F308 HydrophobicContact CG2-CZ 4.26Å
58G90.7Very high89.1Confident1 Ų111 Ų111%0.016%0.055CC..Hα-helixtrans-61-45.3178.800000113.4L56 R62 D303L56-G58 VanDerWaalsContact C-N 3.28Å; L56-G58 PolarHBondContact O-N 2.7Å; G58-R62 WeakPolarHBondContact O-CB 3.39Å; G58-R62 PolarHBondContact O-N 3.06Å; G58-D303 VanDerWaalsContact CA-O 3.26Å; G58-D303 WeakPolarHBondContact CA-O 3.49Å
59T89.2Confident89.3Confident13 Ų1311 Ų118%0.086%0.055CC..Hα-helixtrans-65.9-41.8178.1-62.30000111.9L56 T57 R62 D63 R304L56-T59 PolarHBondContact O-N 2.7Å; L56-T59 VanDerWaalsContact O-N 3.13Å; T57-T59 PolarHBondContact O-N 3.27Å; T59-R62 PolarHBondContact O-N 2.96Å; T59-D63 WeakPolarHBondContact O-CB 3.25Å; T59-D63 PolarHBondContact O-N 3.34Å; T59-R304 PolarHBondContact OG1-O 3.32Å
60V91.6Very high89.6Confident0 Ų012.8 Ų12.80%06%0.062CC..Hα-helixtrans-66.4-42.1178.9178.10000111.8L56 T57 K64 S65 T69 T246L56-V60 WeakPolarHBondContact O-CG2 3.2Å; L56-V60 PolarHBondContact O-N 3.38Å; T57-V60 PolarHBondContact O-N 3.48Å; V60-K64 HydrophobicContact CG1-CB 4.32Å; V60-K64 PolarHBondContact O-N 2.94Å; V60-S65 PolarHBondContact O-N 3.05Å; V60-T69 HydrophobicContact CB-CG2 4.28Å; V60-T69 HydrophobicContact CG1-CG2 3.77Å; V60-T246 HydrophobicContact CG2-CG2 3.71Å
61I94.6Very high90.2Very high0 Ų014.8 Ų14.80%07%0.073CC..Iπ-helixtrans-61.4-49.6176.2-68.4166.6000110T57 G66 T69 L293 T294 W299 V302T57-I61 HydrophobicContact CG2-CD1 3.64Å; T57-I61 HydrophobicContact CG2-CG1 4.38Å; T57-I61 VanDerWaalsContact O-CG1 3.3Å; T57-I61 WeakPolarHBondContact O-CG1 3.34Å; T57-I61 PolarHBondContact O-N 3.36Å; I61-G66 WeakPolarHBondContact O-CA 3.46Å; I61-G66 PolarHBondContact O-N 3.46Å; I61-T69 WeakPolarHBondContact CA-OG1 3.4Å; I61-T69 HydrophobicContact CG1-CG2 3.83Å; I61-T69 WeakPolarHBondContact CG1-OG1 3.12Å; I61-L293 HydrophobicContact CD1-CD2 3.59Å; I61-L293 HydrophobicContact CD1-CG 4.22Å; I61-T294 HydrophobicContact CD1-CG2 3.86Å; I61-T294 HydrophobicContact CG1-CG2 4.09Å; I61-T294 HydrophobicContact CG2-CG2 3.82Å; I61-W299 HydrophobicContact CG2-CB 3.82Å; I61-V302 HydrophobicContact CB-CG1 4.44Å; I61-V302 HydrophobicContact CD1-CG1 4.38Å; I61-V302 HydrophobicContact CG2-CB 4.2Å; I61-V302 HydrophobicContact CG2-CG1 4.44Å; I61-V302 HydrophobicContact CG2-CG2 4.02Å
62R93.2Very high91Very high28 Ų2814.5 Ų14.511%0.1067%0.071CC..Iπ-helixtrans-83.3-23.9-169.2-165.5-162.742.955.227.1114.2G58 T59 Y235 V302 R304G58-R62 WeakPolarHBondContact O-CB 3.39Å; G58-R62 PolarHBondContact O-N 3.06Å; T59-R62 PolarHBondContact O-N 2.96Å; R62-Y235 PolarHBondContact O-OH 2.98Å; R62-V302 VanDerWaalsContact CD-O 3.28Å; R62-V302 WeakPolarHBondContact CD-O 3.05Å; R62-R304 VanDerWaalsContact NE-CZ 3.28Å
63D91Very high91.7Very high72 Ų7214.5 Ų14.539%0.3857%0.071SC..Iπ-helixtrans-114.3-21.1-177.8-74.1-28.6000116.1T59T59-D63 WeakPolarHBondContact O-CB 3.25Å; T59-D63 PolarHBondContact O-N 3.34Å
64K89.1Confident92Very high74 Ų7417.6 Ų17.632%0.3229%0.087SC..Iπ-helixtrans-123.6-52.3-165.5-62.2-167.2-178.4-173.70114.5V60 Y235 G239 T246V60-K64 HydrophobicContact CG1-CB 4.32Å; V60-K64 PolarHBondContact O-N 2.94Å; K64-Y235 WeakPolarHBondContact O-CB 3.33Å; K64-Y235 WeakPolarHBondContact O-CD2 3.23Å; K64-Y235 VanDerWaalsContact O-CG 3.23Å; K64-G239 CarbonylContact O-C 3.51Å; K64-G239 WeakPolarHBondContact O-CA 3.44Å; K64-T246 HydrophobicContact CD-CG2 4.48Å; K64-T246 WeakPolarHBondContact CD-OG1 3.39Å; K64-T246 PolarHBondContact NZ-OG1 2.84Å
65S92.8Very high92.2Very high0 Ų019.7 Ų19.70%010%0.101CC..Iπ-helixtrans-119.3-20.8-168.4-67.70000114V60 S68 T69 S72 G239 G243V60-S65 PolarHBondContact O-N 3.05Å; S65-S68 PolarHBondContact O-N 2.93Å; S65-S68 PolarHBondContact O-OG 3.49Å; S65-T69 WeakPolarHBondContact CB-OG1 3.13Å; S65-S72 PolarHBondContact OG-OG 3.48Å; S65-G239 PolarHBondContact OG-O 3.15Å; S65-G243 WeakPolarHBondContact OG-CA 3.41Å
66G93.6Very high92.8Very high0 Ų019 Ų190%010%0.097CC..G310 helixtrans60.8-140.1-174.500000112I61 S68 T69I61-G66 WeakPolarHBondContact O-CA 3.46Å; I61-G66 PolarHBondContact O-N 3.46Å; G66-S68 PolarHBondContact O-N 3.26Å; G66-T69 WeakPolarHBondContact O-CB 3.25Å; G66-T69 PolarHBondContact O-N 3.27Å; G66-T69 VanDerWaalsContact O-N 3.17Å; G66-T69 PolarHBondContact O-OG1 3.19Å
67P93.9Very high93.4Very high0 Ų018.7 Ų18.70%010%0.095CC..G310 helixtrans-60.5-25.1177-24.336000113.8T69 F70 F224 A225 L232 W299P67-T69 PolarHBondContact O-N 2.92Å; P67-T69 VanDerWaalsContact O-N 3.12Å; P67-F70 WeakPolarHBondContact O-CD1 3.47Å; P67-F70 WeakPolarHBondContact O-CE1 2.96Å; P67-F224 HydrophobicContact CB-CE1 3.94Å; P67-F224 HydrophobicContact CB-CE2 4.42Å; P67-F224 HydrophobicContact CB-CZ 3.84Å; P67-A225 HydrophobicContact CB-CB 4.15Å; P67-A225 HydrophobicContact CG-CB 4.03Å; P67-L232 HydrophobicContact CB-CD1 4.06Å; P67-W299 HydrophobicContact CG-CB 4.17Å; P67-W299 HydrophobicContact CG-CD2 4.38Å; P67-W299 HydrophobicContact CG-CG 3.71Å
68S95.4Very high93.6Very high1 Ų123 Ų231%0.00712%0.118CC..G310 helixtrans-72.53.6177.1720000114.8S65 G66 F70 L71 S72 L232 M240S65-S68 PolarHBondContact O-N 2.93Å; S65-S68 PolarHBondContact O-OG 3.49Å; G66-S68 PolarHBondContact O-N 3.26Å; S68-F70 PolarHBondContact O-N 2.89Å; S68-L71 WeakPolarHBondContact O-CB 3.31Å; S68-L71 PolarHBondContact O-N 3.34Å; S68-S72 PolarHBondContact O-N 3.27Å; S68-S72 VanDerWaalsContact O-N 3.15Å; S68-L232 WeakPolarHBondContact CB-O 3.45Å; S68-L232 PolarHBondContact N-O 3.48Å; S68-M240 WeakPolarHBondContact OG-CB 3.48Å
69T95.6Very high93.7Very high0 Ų023.5 Ų23.50%012%0.12CC..Hα-helixtrans-57.4-32.8179.8-60.10000113.4V60 I61 S65 G66 P67 L71 S72 Y73V60-T69 HydrophobicContact CB-CG2 4.28Å; V60-T69 HydrophobicContact CG1-CG2 3.77Å; I61-T69 WeakPolarHBondContact CA-OG1 3.4Å; I61-T69 HydrophobicContact CG1-CG2 3.83Å; I61-T69 WeakPolarHBondContact CG1-OG1 3.12Å; S65-T69 WeakPolarHBondContact CB-OG1 3.13Å; G66-T69 WeakPolarHBondContact O-CB 3.25Å; G66-T69 PolarHBondContact O-N 3.27Å; G66-T69 VanDerWaalsContact O-N 3.17Å; G66-T69 PolarHBondContact O-OG1 3.19Å; P67-T69 PolarHBondContact O-N 2.92Å; P67-T69 VanDerWaalsContact O-N 3.12Å; T69-L71 VanDerWaalsContact C-N 3.27Å; T69-L71 PolarHBondContact O-N 2.7Å; T69-S72 WeakPolarHBondContact O-CA 3.26Å; T69-S72 VanDerWaalsContact O-CB 3.28Å; T69-S72 WeakPolarHBondContact O-CB 3.28Å; T69-S72 PolarHBondContact O-N 3.48Å; T69-S72 VanDerWaalsContact O-N 3.11Å; T69-Y73 HydrophobicContact CG2-CD2 3.78Å; T69-Y73 HydrophobicContact CG2-CE2 3.68Å; T69-Y73 WeakPolarHBondContact O-CD2 3.26Å; T69-Y73 PolarHBondContact O-N 2.87Å
70F95.5Very high94Very high37 Ų3722.9 Ų22.916%0.16212%0.117CC..Hα-helixtrans-64.3-32.6175.874.6-87.1000112.3P67 S68 Y73 L74 F224 L232 L287 S290 L291P67-F70 WeakPolarHBondContact O-CD1 3.47Å; P67-F70 WeakPolarHBondContact O-CE1 2.96Å; S68-F70 PolarHBondContact O-N 2.89Å; F70-Y73 PolarHBondContact O-N 3.3Å; F70-L74 PolarHBondContact O-N 3.06Å; F70-F224 HydrophobicContact CE1-CE1 4.37Å; F70-F224 HydrophobicContact CE1-CZ 4.26Å; F70-L232 HydrophobicContact CE1-CD1 4.18Å; F70-L287 HydrophobicContact CB-CG 4.29Å; F70-L287 HydrophobicContact CD2-CD2 4.45Å; F70-L287 HydrophobicContact CD2-CG 4.42Å; F70-S290 WeakPolarHBondContact CA-OG 3.21Å; F70-S290 WeakPolarHBondContact CB-OG 3.37Å; F70-L291 HydrophobicContact CB-CB 4.08Å; F70-L291 HydrophobicContact CD1-CD1 3.98Å; F70-L291 HydrophobicContact CE1-CD1 4.21Å; F70-L291 HydrophobicContact CG-CB 4.36Å; F70-L291 HydrophobicContact CG-CD1 4.39Å
71L95.7Very high94.2Very high42 Ų4226.6 Ų26.622%0.2213%0.133CC..Hα-helixtrans-71.8-37.2172.2-62.6175.4000111.2S68 T69 Y73 L74 V75 F233 M240S68-L71 WeakPolarHBondContact O-CB 3.31Å; S68-L71 PolarHBondContact O-N 3.34Å; T69-L71 VanDerWaalsContact C-N 3.27Å; T69-L71 PolarHBondContact O-N 2.7Å; L71-Y73 VanDerWaalsContact C-N 3.32Å; L71-Y73 PolarHBondContact O-N 2.9Å; L71-L74 WeakPolarHBondContact O-CB 3.41Å; L71-L74 PolarHBondContact O-N 3.25Å; L71-V75 WeakPolarHBondContact O-CG2 3.22Å; L71-V75 PolarHBondContact O-N 3.46Å; L71-F233 HydrophobicContact CD1-CE1 4.21Å; L71-F233 HydrophobicContact CD1-CZ 4.03Å; L71-M240 HydrophobicContact CB-CE 3.98Å; L71-M240 HydrophobicContact CB-CG 4.04Å; L71-M240 HydrophobicContact CB-SD 4.12Å; L71-M240 HydrophobicContact CD1-CE 4.2Å
72S94.2Very high94.3Very high0 Ų027.8 Ų27.80%014%0.139CC..Hα-helixtrans-58-45172-61.10000111.4S65 S68 T69 V75 A76 M240 A244S65-S72 PolarHBondContact OG-OG 3.48Å; S68-S72 PolarHBondContact O-N 3.27Å; S68-S72 VanDerWaalsContact O-N 3.15Å; T69-S72 WeakPolarHBondContact O-CA 3.26Å; T69-S72 VanDerWaalsContact O-CB 3.28Å; T69-S72 WeakPolarHBondContact O-CB 3.28Å; T69-S72 PolarHBondContact O-N 3.48Å; T69-S72 VanDerWaalsContact O-N 3.11Å; S72-V75 PolarHBondContact O-N 3.35Å; S72-A76 VanDerWaalsContact O-CB 3.3Å; S72-A76 WeakPolarHBondContact O-CB 3.23Å; S72-A76 PolarHBondContact O-N 3.5Å; S72-M240 PolarHBondContact OG-O 3.21Å; S72-A244 WeakPolarHBondContact O-CB 3.37Å
73Y96Very high94.4Very high0 Ų026.4 Ų26.40%013%0.134CC..Hα-helixtrans-66-36.4174.6-83.8-61.4000113.1T57 T69 F70 L71 A76 G77 C247 A250 F251 F286T57-Y73 HydrophobicContact CG2-CE2 4.29Å; T57-Y73 PolarHBondContact OG1-OH 3.27Å; T69-Y73 HydrophobicContact CG2-CD2 3.78Å; T69-Y73 HydrophobicContact CG2-CE2 3.68Å; T69-Y73 WeakPolarHBondContact O-CD2 3.26Å; T69-Y73 PolarHBondContact O-N 2.87Å; F70-Y73 PolarHBondContact O-N 3.3Å; L71-Y73 VanDerWaalsContact C-N 3.32Å; L71-Y73 PolarHBondContact O-N 2.9Å; Y73-A76 PolarHBondContact O-N 3.01Å; Y73-G77 PolarHBondContact O-N 2.82Å; Y73-C247 HydrophobicContact CD1-CB 3.64Å; Y73-C247 HydrophobicContact CE1-CB 3.71Å; Y73-C247 HydrophobicContact CG-CB 4.25Å; Y73-A250 HydrophobicContact CE1-CB 3.77Å; Y73-F251 HydrophobicContact CD1-CE2 4.03Å; Y73-F251 HydrophobicContact CD1-CZ 4.5Å; Y73-F286 HydrophobicContact CD1-CB 3.67Å; Y73-F286 AromaticContact CD1-CD2 3.64Å; Y73-F286 HydrophobicContact CD1-CD2 3.64Å; Y73-F286 HydrophobicContact CD1-CG 4.07Å; Y73-F286 HydrophobicContact CD2-CB 4.23Å; Y73-F286 HydrophobicContact CE1-CB 4.06Å; Y73-F286 AromaticContact CE1-CD2 3.6Å; Y73-F286 HydrophobicContact CE1-CD2 3.6Å; Y73-F286 HydrophobicContact CE1-CE2 4.31Å; Y73-F286 HydrophobicContact CE1-CG 4.07Å; Y73-F286 HydrophobicContact CG-CB 3.78Å
74L96.1Very high94.6Very high66 Ų6623 Ų2335%0.34612%0.116SC..Hα-helixtrans-62-48.4175.5-179.760.7000111.6F70 L71 G77 I78 L287F70-L74 PolarHBondContact O-N 3.06Å; L71-L74 WeakPolarHBondContact O-CB 3.41Å; L71-L74 PolarHBondContact O-N 3.25Å; L74-G77 PolarHBondContact O-N 2.79Å; L74-I78 HydrophobicContact CD1-CD1 4.24Å; L74-I78 HydrophobicContact CG-CD1 4.2Å; L74-I78 VanDerWaalsContact O-CG1 3.32Å; L74-I78 WeakPolarHBondContact O-CG1 3.33Å; L74-I78 PolarHBondContact O-N 3.45Å; L74-L287 HydrophobicContact CB-CD1 4.09Å; L74-L287 HydrophobicContact CD1-CD1 4Å; L74-L287 HydrophobicContact CG-CD1 4.42Å
75V93.6Very high95Very high55 Ų5520.7 Ų20.733%0.33311%0.106SC..Hα-helixtrans-64.1-43.5178.5174.30000111.2L71 S72 I78 T79 A244L71-V75 WeakPolarHBondContact O-CG2 3.22Å; L71-V75 PolarHBondContact O-N 3.46Å; S72-V75 PolarHBondContact O-N 3.35Å; V75-I78 PolarHBondContact O-N 2.9Å; V75-T79 PolarHBondContact O-N 3.46Å; V75-T79 VanDerWaalsContact O-N 3.11Å; V75-T79 PolarHBondContact O-OG1 3.37Å; V75-A244 HydrophobicContact CB-CB 4.09Å; V75-A244 HydrophobicContact CG1-CB 4.08Å
76A93.3Very high95.1Very high2 Ų220.7 Ų20.72%0.01711%0.106CC..Hα-helixtrans-62-43.2175.700000111.9S72 Y73 T79 A80 C247 F248 F251S72-A76 VanDerWaalsContact O-CB 3.3Å; S72-A76 WeakPolarHBondContact O-CB 3.23Å; S72-A76 PolarHBondContact O-N 3.5Å; Y73-A76 PolarHBondContact O-N 3.01Å; A76-T79 WeakPolarHBondContact O-CB 3.4Å; A76-T79 PolarHBondContact O-N 2.94Å; A76-A80 WeakPolarHBondContact O-CB 3.31Å; A76-A80 PolarHBondContact O-N 3.14Å; A76-C247 HydrophobicContact CB-CB 3.77Å; A76-F248 HydrophobicContact CB-CB 4.48Å; A76-F251 HydrophobicContact CB-CD2 3.91Å; A76-F251 HydrophobicContact CB-CE2 3.71Å
77G95.7Very high95.1Very high1 Ų120.7 Ų20.71%0.0111%0.107CC..Hα-helixtrans-66.4-39.7179.100000113.2Y73 L74 T79 A80 F81Y73-G77 PolarHBondContact O-N 2.82Å; L74-G77 PolarHBondContact O-N 2.79Å; G77-T79 VanDerWaalsContact C-N 3.33Å; G77-T79 PolarHBondContact O-N 3.44Å; G77-A80 PolarHBondContact O-N 2.93Å; G77-F81 VanDerWaalsContact O-CB 3.26Å; G77-F81 WeakPolarHBondContact O-CB 3.33Å; G77-F81 PolarHBondContact O-N 3.46Å
78I95Very high95.1Very high92 Ų9220.9 Ų20.947%0.47211%0.108SC..Hα-helixtrans-60.4-46172-68.4165.3000110.1L74 V75 A80 F81 L82L74-I78 HydrophobicContact CD1-CD1 4.24Å; L74-I78 HydrophobicContact CG-CD1 4.2Å; L74-I78 VanDerWaalsContact O-CG1 3.32Å; L74-I78 WeakPolarHBondContact O-CG1 3.33Å; L74-I78 PolarHBondContact O-N 3.45Å; V75-I78 PolarHBondContact O-N 2.9Å; I78-A80 PolarHBondContact O-N 3.35Å; I78-F81 PolarHBondContact O-N 3.27Å; I78-L82 HydrophobicContact CG2-CD1 4.34Å; I78-L82 WeakPolarHBondContact O-CG 3.48Å; I78-L82 PolarHBondContact O-N 2.71Å
79T93.4Very high95Very high11 Ų1120.8 Ų20.87%0.06711%0.108CC..Hα-helixtrans-63-43.5179.1-54.30000111.6V75 A76 G77 L82 N83 F248 L565 L569V75-T79 PolarHBondContact O-N 3.46Å; V75-T79 VanDerWaalsContact O-N 3.11Å; V75-T79 PolarHBondContact O-OG1 3.37Å; A76-T79 WeakPolarHBondContact O-CB 3.4Å; A76-T79 PolarHBondContact O-N 2.94Å; G77-T79 VanDerWaalsContact C-N 3.33Å; G77-T79 PolarHBondContact O-N 3.44Å; T79-L82 PolarHBondContact O-N 3.19Å; T79-N83 PolarHBondContact O-N 2.83Å; T79-N83 PolarHBondContact O-ND2 3.41Å; T79-F248 HydrophobicContact CG2-CD2 4.16Å; T79-F248 HydrophobicContact CG2-CE2 3.82Å; T79-L565 HydrophobicContact CG2-CB 3.73Å; T79-L565 HydrophobicContact CG2-CD1 3.88Å; T79-L565 HydrophobicContact CG2-CG 4.38Å; T79-L569 HydrophobicContact CG2-CD1 4.42Å
80A95.1Very high94.8Very high0 Ų020.8 Ų20.80%011%0.108CC..Hα-helixtrans-63.4-43.1175.400000111.5A76 G77 I78 L82 N83 A84 F248 F251 V279A76-A80 WeakPolarHBondContact O-CB 3.31Å; A76-A80 PolarHBondContact O-N 3.14Å; G77-A80 PolarHBondContact O-N 2.93Å; I78-A80 PolarHBondContact O-N 3.35Å; A80-L82 PolarHBondContact O-N 3.12Å; A80-N83 PolarHBondContact O-N 2.86Å; A80-A84 VanDerWaalsContact O-CB 3.24Å; A80-A84 WeakPolarHBondContact O-CB 3.35Å; A80-A84 PolarHBondContact O-N 3.36Å; A80-F248 HydrophobicContact CB-CE2 4.18Å; A80-F251 HydrophobicContact CB-CB 3.46Å; A80-F251 VanDerWaalsContact CB-CB 3.46Å; A80-F251 HydrophobicContact CB-CD1 3.98Å; A80-F251 HydrophobicContact CB-CD2 4.37Å; A80-F251 HydrophobicContact CB-CG 3.69Å; A80-V279 HydrophobicContact CB-CG1 4.12Å
81F95.9Very high94.5Very high78 Ų7819 Ų1934%0.34210%0.1SC..Hα-helixtrans-61.8-42.2179.2-170.3-98.5000111.9G77 I78 N83 A84 L85 V279G77-F81 VanDerWaalsContact O-CB 3.26Å; G77-F81 WeakPolarHBondContact O-CB 3.33Å; G77-F81 PolarHBondContact O-N 3.46Å; I78-F81 PolarHBondContact O-N 3.27Å; F81-N83 PolarHBondContact O-N 2.92Å; F81-A84 WeakPolarHBondContact O-CB 3.35Å; F81-A84 PolarHBondContact O-N 3.02Å; F81-L85 HydrophobicContact CD1-CD1 4.26Å; F81-L85 HydrophobicContact CD1-CG 4.29Å; F81-L85 HydrophobicContact CE1-CD1 4.06Å; F81-L85 HydrophobicContact CE1-CD2 4Å; F81-L85 HydrophobicContact CE1-CG 4.11Å; F81-L85 HydrophobicContact CZ-CD2 4.17Å; F81-L85 WeakPolarHBondContact O-CG 3.49Å; F81-L85 PolarHBondContact O-N 3.18Å; F81-V279 HydrophobicContact CB-CG1 4Å; F81-V279 HydrophobicContact CD2-CB 4.27Å; F81-V279 HydrophobicContact CD2-CG1 4.12Å
82L96.2Very high94.2Very high24 Ų2417.2 Ų17.213%0.1269%0.09CC..Hα-helixtrans-62.1-43.2175.6-66172.9000112.2I78 T79 A80 A84 L85 C86 I558 L561 C562 L565I78-L82 HydrophobicContact CG2-CD1 4.34Å; I78-L82 WeakPolarHBondContact O-CG 3.48Å; I78-L82 PolarHBondContact O-N 2.71Å; T79-L82 PolarHBondContact O-N 3.19Å; A80-L82 PolarHBondContact O-N 3.12Å; L82-A84 VanDerWaalsContact C-N 3.33Å; L82-L85 HydrophobicContact CD2-CD1 4.48Å; L82-L85 PolarHBondContact O-N 2.83Å; L82-C86 PolarHBondContact O-N 2.81Å; L82-I558 HydrophobicContact CD2-CD1 4.39Å; L82-I558 HydrophobicContact CD2-CG1 4.45Å; L82-I558 HydrophobicContact CD2-CG2 4.08Å; L82-L561 HydrophobicContact CD1-CD2 3.72Å; L82-L561 HydrophobicContact CD1-CG 4.22Å; L82-C562 VanDerWaalsContact CB-SG 3.55Å; L82-C562 PolarHBondContact O-SG 3.43Å; L82-L565 HydrophobicContact CD1-CD1 4.13Å
83N95.6Very high93.7Very high0 Ų019.1 Ų19.10%010%0.098CC..Hα-helixtrans-62.6-42172.9-78.8-64.6000111T79 A80 F81 L85 C86 Y87 F254 Y405 N566T79-N83 PolarHBondContact O-N 2.83Å; T79-N83 PolarHBondContact O-ND2 3.41Å; A80-N83 PolarHBondContact O-N 2.86Å; F81-N83 PolarHBondContact O-N 2.92Å; N83-L85 VanDerWaalsContact C-N 3.3Å; N83-L85 PolarHBondContact O-N 3Å; N83-C86 WeakPolarHBondContact O-CA 3.12Å; N83-C86 VanDerWaalsContact O-CB 3.31Å; N83-C86 WeakPolarHBondContact O-CB 3.27Å; N83-C86 PolarHBondContact O-N 2.87Å; N83-Y87 WeakPolarHBondContact O-CD2 3.27Å; N83-Y87 PolarHBondContact O-N 2.91Å; N83-Y87 VanDerWaalsContact O-N 3.09Å; N83-F254 HydrophobicContact CB-CZ 3.94Å; N83-Y405 HydrophobicContact CB-CD2 4.12Å; N83-N566 PolarHBondContact ND2-OD1 2.87Å; N83-N566 PolarHBondContact OD1-ND2 3.41Å
84A96Very high93.2Very high1 Ų119.7 Ų19.71%0.00810%0.1CC..Hα-helixtrans-61.6-35.6179.300000112.3A80 F81 L82 C86 Y87 A88 F254 T275 V279A80-A84 VanDerWaalsContact O-CB 3.24Å; A80-A84 WeakPolarHBondContact O-CB 3.35Å; A80-A84 PolarHBondContact O-N 3.36Å; F81-A84 WeakPolarHBondContact O-CB 3.35Å; F81-A84 PolarHBondContact O-N 3.02Å; L82-A84 VanDerWaalsContact C-N 3.33Å; A84-C86 VanDerWaalsContact C-N 3.33Å; A84-C86 PolarHBondContact O-N 3.25Å; A84-Y87 PolarHBondContact O-N 3.1Å; A84-A88 WeakPolarHBondContact O-CB 3.13Å; A84-A88 PolarHBondContact O-N 3.18Å; A84-F254 HydrophobicContact CB-CD2 3.95Å; A84-F254 HydrophobicContact CB-CE2 3.94Å; A84-F254 HydrophobicContact CB-CG 4.31Å; A84-F254 HydrophobicContact CB-CZ 4.25Å; A84-T275 HydrophobicContact CB-CG2 3.6Å; A84-T275 VanDerWaalsContact O-CG2 3.28Å; A84-T275 WeakPolarHBondContact O-CG2 3.12Å; A84-V279 HydrophobicContact CB-CB 4.48Å; A84-V279 HydrophobicContact CB-CG2 3.82Å
85L95.7Very high92.6Very high24 Ų2417.2 Ų17.213%0.1269%0.089CC..Hα-helixtrans-60.9-41.3171.6-64.9176.8000111.7F81 L82 N83 A88 E89 F550 V552 I558F81-L85 HydrophobicContact CD1-CD1 4.26Å; F81-L85 HydrophobicContact CD1-CG 4.29Å; F81-L85 HydrophobicContact CE1-CD1 4.06Å; F81-L85 HydrophobicContact CE1-CD2 4Å; F81-L85 HydrophobicContact CE1-CG 4.11Å; F81-L85 HydrophobicContact CZ-CD2 4.17Å; F81-L85 WeakPolarHBondContact O-CG 3.49Å; F81-L85 PolarHBondContact O-N 3.18Å; L82-L85 HydrophobicContact CD2-CD1 4.48Å; L82-L85 PolarHBondContact O-N 2.83Å; N83-L85 VanDerWaalsContact C-N 3.3Å; N83-L85 PolarHBondContact O-N 3Å; L85-A88 WeakPolarHBondContact O-CB 3.46Å; L85-A88 PolarHBondContact O-N 3.5Å; L85-E89 PolarHBondContact O-N 3.35Å; L85-E89 VanDerWaalsContact O-N 3.11Å; L85-F550 HydrophobicContact CD2-CE1 4.37Å; L85-F550 HydrophobicContact CD2-CZ 3.93Å; L85-V552 VanDerWaalsContact C-CG2 3.46Å; L85-V552 HydrophobicContact CB-CG2 4.08Å; L85-V552 WeakPolarHBondContact O-CG2 3.29Å; L85-I558 HydrophobicContact CD1-CD1 4.32Å
86C95.6Very high92Very high0 Ų015.4 Ų15.40%08%0.076CC..Hα-helixtrans-63.2-44.2176.9-61.80000111.2L82 N83 A84 E89 L90 V408 V412L82-C86 PolarHBondContact O-N 2.81Å; N83-C86 WeakPolarHBondContact O-CA 3.12Å; N83-C86 VanDerWaalsContact O-CB 3.31Å; N83-C86 WeakPolarHBondContact O-CB 3.27Å; N83-C86 PolarHBondContact O-N 2.87Å; A84-C86 VanDerWaalsContact C-N 3.33Å; A84-C86 PolarHBondContact O-N 3.25Å; C86-E89 PolarHBondContact O-N 2.62Å; C86-L90 PolarHBondContact O-N 3.49Å; C86-V408 HydrophobicContact CB-CG1 4.31Å; C86-V412 HydrophobicContact CB-CG2 3.86Å
87Y94.6Very high91.5Very high1 Ų115.5 Ų15.50%0.0048%0.077CC..Hα-helixtrans-64-38.5174.3-89.2-93.8000113.1N83 A84 L90 G91 S99 A100 Y103 F254 D255 T258 Y405 V408N83-Y87 WeakPolarHBondContact O-CD2 3.27Å; N83-Y87 PolarHBondContact O-N 2.91Å; N83-Y87 VanDerWaalsContact O-N 3.09Å; A84-Y87 PolarHBondContact O-N 3.1Å; Y87-L90 PolarHBondContact O-N 3.44Å; Y87-G91 PolarHBondContact O-N 3.45Å; Y87-S99 WeakPolarHBondContact CE1-OG 3.38Å; Y87-A100 HydrophobicContact CE1-CB 4.18Å; Y87-A100 WeakPolarHBondContact OH-CB 3.39Å; Y87-Y103 HydrophobicContact CD1-CE2 4.08Å; Y87-Y103 HydrophobicContact CE1-CE2 4.37Å; Y87-F254 AromaticContact CD2-CE2 3.59Å; Y87-F254 HydrophobicContact CD2-CE2 3.59Å; Y87-F254 HydrophobicContact CD2-CZ 4.09Å; Y87-F254 HydrophobicContact CE2-CE2 4.15Å; Y87-F254 HydrophobicContact CE2-CZ 4.36Å; Y87-F254 AromaticContact CG-CE2 3.8Å; Y87-F254 HydrophobicContact CG-CE2 3.8Å; Y87-D255 HydrophobicContact CD1-CB 4.09Å; Y87-D255 HydrophobicContact CE1-CB 3.66Å; Y87-T258 HydrophobicContact CD1-CG2 4.14Å; Y87-Y405 AromaticContact CE2-CD1 3.41Å; Y87-Y405 HydrophobicContact CE2-CD1 3.41Å; Y87-Y405 VanDerWaalsContact CE2-CD1 3.41Å; Y87-Y405 AromaticContact CE2-CE1 3.7Å; Y87-Y405 HydrophobicContact CE2-CE1 3.7Å; Y87-Y405 HydrophobicContact CE2-CG 4.14Å; Y87-Y405 AromaticContact CZ-CD1 3.68Å; Y87-Y405 AromaticContact CZ-CE1 3.78Å; Y87-Y405 VanDerWaalsContact OH-CD1 3.23Å; Y87-Y405 WeakPolarHBondContact OH-CD1 3.33Å; Y87-Y405 WeakPolarHBondContact OH-CE1 3.22Å; Y87-V408 HydrophobicContact CD1-CG1 4.45Å; Y87-V408 HydrophobicContact CD2-CB 4.42Å; Y87-V408 HydrophobicContact CD2-CG1 3.65Å; Y87-V408 HydrophobicContact CE1-CG1 4.39Å; Y87-V408 HydrophobicContact CE1-CG2 4.15Å; Y87-V408 HydrophobicContact CE2-CB 3.87Å; Y87-V408 HydrophobicContact CE2-CG1 3.61Å; Y87-V408 HydrophobicContact CE2-CG2 4.08Å; Y87-V408 HydrophobicContact CG-CG1 4.1Å
88A94Very high90.9Very high3 Ų315.5 Ų15.53%0.0258%0.076CC..Hα-helixtrans-61.6-43.2177.500000112.1A84 L85 S92 P272 T275 F550A84-A88 WeakPolarHBondContact O-CB 3.13Å; A84-A88 PolarHBondContact O-N 3.18Å; L85-A88 WeakPolarHBondContact O-CB 3.46Å; L85-A88 PolarHBondContact O-N 3.5Å; A88-S92 WeakPolarHBondContact O-CB 3.25Å; A88-S92 PolarHBondContact O-N 2.87Å; A88-S92 PolarHBondContact O-OG 3.35Å; A88-S92 VanDerWaalsContact O-OG 3.11Å; A88-P272 HydrophobicContact CB-CB 4.08Å; A88-T275 HydrophobicContact CB-CG2 4.41Å; A88-F550 HydrophobicContact CB-CD1 3.88Å; A88-F550 HydrophobicContact CB-CE1 3.93Å
89E92.6Very high90.8Very high0 Ų011.1 Ų11.10%05%0.054CC..Hα-helixtrans-61.9-51.5175.5172169.8160.200111L85 C86 S92 R93 R416 F550 V552L85-E89 PolarHBondContact O-N 3.35Å; L85-E89 VanDerWaalsContact O-N 3.11Å; C86-E89 PolarHBondContact O-N 2.62Å; E89-S92 PolarHBondContact O-N 3.44Å; E89-S92 PolarHBondContact O-OG 3.06Å; E89-R93 VanDerWaalsContact CD-CZ 3.48Å; E89-R93 VanDerWaalsContact CG-CZ 3.45Å; E89-R93 WeakPolarHBondContact O-CB 3.41Å; E89-R93 VanDerWaalsContact O-CG 3.3Å; E89-R93 WeakPolarHBondContact O-CG 3.5Å; E89-R93 PolarHBondContact O-N 2.86Å; E89-R93 IonicContact OE1-CZ 2.82Å; E89-R93 IonicContact OE1-NE 3.43Å; E89-R93 IonicContact OE1-NH1 3.9Å; E89-R93 PolarHBondContact OE1-NH1 2.96Å; E89-R93 IonicContact OE1-NH2 2.76Å; E89-R93 PolarHBondContact OE1-NH2 3.47Å; E89-R93 IonicContact OE2-NH2 3.45Å; E89-R416 IonicContact OE1-CZ 2.76Å; E89-R416 IonicContact OE1-NE 3.18Å; E89-R416 PolarHBondContact OE1-NE 2.91Å; E89-R416 IonicContact OE1-NH2 2.68Å; E89-R416 PolarHBondContact OE1-NH2 2.89Å; E89-R416 IonicContact OE2-CZ 3.35Å; E89-R416 IonicContact OE2-NE 3.53Å; E89-R416 PolarHBondContact OE2-NE 3.27Å; E89-R416 IonicContact OE2-NH2 3.81Å; E89-R416 PolarHBondContact OE2-NH2 3.18Å; E89-F550 HydrophobicContact CB-CD1 4.27Å; E89-V552 HydrophobicContact CB-CG2 3.85Å; E89-V552 VanDerWaalsContact OE2-CB 3.27Å; E89-V552 WeakPolarHBondContact OE2-CB 3.12Å; E89-V552 VanDerWaalsContact OE2-CG2 3.27Å; E89-V552 WeakPolarHBondContact OE2-CG2 3.48Å; E89-V552 PolarHBondContact OE2-N 3.32Å
90L91.2Very high90.8Very high0 Ų010.6 Ų10.60%05%0.051CC..Hα-helixtrans-68.5-41.3-177.2-59.3-170.8000112.8C86 Y87 S92 R93 I94 Y103 V408 N411 V412 L415C86-L90 PolarHBondContact O-N 3.49Å; Y87-L90 PolarHBondContact O-N 3.44Å; L90-S92 VanDerWaalsContact C-N 3.31Å; L90-S92 PolarHBondContact O-N 2.99Å; L90-R93 PolarHBondContact O-N 2.88Å; L90-R93 VanDerWaalsContact O-N 3.13Å; L90-I94 PolarHBondContact O-N 3.33Å; L90-Y103 HydrophobicContact CB-CD1 3.91Å; L90-Y103 HydrophobicContact CB-CD2 3.65Å; L90-Y103 HydrophobicContact CB-CE1 4.14Å; L90-Y103 HydrophobicContact CB-CE2 3.9Å; L90-Y103 HydrophobicContact CB-CG 3.69Å; L90-Y103 HydrophobicContact CD1-CD2 3.9Å; L90-Y103 HydrophobicContact CD1-CG 3.91Å; L90-Y103 HydrophobicContact CG-CD2 4.42Å; L90-Y103 HydrophobicContact CG-CG 4.42Å; L90-V408 HydrophobicContact CD1-CG1 3.86Å; L90-N411 HydrophobicContact CD1-CB 3.87Å; L90-V412 HydrophobicContact CD1-CG2 3.96Å; L90-V412 HydrophobicContact CD2-CG2 3.86Å; L90-V412 HydrophobicContact CG-CG2 3.72Å; L90-L415 HydrophobicContact CD2-CD1 3.59Å
91G88.9Confident90.7Very high0 Ų010.6 Ų10.60%05%0.051CC..Hα-helixtrans-67.8-29.2177.800000113.8Y87 R93 Y103Y87-G91 PolarHBondContact O-N 3.45Å; G91-R93 VanDerWaalsContact C-N 3.35Å; G91-Y103 WeakPolarHBondContact CA-OH 3.3Å
92S88.9Confident90.4Very high3 Ų36.9 Ų6.92%0.0213%0.034CC..Hα-helixtrans-75.3-24.9172.675.30000113.3A88 E89 L90A88-S92 WeakPolarHBondContact O-CB 3.25Å; A88-S92 PolarHBondContact O-N 2.87Å; A88-S92 PolarHBondContact O-OG 3.35Å; A88-S92 VanDerWaalsContact O-OG 3.11Å; E89-S92 PolarHBondContact O-N 3.44Å; E89-S92 PolarHBondContact O-OG 3.06Å; L90-S92 VanDerWaalsContact C-N 3.31Å; L90-S92 PolarHBondContact O-N 2.99Å
93R84.5Confident90.1Very high41 Ų415.7 Ų5.716%0.1553%0.028CC..Hα-helixtrans-89.6-38.8-179.2-76.7-179-176.5168.812.7113.7E89 L90 G91 P95 F547 S549E89-R93 VanDerWaalsContact CD-CZ 3.48Å; E89-R93 VanDerWaalsContact CG-CZ 3.45Å; E89-R93 WeakPolarHBondContact O-CB 3.41Å; E89-R93 VanDerWaalsContact O-CG 3.3Å; E89-R93 WeakPolarHBondContact O-CG 3.5Å; E89-R93 PolarHBondContact O-N 2.86Å; E89-R93 IonicContact OE1-CZ 2.82Å; E89-R93 IonicContact OE1-NE 3.43Å; E89-R93 IonicContact OE1-NH1 3.9Å; E89-R93 PolarHBondContact OE1-NH1 2.96Å; E89-R93 IonicContact OE1-NH2 2.76Å; E89-R93 PolarHBondContact OE1-NH2 3.47Å; E89-R93 IonicContact OE2-NH2 3.45Å; L90-R93 PolarHBondContact O-N 2.88Å; L90-R93 VanDerWaalsContact O-N 3.13Å; G91-R93 VanDerWaalsContact C-N 3.35Å; R93-P95 VanDerWaalsContact C-CD 3.48Å; R93-P95 VanDerWaalsContact O-CD 3.29Å; R93-P95 WeakPolarHBondContact O-CD 3.46Å; R93-F547 VanDerWaalsContact CZ-CE2 3.4Å; R93-F547 VanDerWaalsContact NH1-CE2 3.31Å; R93-S549 VanDerWaalsContact CG-OG 3.23Å; R93-S549 WeakPolarHBondContact CG-OG 3.29Å
94I85.8Confident90Very high11 Ų115.7 Ų5.76%0.0563%0.028CC..  trans-119.779-174.6-53.3166.4000106.8F22 L90 K96 T102 Y103 V106 L415F22-I94 HydrophobicContact CD2-CG2 4.24Å; F22-I94 HydrophobicContact CE2-CG2 3.65Å; F22-I94 HydrophobicContact CZ-CG2 4.31Å; L90-I94 PolarHBondContact O-N 3.33Å; I94-K96 HydrophobicContact CG2-CB 4.41Å; I94-K96 PolarHBondContact O-N 3.44Å; I94-T102 HydrophobicContact CG2-CG2 3.93Å; I94-Y103 HydrophobicContact CB-CD1 3.96Å; I94-Y103 HydrophobicContact CB-CE1 4Å; I94-Y103 HydrophobicContact CD1-CD1 3.87Å; I94-Y103 HydrophobicContact CG1-CD1 4.47Å; I94-Y103 HydrophobicContact CG2-CD1 4.3Å; I94-Y103 HydrophobicContact CG2-CE1 4.45Å; I94-V106 HydrophobicContact CD1-CB 4.04Å; I94-V106 HydrophobicContact CD1-CG1 4.13Å; I94-V106 HydrophobicContact CD1-CG2 4.1Å; I94-V106 HydrophobicContact CG2-CG2 4.47Å; I94-L415 HydrophobicContact CD1-CD1 4.29Å
95P82.9Confident89.7Confident15 Ų155.7 Ų5.710%0.0973%0.028CC..  trans-80.156.1-175.936.1-37.8000111.2L27 R93 E262 P267L27-P95 HydrophobicContact CD2-CG 3.84Å; R93-P95 VanDerWaalsContact C-CD 3.48Å; R93-P95 VanDerWaalsContact O-CD 3.29Å; R93-P95 WeakPolarHBondContact O-CD 3.46Å; P95-E262 WeakPolarHBondContact O-CA 3.46Å; P95-P267 HydrophobicContact CB-CB 3.69Å; P95-P267 HydrophobicContact CB-CG 3.6Å; P95-P267 HydrophobicContact CG-CG 4.31Å
96K82.1Confident89.2Confident17 Ų175 Ų57%0.0743%0.025CC..SBendtrans-120.3147.1176.1-78.2-67.6-173.7179.80109.3F22 N26 D28 I94 T102 S261 E262F22-K96 HydrophobicContact CD1-CG 4.46Å; F22-K96 HydrophobicContact CE1-CD 4.36Å; F22-K96 HydrophobicContact CE1-CG 3.66Å; F22-K96 HydrophobicContact CZ-CB 4.21Å; F22-K96 HydrophobicContact CZ-CG 3.76Å; N26-K96 VanDerWaalsContact O-CE 3.23Å; N26-K96 WeakPolarHBondContact O-CE 3.45Å; N26-K96 PolarHBondContact O-NZ 3.2Å; D28-K96 PolarHBondContact O-NZ 3.23Å; I94-K96 HydrophobicContact CG2-CB 4.41Å; I94-K96 PolarHBondContact O-N 3.44Å; K96-T102 HydrophobicContact CB-CG2 4.04Å; K96-S261 PolarHBondContact N-OG 2.87Å; K96-S261 PolarHBondContact O-OG 2.97Å; K96-E262 WeakPolarHBondContact CD-OE1 3.49Å; K96-E262 IonicContact NZ-OE1 3.97Å; K96-E262 PolarHBondContact NZ-OE1 3.19Å
97S81.3Confident88.8Confident4 Ų45.9 Ų5.93%0.0283%0.032CC..THydrogen-bonded Turntrans-64.7160.5177.2-159.50000111.7T102 V259 E262S97-T102 PolarHBondContact O-OG1 2.66Å; S97-V259 PolarHBondContact OG-O 3.12Å; S97-E262 WeakPolarHBondContact CB-OE2 3.5Å; S97-E262 PolarHBondContact N-OE2 3.18Å
98G84Confident88.4Confident0 Ų07.4 Ų7.40%04%0.043CC..THydrogen-bonded Turntrans105.1-10.1-178.500000115.4A100 Y101G98-A100 PolarHBondContact O-N 3.06Å; G98-Y101 WeakPolarHBondContact O-CB 3.4Å; G98-Y101 PolarHBondContact O-N 3.19Å
99S91.7Very high88Confident0 Ų07.3 Ų7.30%04%0.042CC..THydrogen-bonded Turntrans51.7-125.1172.9-178.10000112.6Y87 Y101 T102 Y103 T258Y87-S99 WeakPolarHBondContact CE1-OG 3.38Å; S99-Y101 PolarHBondContact O-N 3.39Å; S99-T102 PolarHBondContact O-N 3.44Å; S99-T102 VanDerWaalsContact O-N 3.09Å; S99-Y103 VanDerWaalsContact C-CE2 3.46Å; S99-Y103 WeakPolarHBondContact O-CD1 3.33Å; S99-Y103 VanDerWaalsContact O-CD2 3.24Å; S99-Y103 WeakPolarHBondContact O-CD2 3.39Å; S99-Y103 WeakPolarHBondContact O-CE2 3.45Å; S99-Y103 PolarHBondContact O-N 3.01Å; S99-T258 WeakPolarHBondContact CB-OG1 3.35Å; S99-T258 PolarHBondContact OG-OG1 2.85Å
100A93.3Very high87.8Confident0 Ų07.3 Ų7.30%04%0.042CC..Hα-helixtrans-57.2-33.2-175.200000113.5Y87 G98 T104 V116 M120 A404 V408Y87-A100 HydrophobicContact CE1-CB 4.18Å; Y87-A100 WeakPolarHBondContact OH-CB 3.39Å; G98-A100 PolarHBondContact O-N 3.06Å; A100-T104 VanDerWaalsContact O-CB 3.25Å; A100-T104 WeakPolarHBondContact O-CB 3.44Å; A100-T104 PolarHBondContact O-N 3.01Å; A100-T104 PolarHBondContact O-OG1 2.99Å; A100-V116 HydrophobicContact CB-CG1 3.63Å; A100-M120 HydrophobicContact CB-CE 4.33Å; A100-M120 HydrophobicContact CB-SD 3.7Å; A100-A404 HydrophobicContact CB-CB 4.48Å; A100-V408 HydrophobicContact CB-CG2 3.45Å; A100-V408 VanDerWaalsContact CB-CG2 3.45Å
101Y93.4Very high87.8Confident0 Ų09.7 Ų9.70%05%0.053CC..Hα-helixtrans-56.7-57.2172.8161.6-103.3000110.9G98 S99 Y103 T104 Y105 A113 A349 M350 D353 L355G98-Y101 WeakPolarHBondContact O-CB 3.4Å; G98-Y101 PolarHBondContact O-N 3.19Å; S99-Y101 PolarHBondContact O-N 3.39Å; Y101-Y103 VanDerWaalsContact C-N 3.33Å; Y101-Y103 PolarHBondContact O-N 3.3Å; Y101-T104 PolarHBondContact O-N 2.88Å; Y101-T104 VanDerWaalsContact O-N 3.15Å; Y101-Y105 HydrophobicContact CE1-CD1 4.45Å; Y101-Y105 AromaticContact CE2-CD1 3.91Å; Y101-Y105 HydrophobicContact CE2-CD1 3.91Å; Y101-Y105 AromaticContact CZ-CD1 3.64Å; Y101-Y105 PolarHBondContact O-N 3.02Å; Y101-Y105 VanDerWaalsContact OH-CD1 3.25Å; Y101-Y105 WeakPolarHBondContact OH-CD1 3.32Å; Y101-Y105 WeakPolarHBondContact OH-CE1 3.2Å; Y101-A113 HydrophobicContact CD2-CB 3.96Å; Y101-A113 VanDerWaalsContact CD2-O 3.31Å; Y101-A113 WeakPolarHBondContact CD2-O 3.41Å; Y101-A113 HydrophobicContact CE2-CB 3.89Å; Y101-A349 HydrophobicContact CD1-CB 4.08Å; Y101-A349 HydrophobicContact CE1-CB 4.09Å; Y101-M350 HydrophobicContact CD1-CG 4.06Å; Y101-M350 HydrophobicContact CD2-CG 3.76Å; Y101-M350 HydrophobicContact CD2-SD 4.46Å; Y101-M350 HydrophobicContact CE1-CG 3.99Å; Y101-M350 HydrophobicContact CE2-CG 3.7Å; Y101-M350 HydrophobicContact CG-CG 3.95Å; Y101-D353 VanDerWaalsContact CE1-OD2 3.29Å; Y101-D353 WeakPolarHBondContact CE1-OD2 3.44Å; Y101-D353 VanDerWaalsContact OH-CB 3.24Å; Y101-D353 WeakPolarHBondContact OH-CB 3.28Å; Y101-D353 PolarHBondContact OH-OD2 2.91Å; Y101-L355 HydrophobicContact CE2-CD1 3.67Å; Y101-L355 VanDerWaalsContact OH-CD1 3.3Å; Y101-L355 WeakPolarHBondContact OH-CD1 3.46Å
102T89.9Confident87.8Confident0 Ų013.1 Ų13.10%07%0.071CC..Hα-helixtrans-64-40.4-176.1-54.30000111.1F22 I94 K96 S97 S99 T104 Y105 V106F22-T102 HydrophobicContact CE2-CG2 4.26Å; F22-T102 HydrophobicContact CZ-CG2 4.04Å; I94-T102 HydrophobicContact CG2-CG2 3.93Å; K96-T102 HydrophobicContact CB-CG2 4.04Å; S97-T102 PolarHBondContact O-OG1 2.66Å; S99-T102 PolarHBondContact O-N 3.44Å; S99-T102 VanDerWaalsContact O-N 3.09Å; T102-T104 VanDerWaalsContact C-N 3.33Å; T102-T104 PolarHBondContact O-N 3.16Å; T102-Y105 PolarHBondContact O-N 3.06Å; T102-V106 WeakPolarHBondContact O-CG2 3.34Å; T102-V106 PolarHBondContact O-N 3.03Å; T102-V106 VanDerWaalsContact O-N 3.09Å
103Y90.5Very high88Confident0 Ų013 Ų130%07%0.07CC..Hα-helixtrans-61.9-42.3175.9-53.2-25.9000112.1Y87 L90 G91 I94 S99 Y101 V106 A107 T258 V408Y87-Y103 HydrophobicContact CD1-CE2 4.08Å; Y87-Y103 HydrophobicContact CE1-CE2 4.37Å; L90-Y103 HydrophobicContact CB-CD1 3.91Å; L90-Y103 HydrophobicContact CB-CD2 3.65Å; L90-Y103 HydrophobicContact CB-CE1 4.14Å; L90-Y103 HydrophobicContact CB-CE2 3.9Å; L90-Y103 HydrophobicContact CB-CG 3.69Å; L90-Y103 HydrophobicContact CD1-CD2 3.9Å; L90-Y103 HydrophobicContact CD1-CG 3.91Å; L90-Y103 HydrophobicContact CG-CD2 4.42Å; L90-Y103 HydrophobicContact CG-CG 4.42Å; G91-Y103 WeakPolarHBondContact CA-OH 3.3Å; I94-Y103 HydrophobicContact CB-CD1 3.96Å; I94-Y103 HydrophobicContact CB-CE1 4Å; I94-Y103 HydrophobicContact CD1-CD1 3.87Å; I94-Y103 HydrophobicContact CG1-CD1 4.47Å; I94-Y103 HydrophobicContact CG2-CD1 4.3Å; I94-Y103 HydrophobicContact CG2-CE1 4.45Å; S99-Y103 VanDerWaalsContact C-CE2 3.46Å; S99-Y103 WeakPolarHBondContact O-CD1 3.33Å; S99-Y103 VanDerWaalsContact O-CD2 3.24Å; S99-Y103 WeakPolarHBondContact O-CD2 3.39Å; S99-Y103 WeakPolarHBondContact O-CE2 3.45Å; S99-Y103 PolarHBondContact O-N 3.01Å; Y101-Y103 VanDerWaalsContact C-N 3.33Å; Y101-Y103 PolarHBondContact O-N 3.3Å; Y103-V106 PolarHBondContact O-N 2.84Å; Y103-A107 WeakPolarHBondContact O-CB 3.34Å; Y103-A107 PolarHBondContact O-N 3.39Å; Y103-T258 VanDerWaalsContact OH-CB 3.3Å; Y103-T258 WeakPolarHBondContact OH-CB 3.43Å; Y103-V408 HydrophobicContact CD2-CG2 4.35Å
104T92.1Very high88.5Confident0 Ų011.1 Ų11.10%06%0.063CC..Hα-helixtrans-69.6-35.5178.6-54.10000111.2A100 Y101 T102 V106 A107 S108 G109 L112 A113 V116 I407 N411A100-T104 VanDerWaalsContact O-CB 3.25Å; A100-T104 WeakPolarHBondContact O-CB 3.44Å; A100-T104 PolarHBondContact O-N 3.01Å; A100-T104 PolarHBondContact O-OG1 2.99Å; Y101-T104 PolarHBondContact O-N 2.88Å; Y101-T104 VanDerWaalsContact O-N 3.15Å; T102-T104 VanDerWaalsContact C-N 3.33Å; T102-T104 PolarHBondContact O-N 3.16Å; T104-V106 PolarHBondContact O-N 3.26Å; T104-A107 PolarHBondContact O-N 3.09Å; T104-S108 CarbonylContact O-C 3.58Å; T104-S108 WeakPolarHBondContact O-CA 3.45Å; T104-S108 WeakPolarHBondContact O-CB 3.34Å; T104-S108 PolarHBondContact O-N 2.83Å; T104-G109 PolarHBondContact O-N 3.11Å; T104-L112 HydrophobicContact CG2-CB 3.79Å; T104-A113 HydrophobicContact CG2-CB 4.33Å; T104-V116 HydrophobicContact CG2-CG2 4.13Å; T104-I407 HydrophobicContact CG2-CG2 3.69Å; T104-N411 VanDerWaalsContact CA-ND2 3.26Å; T104-N411 WeakPolarHBondContact CA-ND2 3.38Å; T104-N411 PolarHBondContact N-ND2 3.46Å; T104-N411 PolarHBondContact OG1-ND2 3.45Å
105Y90.2Very high88.8Confident0 Ų011.8 Ų11.80%07%0.066CC..Hα-helixtrans-62.3-45.5175.6-151.3133.4000110.8R18 S19 R20 Y101 T102 G109 E110 A113 D353 L355 S600 H602R18-Y105 WeakPolarHBondContact O-CE2 3.45Å; S19-Y105 WeakPolarHBondContact CA-O 3.46Å; R20-Y105 HydrophobicContact CB-CD2 3.56Å; R20-Y105 HydrophobicContact CB-CE2 4.01Å; R20-Y105 HydrophobicContact CB-CG 4.08Å; R20-Y105 VanDerWaalsContact N-CD2 3.32Å; Y101-Y105 HydrophobicContact CE1-CD1 4.45Å; Y101-Y105 AromaticContact CE2-CD1 3.91Å; Y101-Y105 HydrophobicContact CE2-CD1 3.91Å; Y101-Y105 AromaticContact CZ-CD1 3.64Å; Y101-Y105 PolarHBondContact O-N 3.02Å; Y101-Y105 VanDerWaalsContact OH-CD1 3.25Å; Y101-Y105 WeakPolarHBondContact OH-CD1 3.32Å; Y101-Y105 WeakPolarHBondContact OH-CE1 3.2Å; T102-Y105 PolarHBondContact O-N 3.06Å; Y105-G109 WeakPolarHBondContact O-CA 3.19Å; Y105-G109 PolarHBondContact O-N 3.42Å; Y105-E110 HydrophobicContact CE1-CB 4.45Å; Y105-E110 HydrophobicContact CE1-CG 4.2Å; Y105-E110 HydrophobicContact CE2-CB 4.04Å; Y105-E110 PolarHBondContact OH-OE2 3.27Å; Y105-A113 HydrophobicContact CD1-CB 3.88Å; Y105-A113 HydrophobicContact CG-CB 3.91Å; Y105-D353 HydrophobicContact CE1-CB 4.12Å; Y105-L355 HydrophobicContact CD1-CD1 4.44Å; Y105-L355 HydrophobicContact CE1-CD1 3.94Å; Y105-S600 PolarHBondContact OH-OG 2.89Å; Y105-H602 AromaticContact CZ-ND1 3.85Å; Y105-H602 PolarHBondContact OH-ND1 3.18Å
106V85.4Confident89.4Confident9 Ų911.1 Ų11.16%0.0556%0.062CC..Hα-helixtrans-66.1-44.7178.3177.60000111.8R20 F22 I94 T102 Y103 T104 L415 L422R20-V106 HydrophobicContact CB-CG2 4.32Å; F22-V106 HydrophobicContact CD2-CG2 3.77Å; F22-V106 HydrophobicContact CE2-CG2 3.37Å; F22-V106 HydrophobicContact CZ-CG2 4.5Å; I94-V106 HydrophobicContact CD1-CB 4.04Å; I94-V106 HydrophobicContact CD1-CG1 4.13Å; I94-V106 HydrophobicContact CD1-CG2 4.1Å; I94-V106 HydrophobicContact CG2-CG2 4.47Å; T102-V106 WeakPolarHBondContact O-CG2 3.34Å; T102-V106 PolarHBondContact O-N 3.03Å; T102-V106 VanDerWaalsContact O-N 3.09Å; Y103-V106 PolarHBondContact O-N 2.84Å; T104-V106 PolarHBondContact O-N 3.26Å; V106-L415 HydrophobicContact CG1-CD2 4.18Å; V106-L422 HydrophobicContact CG1-CD1 4.11Å
107A87.3Confident89.9Confident19 Ų1910.3 Ų10.316%0.1576%0.058CC..Hα-helixtrans-86.6-45-17100000114Y103 T104 N411 I414 L415Y103-A107 WeakPolarHBondContact O-CB 3.34Å; Y103-A107 PolarHBondContact O-N 3.39Å; T104-A107 PolarHBondContact O-N 3.09Å; A107-N411 HydrophobicContact CB-CB 3.68Å; A107-I414 HydrophobicContact CB-CG2 4.34Å; A107-I414 WeakPolarHBondContact O-CG2 3.34Å; A107-L415 HydrophobicContact CB-CD1 4.08Å; A107-L415 HydrophobicContact CB-CD2 3.92Å; A107-L415 HydrophobicContact CB-CG 3.74Å
108S86.2Confident90.6Very high34 Ų3410.9 Ų10.924%0.2386%0.06CC..Hα-helixtrans-116.3-11.3-166.1-67.40000113.7T104 N411 I414T104-S108 CarbonylContact O-C 3.58Å; T104-S108 WeakPolarHBondContact O-CA 3.45Å; T104-S108 WeakPolarHBondContact O-CB 3.34Å; T104-S108 PolarHBondContact O-N 2.83Å; S108-N411 PolarHBondContact OG-OD1 2.99Å; S108-I414 WeakPolarHBondContact OG-CD1 3.35Å
109G86.3Confident91Very high1 Ų110.9 Ų10.91%0.016%0.06CC..  trans95.6175.117600000114.9R18 T104 Y105 F111 A113R18-G109 CarbonylContact O-C 3.49Å; R18-G109 VanDerWaalsContact O-CA 3.29Å; R18-G109 WeakPolarHBondContact O-CA 3.45Å; T104-G109 PolarHBondContact O-N 3.11Å; Y105-G109 WeakPolarHBondContact O-CA 3.19Å; Y105-G109 PolarHBondContact O-N 3.42Å; G109-F111 PolarHBondContact O-N 3.36Å; G109-A113 VanDerWaalsContact O-CB 3.31Å; G109-A113 WeakPolarHBondContact O-CB 3.33Å; G109-A113 PolarHBondContact O-N 2.85Å
110E88.9Confident91.1Very high0 Ų011 Ų110%06%0.06CC..Hα-helixtrans-58.1-46.6-168.3-175175.8121.100114.1M16 R18 Y105 A113 F114 L355 Y592 S600M16-E110 PolarHBondContact O-N 2.9Å; R18-E110 HydrophobicContact CB-CB 4.22Å; R18-E110 WeakPolarHBondContact CD-OE2 3.36Å; R18-E110 WeakPolarHBondContact O-CB 3.34Å; R18-E110 PolarHBondContact O-N 3.23Å; Y105-E110 HydrophobicContact CE1-CB 4.45Å; Y105-E110 HydrophobicContact CE1-CG 4.2Å; Y105-E110 HydrophobicContact CE2-CB 4.04Å; Y105-E110 PolarHBondContact OH-OE2 3.27Å; E110-A113 WeakPolarHBondContact O-CB 3.46Å; E110-A113 PolarHBondContact O-N 2.91Å; E110-F114 PolarHBondContact O-N 3.23Å; E110-L355 HydrophobicContact CG-CD1 4.37Å; E110-L355 HydrophobicContact CG-CD2 3.68Å; E110-Y592 HydrophobicContact CG-CE2 4.28Å; E110-Y592 PolarHBondContact OE1-OH 3.39Å; E110-S600 VanDerWaalsContact CD-OG 3.31Å; E110-S600 WeakPolarHBondContact OE1-CB 3.3Å; E110-S600 WeakPolarHBondContact OE2-CB 3.45Å; E110-S600 PolarHBondContact OE2-OG 3.43Å
111F89.3Confident91.1Very high50 Ų5011 Ų1122%0.2196%0.06CC..Hα-helixtrans-67.1-47.1-173.9177.7-106.9000112.7M16 G109 A113 F114 I115 L589 Y592 F593M16-F111 HydrophobicContact CB-CB 3.7Å; M16-F111 HydrophobicContact CB-CG 4.4Å; M16-F111 HydrophobicContact CG-CB 3.83Å; M16-F111 HydrophobicContact CG-CD2 4.23Å; M16-F111 HydrophobicContact CG-CG 4.14Å; M16-F111 PolarHBondContact O-N 3.48Å; M16-F111 HydrophobicContact SD-CB 4.26Å; M16-F111 HydrophobicContact SD-CD1 4.43Å; M16-F111 HydrophobicContact SD-CD2 3.87Å; M16-F111 HydrophobicContact SD-CE2 4.3Å; M16-F111 HydrophobicContact SD-CG 3.93Å; G109-F111 PolarHBondContact O-N 3.36Å; F111-A113 VanDerWaalsContact C-N 3.29Å; F111-F114 PolarHBondContact O-N 3.13Å; F111-I115 HydrophobicContact CD1-CD1 4.04Å; F111-I115 HydrophobicContact CE1-CD1 3.48Å; F111-I115 VanDerWaalsContact CE1-CD1 3.48Å; F111-I115 HydrophobicContact CE2-CD1 4.35Å; F111-I115 HydrophobicContact CZ-CD1 3.66Å; F111-I115 HydrophobicContact CZ-CG1 4.49Å; F111-I115 PolarHBondContact O-N 3.49Å; F111-I115 VanDerWaalsContact O-N 3.11Å; F111-L589 HydrophobicContact CE2-CD2 3.64Å; F111-L589 HydrophobicContact CZ-CD2 3.88Å; F111-Y592 HydrophobicContact CD2-CD1 4.15Å; F111-Y592 AromaticContact CD2-CE1 3.68Å; F111-Y592 HydrophobicContact CD2-CE1 3.68Å; F111-Y592 HydrophobicContact CE2-CD1 4.4Å; F111-Y592 HydrophobicContact CE2-CE1 4.3Å; F111-F593 HydrophobicContact CE2-CE2 4.33Å; F111-F593 HydrophobicContact CE2-CZ 4.02Å
112L90.5Very high91.1Very high71 Ų7111.2 Ų11.237%0.3726%0.062SC..Hα-helixtrans-66.6-36.2175.7-77.9174000110.9T104 F114 I115 V116T104-L112 HydrophobicContact CG2-CB 3.79Å; L112-F114 VanDerWaalsContact C-N 3.35Å; L112-F114 PolarHBondContact O-N 3.26Å; L112-I115 PolarHBondContact O-N 3.12Å; L112-V116 WeakPolarHBondContact O-CG2 3.34Å; L112-V116 PolarHBondContact O-N 2.94Å
113A92.6Very high91.2Very high0 Ų011.5 Ų11.50%06%0.063CC..Hα-helixtrans-59.1-47.2173.200000111.1Y101 T104 Y105 G109 E110 F111 I115 V116 G117Y101-A113 HydrophobicContact CD2-CB 3.96Å; Y101-A113 VanDerWaalsContact CD2-O 3.31Å; Y101-A113 WeakPolarHBondContact CD2-O 3.41Å; Y101-A113 HydrophobicContact CE2-CB 3.89Å; T104-A113 HydrophobicContact CG2-CB 4.33Å; Y105-A113 HydrophobicContact CD1-CB 3.88Å; Y105-A113 HydrophobicContact CG-CB 3.91Å; G109-A113 VanDerWaalsContact O-CB 3.31Å; G109-A113 WeakPolarHBondContact O-CB 3.33Å; G109-A113 PolarHBondContact O-N 2.85Å; E110-A113 WeakPolarHBondContact O-CB 3.46Å; E110-A113 PolarHBondContact O-N 2.91Å; F111-A113 VanDerWaalsContact C-N 3.29Å; A113-I115 PolarHBondContact O-N 2.89Å; A113-V116 PolarHBondContact O-N 3.33Å; A113-G117 PolarHBondContact O-N 3.21Å
114F93.8Very high91.3Very high2 Ų211.6 Ų11.61%0.0096%0.064CC..Hα-helixtrans-57.4-46.9176.8-179.1-90000112.1E110 F111 L112 V116 G117 W118 M350 L355 L356 G588 Y592E110-F114 PolarHBondContact O-N 3.23Å; F111-F114 PolarHBondContact O-N 3.13Å; L112-F114 VanDerWaalsContact C-N 3.35Å; L112-F114 PolarHBondContact O-N 3.26Å; F114-V116 VanDerWaalsContact C-N 3.32Å; F114-V116 PolarHBondContact O-N 2.88Å; F114-G117 PolarHBondContact O-N 3.47Å; F114-W118 HydrophobicContact CD1-CB 4.42Å; F114-W118 HydrophobicContact CE1-CB 3.99Å; F114-W118 HydrophobicContact CE1-CG 4.2Å; F114-W118 HydrophobicContact CZ-CB 4.23Å; F114-W118 HydrophobicContact CZ-CD2 4.29Å; F114-W118 HydrophobicContact CZ-CE3 4.21Å; F114-W118 HydrophobicContact CZ-CG 4.3Å; F114-W118 WeakPolarHBondContact O-CB 3.23Å; F114-W118 PolarHBondContact O-N 3.3Å; F114-M350 HydrophobicContact CD2-CE 3.7Å; F114-M350 HydrophobicContact CE2-CE 3.91Å; F114-M350 HydrophobicContact CG-CE 4.46Å; F114-L355 HydrophobicContact CB-CD1 4.29Å; F114-L355 HydrophobicContact CD2-CB 4.12Å; F114-L355 HydrophobicContact CD2-CD1 4.32Å; F114-L356 HydrophobicContact CE2-CD2 4.16Å; F114-G588 VanDerWaalsContact CE1-C 3.5Å; F114-G588 WeakPolarHBondContact CE1-O 3.47Å; F114-G588 WeakPolarHBondContact CZ-O 3.36Å; F114-Y592 HydrophobicContact CB-CD2 3.78Å; F114-Y592 HydrophobicContact CB-CE2 4Å; F114-Y592 AromaticContact CD1-CD2 3.93Å; F114-Y592 HydrophobicContact CD1-CD2 3.93Å; F114-Y592 HydrophobicContact CD1-CG 4.03Å; F114-Y592 AromaticContact CD2-CD2 3.65Å; F114-Y592 HydrophobicContact CD2-CD2 3.65Å; F114-Y592 HydrophobicContact CD2-CG 4.38Å; F114-Y592 HydrophobicContact CE1-CG 4.37Å; F114-Y592 HydrophobicContact CE2-CD2 4.23Å; F114-Y592 AromaticContact CG-CD2 3.46Å; F114-Y592 HydrophobicContact CG-CD2 3.46Å; F114-Y592 VanDerWaalsContact CG-CD2 3.46Å; F114-Y592 HydrophobicContact CG-CE2 4.2Å; F114-Y592 HydrophobicContact CG-CG 4.05Å
115I93.5Very high91.4Very high26 Ų2611.7 Ų11.713%0.1336%0.064CC..Hα-helixtrans-58.2-46177.8-69.8171000110.8F111 L112 A113 S119 L585 L589F111-I115 HydrophobicContact CD1-CD1 4.04Å; F111-I115 HydrophobicContact CE1-CD1 3.48Å; F111-I115 VanDerWaalsContact CE1-CD1 3.48Å; F111-I115 HydrophobicContact CE2-CD1 4.35Å; F111-I115 HydrophobicContact CZ-CD1 3.66Å; F111-I115 HydrophobicContact CZ-CG1 4.49Å; F111-I115 PolarHBondContact O-N 3.49Å; F111-I115 VanDerWaalsContact O-N 3.11Å; L112-I115 PolarHBondContact O-N 3.12Å; A113-I115 PolarHBondContact O-N 2.89Å; I115-S119 WeakPolarHBondContact O-CB 3.49Å; I115-S119 PolarHBondContact O-N 2.51Å; I115-S119 PolarHBondContact O-OG 3.17Å; I115-L585 HydrophobicContact CG2-CD1 3.83Å; I115-L589 HydrophobicContact CG1-CD2 4.5Å
116V94.1Very high91.5Very high1 Ų111.8 Ų11.81%0.0067%0.065CC..Hα-helixtrans-63.3-50.9177.8171.80000110.8A100 T104 L112 A113 F114 W118 S119 M120 A404 I407A100-V116 HydrophobicContact CB-CG1 3.63Å; T104-V116 HydrophobicContact CG2-CG2 4.13Å; L112-V116 WeakPolarHBondContact O-CG2 3.34Å; L112-V116 PolarHBondContact O-N 2.94Å; A113-V116 PolarHBondContact O-N 3.33Å; F114-V116 VanDerWaalsContact C-N 3.32Å; F114-V116 PolarHBondContact O-N 2.88Å; V116-W118 PolarHBondContact O-N 3.49Å; V116-S119 WeakPolarHBondContact O-CB 3.42Å; V116-S119 PolarHBondContact O-N 3.3Å; V116-S119 VanDerWaalsContact O-N 3.15Å; V116-M120 HydrophobicContact CG1-CG 4.36Å; V116-M120 HydrophobicContact CG1-SD 4.17Å; V116-M120 WeakPolarHBondContact O-CG 3.3Å; V116-M120 PolarHBondContact O-N 2.96Å; V116-A404 HydrophobicContact CG1-CB 4.24Å; V116-I407 HydrophobicContact CG2-CB 4.1Å; V116-I407 HydrophobicContact CG2-CD1 3.44Å; V116-I407 VanDerWaalsContact CG2-CD1 3.44Å; V116-I407 HydrophobicContact CG2-CG1 4.36Å; V116-I407 HydrophobicContact CG2-CG2 3.87Å
117G94.4Very high91.8Very high0 Ų011.9 Ų11.90%07%0.065CC..Hα-helixtrans-62-42.2-179.400000112.8A113 F114 S119 M120 I121 M350A113-G117 PolarHBondContact O-N 3.21Å; F114-G117 PolarHBondContact O-N 3.47Å; G117-S119 VanDerWaalsContact C-N 3.29Å; G117-S119 PolarHBondContact O-N 2.92Å; G117-M120 PolarHBondContact O-N 3.02Å; G117-I121 WeakPolarHBondContact O-CG1 3.17Å; G117-I121 PolarHBondContact O-N 3.27Å; G117-M350 VanDerWaalsContact CA-SD 3.55Å
118W94.9Very high92.1Very high15 Ų1511 Ų116%0.0576%0.058CC..Hα-helixtrans-65-34175.7-171.5-107.2000112.6F114 V116 I121 L122 L356 W584 I587 I591F114-W118 HydrophobicContact CD1-CB 4.42Å; F114-W118 HydrophobicContact CE1-CB 3.99Å; F114-W118 HydrophobicContact CE1-CG 4.2Å; F114-W118 HydrophobicContact CZ-CB 4.23Å; F114-W118 HydrophobicContact CZ-CD2 4.29Å; F114-W118 HydrophobicContact CZ-CE3 4.21Å; F114-W118 HydrophobicContact CZ-CG 4.3Å; F114-W118 WeakPolarHBondContact O-CB 3.23Å; F114-W118 PolarHBondContact O-N 3.3Å; V116-W118 PolarHBondContact O-N 3.49Å; W118-I121 HydrophobicContact CE3-CD1 4.21Å; W118-L122 PolarHBondContact O-N 3.41Å; W118-L356 HydrophobicContact CE3-CD2 4.36Å; W118-L356 HydrophobicContact CZ3-CD2 4.14Å; W118-W584 AromaticContact CD1-CD1 3.58Å; W118-W584 AromaticContact CD1-CE2 3.99Å; W118-W584 AromaticContact CD1-NE1 3.21Å; W118-W584 HydrophobicContact CD2-CZ2 4.33Å; W118-W584 AromaticContact CE2-CE2 3.53Å; W118-W584 AromaticContact CE2-CZ2 3.59Å; W118-W584 AromaticContact CE2-NE1 3.58Å; W118-W584 AromaticContact CG-NE1 3.91Å; W118-W584 HydrophobicContact CH2-CH2 4.28Å; W118-W584 HydrophobicContact CH2-CZ2 4.04Å; W118-W584 HydrophobicContact CZ2-CD2 4.44Å; W118-W584 AromaticContact CZ2-CE2 3.77Å; W118-W584 AromaticContact CZ2-CH2 3.8Å; W118-W584 HydrophobicContact CZ2-CH2 3.8Å; W118-W584 AromaticContact CZ2-CZ2 3.43Å; W118-W584 HydrophobicContact CZ2-CZ2 3.43Å; W118-W584 VanDerWaalsContact CZ2-CZ2 3.43Å; W118-W584 HydrophobicContact CZ2-CZ3 4.42Å; W118-W584 AromaticContact NE1-CD1 3.42Å; W118-W584 AromaticContact NE1-CD2 3.83Å; W118-W584 AromaticContact NE1-CE2 3.29Å; W118-W584 VanDerWaalsContact NE1-CE2 3.29Å; W118-W584 AromaticContact NE1-CG 3.9Å; W118-W584 AromaticContact NE1-CZ2 3.88Å; W118-W584 AromaticContact NE1-NE1 2.98Å; W118-W584 PolarHBondContact NE1-O 3.24Å; W118-W584 PolarHBondContact O-NE1 3.26Å; W118-I587 HydrophobicContact CZ2-CG2 4.16Å; W118-I591 HydrophobicContact CH2-CD1 3.45Å; W118-I591 VanDerWaalsContact CH2-CD1 3.45Å; W118-I591 HydrophobicContact CZ2-CD1 3.88Å; W118-I591 HydrophobicContact CZ3-CD1 4.06Å
119S93.1Very high92.4Very high1 Ų19.3 Ų9.31%0.0075%0.046CC..Hα-helixtrans-71.4-40.1173.7-56.70000111.6I115 V116 G117 I121 L122 E123I115-S119 WeakPolarHBondContact O-CB 3.49Å; I115-S119 PolarHBondContact O-N 2.51Å; I115-S119 PolarHBondContact O-OG 3.17Å; V116-S119 WeakPolarHBondContact O-CB 3.42Å; V116-S119 PolarHBondContact O-N 3.3Å; V116-S119 VanDerWaalsContact O-N 3.15Å; G117-S119 VanDerWaalsContact C-N 3.29Å; G117-S119 PolarHBondContact O-N 2.92Å; S119-I121 PolarHBondContact O-N 2.95Å; S119-L122 PolarHBondContact O-N 3.15Å; S119-E123 WeakPolarHBondContact O-CB 3.21Å; S119-E123 PolarHBondContact O-N 3.21Å
120M93.1Very high92.6Very high1 Ų19.3 Ų9.31%0.0055%0.046CC..Hα-helixtrans-63.8-37.5176-72.5179.880.500112.6A100 V116 G117 E123 Y124 V346A100-M120 HydrophobicContact CB-CE 4.33Å; A100-M120 HydrophobicContact CB-SD 3.7Å; V116-M120 HydrophobicContact CG1-CG 4.36Å; V116-M120 HydrophobicContact CG1-SD 4.17Å; V116-M120 WeakPolarHBondContact O-CG 3.3Å; V116-M120 PolarHBondContact O-N 2.96Å; G117-M120 PolarHBondContact O-N 3.02Å; M120-E123 WeakPolarHBondContact O-CB 3.28Å; M120-E123 PolarHBondContact O-N 2.93Å; M120-Y124 HydrophobicContact CE-CE2 4.07Å; M120-Y124 WeakPolarHBondContact O-CD2 3.35Å; M120-Y124 PolarHBondContact O-N 3.39Å; M120-V346 HydrophobicContact CB-CG1 4.15Å; M120-V346 HydrophobicContact CE-CG2 3.94Å; M120-V346 HydrophobicContact SD-CG1 4.39Å
121I94.2Very high92.7Very high0 Ų09.3 Ų9.30%05%0.046CC..Hα-helixtrans-59.9-49.2175.7-69.3167.5000110G117 W118 S119 E123 Y124 V125 V346 V347 M350 L356 F377G117-I121 WeakPolarHBondContact O-CG1 3.17Å; G117-I121 PolarHBondContact O-N 3.27Å; W118-I121 HydrophobicContact CE3-CD1 4.21Å; S119-I121 PolarHBondContact O-N 2.95Å; I121-E123 VanDerWaalsContact C-N 3.32Å; I121-E123 PolarHBondContact O-N 3.46Å; I121-Y124 PolarHBondContact O-N 3.44Å; I121-V125 WeakPolarHBondContact O-CG2 3.39Å; I121-V125 PolarHBondContact O-N 3.11Å; I121-V125 VanDerWaalsContact O-N 3.07Å; I121-V346 HydrophobicContact CG1-CG1 4.28Å; I121-V347 HydrophobicContact CD1-CG2 3.77Å; I121-V347 HydrophobicContact CG1-CG2 3.76Å; I121-V347 HydrophobicContact CG2-CG2 4.43Å; I121-M350 HydrophobicContact CD1-CE 4.5Å; I121-M350 HydrophobicContact CD1-SD 3.63Å; I121-M350 HydrophobicContact CG1-SD 4.38Å; I121-L356 HydrophobicContact CD1-CD1 3.97Å; I121-F377 HydrophobicContact CG2-CD1 3.66Å; I121-F377 HydrophobicContact CG2-CD2 4.38Å; I121-F377 HydrophobicContact CG2-CE1 3.37Å; I121-F377 HydrophobicContact CG2-CE2 4.14Å; I121-F377 HydrophobicContact CG2-CG 4.17Å; I121-F377 HydrophobicContact CG2-CZ 3.64Å
122L92.5Very high92.9Very high6 Ų66.9 Ų6.93%0.0314%0.036CC..Hα-helixtrans-61.5-43.3175.6176.669.7000111.6W118 S119 Y124 V125 L126 F396 W584W118-L122 PolarHBondContact O-N 3.41Å; S119-L122 PolarHBondContact O-N 3.15Å; L122-Y124 PolarHBondContact O-N 2.85Å; L122-V125 PolarHBondContact O-N 3.25Å; L122-V125 VanDerWaalsContact O-N 3.14Å; L122-L126 HydrophobicContact CD1-CD1 3.96Å; L122-L126 HydrophobicContact CD1-CD2 4.34Å; L122-L126 HydrophobicContact CD1-CG 3.91Å; L122-L126 HydrophobicContact CD2-CD1 4.09Å; L122-L126 HydrophobicContact CG-CD1 3.68Å; L122-L126 HydrophobicContact CG-CG 4.05Å; L122-L126 WeakPolarHBondContact O-CB 3.34Å; L122-L126 VanDerWaalsContact O-CG 3.28Å; L122-L126 WeakPolarHBondContact O-CG 3.3Å; L122-L126 PolarHBondContact O-N 3.42Å; L122-F396 HydrophobicContact CD1-CE1 4.18Å; L122-F396 HydrophobicContact CD1-CZ 4.39Å; L122-F396 HydrophobicContact CD2-CE1 4Å; L122-F396 HydrophobicContact CD2-CE2 3.84Å; L122-F396 HydrophobicContact CD2-CZ 3.45Å; L122-F396 VanDerWaalsContact CD2-CZ 3.45Å; L122-F396 HydrophobicContact CG-CZ 4.44Å; L122-W584 HydrophobicContact CB-CD2 4.2Å; L122-W584 HydrophobicContact CB-CG 4.33Å; L122-W584 HydrophobicContact CB-CZ2 3.95Å; L122-W584 VanDerWaalsContact CB-NE1 3.3Å; L122-W584 HydrophobicContact CD1-CD2 3.93Å; L122-W584 HydrophobicContact CD1-CE3 4.17Å; L122-W584 HydrophobicContact CD1-CG 4.31Å; L122-W584 HydrophobicContact CD1-CZ2 4.33Å; L122-W584 HydrophobicContact CD1-CZ3 4.47Å; L122-W584 HydrophobicContact CD2-CB 3.97Å; L122-W584 VanDerWaalsContact CD2-CD1 3.42Å; L122-W584 HydrophobicContact CD2-CD2 4.02Å; L122-W584 HydrophobicContact CD2-CG 3.52Å; L122-W584 HydrophobicContact CG-CD2 4.25Å; L122-W584 HydrophobicContact CG-CG 4.25Å
123E92.3Very high92.9Very high5 Ų54.5 Ų4.52%0.0232%0.022CC..Hα-helixtrans-53.6-54.5177.9-179-170.4152.200110.7S119 M120 I121 V125 L126 S127 L397 T401S119-E123 WeakPolarHBondContact O-CB 3.21Å; S119-E123 PolarHBondContact O-N 3.21Å; M120-E123 WeakPolarHBondContact O-CB 3.28Å; M120-E123 PolarHBondContact O-N 2.93Å; I121-E123 VanDerWaalsContact C-N 3.32Å; I121-E123 PolarHBondContact O-N 3.46Å; E123-V125 VanDerWaalsContact C-N 3.29Å; E123-V125 PolarHBondContact O-N 3.37Å; E123-L126 PolarHBondContact O-N 2.97Å; E123-S127 WeakPolarHBondContact O-CB 3.07Å; E123-S127 PolarHBondContact O-N 3.3Å; E123-L397 HydrophobicContact CB-CD1 4.04Å; E123-L397 HydrophobicContact CG-CD1 3.39Å; E123-L397 HydrophobicContact CG-CG 4.37Å; E123-L397 WeakPolarHBondContact O-CD1 3.34Å; E123-T401 WeakPolarHBondContact CG-OG1 3.21Å; E123-T401 PolarHBondContact OE1-OG1 2.93Å; E123-T401 WeakPolarHBondContact OE2-CA 3.43Å
124Y93.3Very high92.6Very high3 Ų35 Ų51%0.0123%0.026CC..Hα-helixtrans-63.6-35.4178.5-70.7-60.8000112.6M120 I121 L122 S127 V128 D255 A256 A342 M343 V346M120-Y124 HydrophobicContact CE-CE2 4.07Å; M120-Y124 WeakPolarHBondContact O-CD2 3.35Å; M120-Y124 PolarHBondContact O-N 3.39Å; I121-Y124 PolarHBondContact O-N 3.44Å; L122-Y124 PolarHBondContact O-N 2.85Å; Y124-S127 PolarHBondContact O-N 3.36Å; Y124-V128 WeakPolarHBondContact O-CB 3.09Å; Y124-V128 VanDerWaalsContact O-CG2 3.26Å; Y124-V128 WeakPolarHBondContact O-CG2 3.47Å; Y124-V128 PolarHBondContact O-N 3.31Å; Y124-D255 PolarHBondContact OH-OD2 3.43Å; Y124-A256 HydrophobicContact CE1-CB 4.42Å; Y124-A342 HydrophobicContact CD1-CB 4.11Å; Y124-A342 HydrophobicContact CE1-CB 3.6Å; Y124-A342 HydrophobicContact CE2-CB 4.06Å; Y124-M343 VanDerWaalsContact C-CE 3.48Å; Y124-M343 HydrophobicContact CD2-CB 4.37Å; Y124-M343 HydrophobicContact CG-CB 4.14Å; Y124-M343 WeakPolarHBondContact O-CE 3.42Å; Y124-V346 HydrophobicContact CD2-CG2 4.43Å; Y124-V346 HydrophobicContact CE2-CG2 3.87Å
125V94.2Very high92.5Very high1 Ų17.1 Ų7.11%0.0063%0.034CC..Hα-helixtrans-63.3-46.2176.6165.40000110.8I121 L122 E123 V128 S129 M343 F377 F380 A381 L384I121-V125 WeakPolarHBondContact O-CG2 3.39Å; I121-V125 PolarHBondContact O-N 3.11Å; I121-V125 VanDerWaalsContact O-N 3.07Å; L122-V125 PolarHBondContact O-N 3.25Å; L122-V125 VanDerWaalsContact O-N 3.14Å; E123-V125 VanDerWaalsContact C-N 3.29Å; E123-V125 PolarHBondContact O-N 3.37Å; V125-V128 PolarHBondContact O-N 3.24Å; V125-S129 WeakPolarHBondContact O-CB 3.48Å; V125-S129 PolarHBondContact O-N 2.9Å; V125-S129 PolarHBondContact O-OG 2.9Å; V125-M343 HydrophobicContact CB-CE 4.25Å; V125-M343 HydrophobicContact CG2-CE 3.65Å; V125-M343 HydrophobicContact CG2-SD 3.97Å; V125-F377 HydrophobicContact CG2-CB 3.88Å; V125-F377 HydrophobicContact CG2-CD1 4.03Å; V125-F377 HydrophobicContact CG2-CG 4.36Å; V125-F380 HydrophobicContact CG1-CD1 3.66Å; V125-F380 HydrophobicContact CG1-CE1 3.95Å; V125-F380 HydrophobicContact CG1-CG 4.31Å; V125-F380 HydrophobicContact CG2-CD1 4.31Å; V125-A381 HydrophobicContact CG1-CB 4.12Å; V125-L384 HydrophobicContact CG1-CD1 3.64Å
126L91.8Very high92.4Very high3 Ų36 Ų62%0.0163%0.029CC..Hα-helixtrans-66.2-39.2177.8-67.3174.3000111.5L122 E123 S129 S130 L384 L393 F396 L397L122-L126 HydrophobicContact CD1-CD1 3.96Å; L122-L126 HydrophobicContact CD1-CD2 4.34Å; L122-L126 HydrophobicContact CD1-CG 3.91Å; L122-L126 HydrophobicContact CD2-CD1 4.09Å; L122-L126 HydrophobicContact CG-CD1 3.68Å; L122-L126 HydrophobicContact CG-CG 4.05Å; L122-L126 WeakPolarHBondContact O-CB 3.34Å; L122-L126 VanDerWaalsContact O-CG 3.28Å; L122-L126 WeakPolarHBondContact O-CG 3.3Å; L122-L126 PolarHBondContact O-N 3.42Å; E123-L126 PolarHBondContact O-N 2.97Å; L126-S129 PolarHBondContact O-N 3.13Å; L126-S130 WeakPolarHBondContact O-CB 3.34Å; L126-S130 PolarHBondContact O-N 3.43Å; L126-S130 PolarHBondContact O-OG 3.45Å; L126-L384 HydrophobicContact CD2-CD1 4.16Å; L126-L393 HydrophobicContact CD2-CD2 3.5Å; L126-F396 HydrophobicContact CD1-CB 3.97Å; L126-F396 HydrophobicContact CD1-CD1 3.45Å; L126-F396 VanDerWaalsContact CD1-CD1 3.45Å; L126-F396 HydrophobicContact CD1-CD2 4.25Å; L126-F396 HydrophobicContact CD1-CE1 3.94Å; L126-F396 HydrophobicContact CD1-CG 3.62Å; L126-F396 HydrophobicContact CD2-CD1 3.68Å; L126-F396 HydrophobicContact CD2-CE1 4.2Å; L126-F396 HydrophobicContact CG-CD1 4.22Å; L126-L397 HydrophobicContact CB-CB 4.26Å; L126-L397 HydrophobicContact CB-CD1 3.96Å
127S91.4Very high92Very high10 Ų106.5 Ų6.57%0.073%0.034CC..Hα-helixtrans-61.7-48.7175.4174.20000111.3E123 Y124 S129 S130 V131 S339E123-S127 WeakPolarHBondContact O-CB 3.07Å; E123-S127 PolarHBondContact O-N 3.3Å; Y124-S127 PolarHBondContact O-N 3.36Å; S127-S129 PolarHBondContact O-N 3.02Å; S127-S130 PolarHBondContact O-N 3.19Å; S127-S130 PolarHBondContact O-OG 2.92Å; S127-S130 VanDerWaalsContact O-OG 3.07Å; S127-V131 WeakPolarHBondContact O-CB 3.34Å; S127-V131 WeakPolarHBondContact O-CG2 3.41Å; S127-V131 PolarHBondContact O-N 3.46Å; S127-V131 VanDerWaalsContact O-N 3.08Å; S127-S339 PolarHBondContact OG-OG 2.7Å
128V94.2Very high91.6Very high0 Ų06.7 Ų6.70%04%0.035CC..Hα-helixtrans-59.4-41174.8172.40000110.3Y124 V125 A132 I177 L336 M340 M343 A381Y124-V128 WeakPolarHBondContact O-CB 3.09Å; Y124-V128 VanDerWaalsContact O-CG2 3.26Å; Y124-V128 WeakPolarHBondContact O-CG2 3.47Å; Y124-V128 PolarHBondContact O-N 3.31Å; V125-V128 PolarHBondContact O-N 3.24Å; V128-A132 VanDerWaalsContact O-CB 3.29Å; V128-A132 WeakPolarHBondContact O-CB 3.39Å; V128-A132 PolarHBondContact O-N 3.48Å; V128-A132 VanDerWaalsContact O-N 3.11Å; V128-I177 HydrophobicContact CG1-CD1 3.76Å; V128-I177 HydrophobicContact CG1-CG1 3.76Å; V128-I177 HydrophobicContact CG1-CG2 4.1Å; V128-L336 HydrophobicContact CB-CD2 4.43Å; V128-L336 HydrophobicContact CG1-CD2 3.96Å; V128-L336 WeakPolarHBondContact O-CD2 3.4Å; V128-M340 HydrophobicContact CB-CG 4.33Å; V128-M340 HydrophobicContact CG1-CG 3.8Å; V128-M340 HydrophobicContact CG1-SD 4.18Å; V128-M340 HydrophobicContact CG2-CB 4.39Å; V128-M340 HydrophobicContact CG2-CG 3.46Å; V128-M340 VanDerWaalsContact CG2-CG 3.46Å; V128-M343 HydrophobicContact CB-CE 4.44Å; V128-M343 HydrophobicContact CG2-CE 3.86Å; V128-A381 HydrophobicContact CB-CB 4.08Å; V128-A381 HydrophobicContact CG1-CB 3.78Å
129S93.2Very high91.3Very high0 Ų07.5 Ų7.50%04%0.042CC..Hα-helixtrans-67.1-45.8-176.7-53.80000112.8V125 L126 S127 R133 A381 L384 T385V125-S129 WeakPolarHBondContact O-CB 3.48Å; V125-S129 PolarHBondContact O-N 2.9Å; V125-S129 PolarHBondContact O-OG 2.9Å; L126-S129 PolarHBondContact O-N 3.13Å; S127-S129 PolarHBondContact O-N 3.02Å; S129-R133 PolarHBondContact O-N 3.47Å; S129-A381 WeakPolarHBondContact OG-CA 3.27Å; S129-A381 PolarHBondContact OG-O 3.11Å; S129-L384 WeakPolarHBondContact OG-CB 3.41Å; S129-T385 WeakPolarHBondContact CA-OG1 3.5Å; S129-T385 PolarHBondContact O-OG1 2.93Å; S129-T385 VanDerWaalsContact O-OG1 3.13Å
130S89.3Confident91Very high0 Ų07.7 Ų7.70%04%0.043CC..Hα-helixtrans-69.5-42-177.862.10000112L126 S127 A132 R133 G134 Y249 I390L126-S130 WeakPolarHBondContact O-CB 3.34Å; L126-S130 PolarHBondContact O-N 3.43Å; L126-S130 PolarHBondContact O-OG 3.45Å; S127-S130 PolarHBondContact O-N 3.19Å; S127-S130 PolarHBondContact O-OG 2.92Å; S127-S130 VanDerWaalsContact O-OG 3.07Å; S130-A132 VanDerWaalsContact C-N 3.33Å; S130-A132 PolarHBondContact O-N 3.46Å; S130-R133 PolarHBondContact O-N 3.38Å; S130-G134 PolarHBondContact O-N 3.44Å; S130-Y249 WeakPolarHBondContact CB-OH 3.27Å; S130-Y249 PolarHBondContact OG-OH 3.34Å; S130-I390 WeakPolarHBondContact O-CD1 3.44Å
131V91.6Very high90.5Very high0 Ų08.9 Ų8.90%05%0.053CC..Hα-helixtrans-68.8-35180-176.70000110.8A51 S127 G134 W135 L332 L336A51-V131 HydrophobicContact CB-CG2 3.51Å; S127-V131 WeakPolarHBondContact O-CB 3.34Å; S127-V131 WeakPolarHBondContact O-CG2 3.41Å; S127-V131 PolarHBondContact O-N 3.46Å; S127-V131 VanDerWaalsContact O-N 3.08Å; V131-G134 PolarHBondContact O-N 3.02Å; V131-W135 WeakPolarHBondContact O-CB 3.34Å; V131-W135 PolarHBondContact O-N 3.28Å; V131-L332 HydrophobicContact CG1-CB 4.06Å; V131-L332 HydrophobicContact CG1-CD2 3.8Å; V131-L332 WeakPolarHBondContact CG1-O 3.43Å; V131-L336 HydrophobicContact CB-CD2 3.92Å; V131-L336 HydrophobicContact CB-CG 3.98Å; V131-L336 HydrophobicContact CG1-CD1 4.29Å; V131-L336 HydrophobicContact CG1-CD2 4.16Å; V131-L336 HydrophobicContact CG1-CG 3.64Å
132A93.7Very high89.9Confident0 Ų011.8 Ų11.80%07%0.067CC..Hα-helixtrans-64.2-40.4174.700000112V128 S130 W135 S136 I177 L336 T385V128-A132 VanDerWaalsContact O-CB 3.29Å; V128-A132 WeakPolarHBondContact O-CB 3.39Å; V128-A132 PolarHBondContact O-N 3.48Å; V128-A132 VanDerWaalsContact O-N 3.11Å; S130-A132 VanDerWaalsContact C-N 3.33Å; S130-A132 PolarHBondContact O-N 3.46Å; A132-W135 WeakPolarHBondContact O-CB 3.13Å; A132-W135 PolarHBondContact O-N 3.13Å; A132-S136 PolarHBondContact O-N 3.22Å; A132-S136 PolarHBondContact O-OG 3.15Å; A132-I177 HydrophobicContact CB-CD1 3.63Å; A132-I177 HydrophobicContact CB-CG1 3.77Å; A132-L336 HydrophobicContact CB-CD1 4.39Å; A132-L336 HydrophobicContact CB-CD2 3.95Å; A132-T385 HydrophobicContact CB-CG2 3.8Å
133R89.1Confident89.6Confident21 Ų2113.3 Ų13.38%0.0798%0.078CC..Hα-helixtrans-66.9-35.8172.2-66.7-16381.3116.812112.6S129 S130 W135 S136 G137 Y168 T385 C388 I390S129-R133 PolarHBondContact O-N 3.47Å; S130-R133 PolarHBondContact O-N 3.38Å; R133-W135 VanDerWaalsContact C-N 3.3Å; R133-S136 WeakPolarHBondContact CA-OG 3.36Å; R133-S136 PolarHBondContact O-OG 2.9Å; R133-G137 PolarHBondContact O-N 2.71Å; R133-Y168 PolarHBondContact NH2-O 2.98Å; R133-T385 HydrophobicContact CG-CG2 3.8Å; R133-T385 PolarHBondContact NH1-O 3.28Å; R133-C388 WeakPolarHBondContact CD-O 3.26Å; R133-C388 PolarHBondContact NE-O 2.95Å; R133-C388 VanDerWaalsContact NH1-C 3.31Å; R133-C388 PolarHBondContact NH1-O 3.29Å; R133-I390 HydrophobicContact CB-CB 4.21Å; R133-I390 HydrophobicContact CB-CD1 4.11Å; R133-I390 HydrophobicContact CB-CG1 4.27Å
134G87.9Confident89.1Confident9 Ų920.4 Ų20.49%0.09311%0.111CC..Hα-helixtrans-63.4-38.5172.700000112S130 V131 T138S130-G134 PolarHBondContact O-N 3.44Å; V131-G134 PolarHBondContact O-N 3.02Å; G134-T138 PolarHBondContact O-N 3.01Å; G134-T138 PolarHBondContact O-OG1 2.96Å
135W91.6Very high88.5Confident47 Ų4724 Ų2418%0.17813%0.128CC..Hα-helixtrans-66.5-51.5178.6-168.2105.3000111.4V131 A132 R133 G137 T138 V139 I172 L176 L329 L332 S333V131-W135 WeakPolarHBondContact O-CB 3.34Å; V131-W135 PolarHBondContact O-N 3.28Å; A132-W135 WeakPolarHBondContact O-CB 3.13Å; A132-W135 PolarHBondContact O-N 3.13Å; R133-W135 VanDerWaalsContact C-N 3.3Å; W135-G137 VanDerWaalsContact C-N 3.33Å; W135-G137 PolarHBondContact O-N 2.68Å; W135-T138 WeakPolarHBondContact O-CB 3.36Å; W135-T138 PolarHBondContact O-N 3.2Å; W135-V139 HydrophobicContact CD2-CG2 4.3Å; W135-V139 HydrophobicContact CE3-CG2 3.71Å; W135-V139 HydrophobicContact CH2-CG2 3.73Å; W135-V139 HydrophobicContact CZ2-CG2 4.32Å; W135-V139 HydrophobicContact CZ3-CB 4.48Å; W135-V139 HydrophobicContact CZ3-CG2 3.41Å; W135-V139 VanDerWaalsContact CZ3-CG2 3.41Å; W135-V139 PolarHBondContact O-N 3.1Å; W135-V139 VanDerWaalsContact O-N 3.1Å; W135-I172 HydrophobicContact CE3-CG2 4.22Å; W135-I172 HydrophobicContact CZ3-CG2 3.71Å; W135-L176 HydrophobicContact CB-CD2 3.86Å; W135-L176 HydrophobicContact CD2-CD2 3.38Å; W135-L176 HydrophobicContact CE3-CD2 3.71Å; W135-L176 HydrophobicContact CG-CD2 3.43Å; W135-L176 VanDerWaalsContact CG-CD2 3.43Å; W135-L176 HydrophobicContact CZ2-CD1 4.4Å; W135-L176 HydrophobicContact CZ3-CD2 4.4Å; W135-L329 HydrophobicContact CD2-CD2 3.88Å; W135-L329 HydrophobicContact CE3-CD2 4.49Å; W135-L329 HydrophobicContact CG-CD2 4.1Å; W135-L329 HydrophobicContact CZ2-CD2 4.19Å; W135-L329 PolarHBondContact NE1-O 2.92Å; W135-L332 HydrophobicContact CB-CB 4.17Å; W135-L332 HydrophobicContact CB-CD1 4.36Å; W135-L332 HydrophobicContact CG-CB 4.37Å; W135-S333 PolarHBondContact NE1-OG 2.76Å
136S91.1Very high88.1Confident3 Ų326.9 Ų26.92%0.02115%0.152CC..Hα-helixtrans-63-38.8177.260.20000111.9A132 R133 T138 V139 D140 D170A132-S136 PolarHBondContact O-N 3.22Å; A132-S136 PolarHBondContact O-OG 3.15Å; R133-S136 WeakPolarHBondContact CA-OG 3.36Å; R133-S136 PolarHBondContact O-OG 2.9Å; S136-T138 VanDerWaalsContact C-N 3.31Å; S136-T138 PolarHBondContact O-N 3.25Å; S136-V139 PolarHBondContact O-N 3.48Å; S136-D140 PolarHBondContact O-N 3.39Å; S136-D170 VanDerWaalsContact CB-OD1 3.28Å; S136-D170 WeakPolarHBondContact CB-OD1 3.36Å; S136-D170 VanDerWaalsContact CB-OD2 3.3Å; S136-D170 WeakPolarHBondContact CB-OD2 3.28Å; S136-D170 VanDerWaalsContact OG-CG 3.23Å; S136-D170 PolarHBondContact OG-OD1 3.3Å; S136-D170 PolarHBondContact OG-OD2 3.12Å
137G85Confident87.8Confident11 Ų1129 Ų2911%0.11316%0.163CC..Hα-helixtrans-61.6-37.4174.100000112.9R133 W135 D140 A141R133-G137 PolarHBondContact O-N 2.71Å; W135-G137 VanDerWaalsContact C-N 3.33Å; W135-G137 PolarHBondContact O-N 2.68Å; G137-D140 PolarHBondContact O-N 3.21Å; G137-A141 WeakPolarHBondContact O-CB 3.38Å; G137-A141 PolarHBondContact O-N 3.28Å
138T85.7Confident87.4Confident4 Ų428.9 Ų28.93%0.02516%0.162CC..Hα-helixtrans-65.1-43173.7-56.80000111.2G134 W135 S136 A141 M142 L329 L332G134-T138 PolarHBondContact O-N 3.01Å; G134-T138 PolarHBondContact O-OG1 2.96Å; W135-T138 WeakPolarHBondContact O-CB 3.36Å; W135-T138 PolarHBondContact O-N 3.2Å; S136-T138 VanDerWaalsContact C-N 3.31Å; S136-T138 PolarHBondContact O-N 3.25Å; T138-A141 PolarHBondContact O-N 3.41Å; T138-M142 HydrophobicContact CG2-SD 4.47Å; T138-M142 WeakPolarHBondContact O-CG 3.28Å; T138-M142 PolarHBondContact O-N 3.46Å; T138-L329 HydrophobicContact CG2-CD2 3.73Å; T138-L329 HydrophobicContact CG2-CG 4.12Å; T138-L332 WeakPolarHBondContact OG1-CD1 3.31Å
139V89.1Confident87.1Confident33 Ų3332.8 Ų32.820%0.218%0.183CC..Hα-helixtrans-63.3-42.7174.7179.60000111.1W135 S136 A141 M142 S143 I147 L329W135-V139 HydrophobicContact CD2-CG2 4.3Å; W135-V139 HydrophobicContact CE3-CG2 3.71Å; W135-V139 HydrophobicContact CH2-CG2 3.73Å; W135-V139 HydrophobicContact CZ2-CG2 4.32Å; W135-V139 HydrophobicContact CZ3-CB 4.48Å; W135-V139 HydrophobicContact CZ3-CG2 3.41Å; W135-V139 VanDerWaalsContact CZ3-CG2 3.41Å; W135-V139 PolarHBondContact O-N 3.1Å; W135-V139 VanDerWaalsContact O-N 3.1Å; S136-V139 PolarHBondContact O-N 3.48Å; V139-A141 PolarHBondContact O-N 3.46Å; V139-M142 PolarHBondContact O-N 2.9Å; V139-S143 WeakPolarHBondContact O-CB 3.25Å; V139-S143 PolarHBondContact O-N 2.7Å; V139-S143 PolarHBondContact O-OG 3.13Å; V139-I147 HydrophobicContact CG1-CD1 3.67Å; V139-L329 HydrophobicContact CG2-CD1 4.1Å; V139-L329 HydrophobicContact CG2-CD2 3.52Å; V139-L329 HydrophobicContact CG2-CG 4.47Å
140D87.5Confident86.8Confident4 Ų434.3 Ų34.32%0.02120%0.199CC..Hα-helixtrans-60.2-45.6177.6-170.452000111S136 G137 M142 S143 Q144 H145 I147 S148S136-D140 PolarHBondContact O-N 3.39Å; G137-D140 PolarHBondContact O-N 3.21Å; D140-M142 PolarHBondContact O-N 3.12Å; D140-S143 WeakPolarHBondContact CA-OG 3.43Å; D140-S143 CarbonylContact O-C 3.02Å; D140-S143 WeakPolarHBondContact O-CA 3.49Å; D140-S143 PolarHBondContact O-N 2.91Å; D140-S143 PolarHBondContact O-OG 3.32Å; D140-Q144 PolarHBondContact O-N 2.96Å; D140-H145 PolarHBondContact O-N 3.17Å; D140-H145 VanDerWaalsContact OD1-CA 3.27Å; D140-H145 WeakPolarHBondContact OD1-CA 3.49Å; D140-H145 IonicContact OD2-CE1 3.22Å; D140-H145 IonicContact OD2-CG 3.71Å; D140-H145 IonicContact OD2-ND1 3.84Å; D140-H145 PolarHBondContact OD2-ND1 3.27Å; D140-I147 WeakPolarHBondContact OD1-CB 3.33Å; D140-I147 PolarHBondContact OD1-N 3.45Å; D140-I147 VanDerWaalsContact OD1-N 3.16Å; D140-S148 PolarHBondContact OD1-N 3.31Å; D140-S148 PolarHBondContact OD1-OG 3.2Å; D140-S148 VanDerWaalsContact OD2-CB 3.23Å; D140-S148 WeakPolarHBondContact OD2-CB 3.4Å; D140-S148 PolarHBondContact OD2-OG 3.46Å
141A81.1Confident86.8Confident26 Ų2635.5 Ų35.522%0.21521%0.206CC..Hα-helixtrans-61.1-42.6175.700000112.6G137 T138 V139 S143 Q144 A306G137-A141 WeakPolarHBondContact O-CB 3.38Å; G137-A141 PolarHBondContact O-N 3.28Å; T138-A141 PolarHBondContact O-N 3.41Å; V139-A141 PolarHBondContact O-N 3.46Å; A141-S143 PolarHBondContact O-N 3.34Å; A141-Q144 PolarHBondContact O-N 3.44Å; A141-Q144 VanDerWaalsContact O-N 3.13Å; A141-A306 HydrophobicContact CB-CB 3.8Å
142M82.7Confident86.5Confident61 Ų6138.7 Ų38.730%0.322%0.22SC..Hα-helixtrans-64.4-29.1174.3-69.9178.370.800112.6T138 V139 D140 Q144 T309 Y322 L329T138-M142 HydrophobicContact CG2-SD 4.47Å; T138-M142 WeakPolarHBondContact O-CG 3.28Å; T138-M142 PolarHBondContact O-N 3.46Å; V139-M142 PolarHBondContact O-N 2.9Å; D140-M142 PolarHBondContact O-N 3.12Å; M142-Q144 VanDerWaalsContact C-N 3.29Å; M142-T309 HydrophobicContact CG-CG2 4.5Å; M142-Y322 HydrophobicContact CE-CD1 4.29Å; M142-L329 HydrophobicContact SD-CD1 4.06Å
143S85.1Confident86.2Confident39 Ų3945.3 Ų45.327%0.27326%0.255SS..THydrogen-bonded Turntrans-8811.7175.477.10000114V139 D140 A141 H145 A146V139-S143 WeakPolarHBondContact O-CB 3.25Å; V139-S143 PolarHBondContact O-N 2.7Å; V139-S143 PolarHBondContact O-OG 3.13Å; D140-S143 WeakPolarHBondContact CA-OG 3.43Å; D140-S143 CarbonylContact O-C 3.02Å; D140-S143 WeakPolarHBondContact O-CA 3.49Å; D140-S143 PolarHBondContact O-N 2.91Å; D140-S143 PolarHBondContact O-OG 3.32Å; A141-S143 PolarHBondContact O-N 3.34Å; S143-H145 VanDerWaalsContact C-N 3.28Å; S143-H145 PolarHBondContact O-N 3.43Å; S143-A146 VanDerWaalsContact O-CB 3.28Å; S143-A146 WeakPolarHBondContact O-CB 3.46Å; S143-A146 PolarHBondContact O-N 3.03Å
144Q81.8Confident86.2Confident153 Ų15350 Ų5072%0.71529%0.287SS*.THydrogen-bonded Turntrans54.941.4-176.6-57.4-179.6-18.100113.1D140 A141 M142 A146D140-Q144 PolarHBondContact O-N 2.96Å; A141-Q144 PolarHBondContact O-N 3.44Å; A141-Q144 VanDerWaalsContact O-N 3.13Å; M142-Q144 VanDerWaalsContact C-N 3.29Å; Q144-A146 PolarHBondContact O-N 3.08Å
145H81.3Confident86Confident79 Ų7954.5 Ų54.537%0.36631%0.307SS..THydrogen-bonded Turntrans63.220.7-179.2-56.9-65.1000115.6D140 S143 I147 S148 N149D140-H145 PolarHBondContact O-N 3.17Å; D140-H145 VanDerWaalsContact OD1-CA 3.27Å; D140-H145 WeakPolarHBondContact OD1-CA 3.49Å; D140-H145 IonicContact OD2-CE1 3.22Å; D140-H145 IonicContact OD2-CG 3.71Å; D140-H145 IonicContact OD2-ND1 3.84Å; D140-H145 PolarHBondContact OD2-ND1 3.27Å; S143-H145 VanDerWaalsContact C-N 3.28Å; S143-H145 PolarHBondContact O-N 3.43Å; H145-I147 VanDerWaalsContact C-N 3.29Å; H145-I147 PolarHBondContact O-N 2.93Å; H145-S148 PolarHBondContact O-OG 3.49Å; H145-N149 VanDerWaalsContact O-CB 3.26Å; H145-N149 WeakPolarHBondContact O-CB 3.18Å; H145-N149 PolarHBondContact O-N 3.25Å; H145-N149 VanDerWaalsContact O-N 3.12Å; H145-N149 PolarHBondContact O-ND2 3.06Å
146A86.8Confident85.7Confident61 Ų6153.8 Ų53.850%0.50431%0.314SS..Hα-helixtrans-64.2-33.9178.600000112.7S143 Q144 G150S143-A146 VanDerWaalsContact O-CB 3.28Å; S143-A146 WeakPolarHBondContact O-CB 3.46Å; S143-A146 PolarHBondContact O-N 3.03Å; Q144-A146 PolarHBondContact O-N 3.08Å; A146-G150 PolarHBondContact O-N 3.42Å
147I84.9Confident85.4Confident47 Ų4757.7 Ų57.724%0.24134%0.341CS..Hα-helixtrans-74.3-48.8-176.2-63.7163.7000110.5V139 D140 H145 G150 T151 I172V139-I147 HydrophobicContact CG1-CD1 3.67Å; D140-I147 WeakPolarHBondContact OD1-CB 3.33Å; D140-I147 PolarHBondContact OD1-N 3.45Å; D140-I147 VanDerWaalsContact OD1-N 3.16Å; H145-I147 VanDerWaalsContact C-N 3.29Å; H145-I147 PolarHBondContact O-N 2.93Å; I147-G150 PolarHBondContact O-N 2.79Å; I147-T151 WeakPolarHBondContact O-CB 2.92Å; I147-T151 PolarHBondContact O-N 3.32Å; I147-T151 PolarHBondContact O-OG1 2.66Å; I147-I172 HydrophobicContact CD1-CD1 3.78Å; I147-I172 HydrophobicContact CG1-CD1 4.34Å; I147-I172 HydrophobicContact CG2-CD1 3.57Å
148S83.5Confident85.4Confident8 Ų859.7 Ų59.76%0.05635%0.347CS..Hα-helixtrans-63.7-42.8178.557.60000111.2D140 H145 T151 K152D140-S148 PolarHBondContact OD1-N 3.31Å; D140-S148 PolarHBondContact OD1-OG 3.2Å; D140-S148 VanDerWaalsContact OD2-CB 3.23Å; D140-S148 WeakPolarHBondContact OD2-CB 3.4Å; D140-S148 PolarHBondContact OD2-OG 3.46Å; H145-S148 PolarHBondContact O-OG 3.49Å; S148-T151 PolarHBondContact O-N 3.05Å; S148-K152 WeakPolarHBondContact O-CB 3.18Å; S148-K152 VanDerWaalsContact O-CG 3.25Å; S148-K152 WeakPolarHBondContact O-CG 3.29Å; S148-K152 PolarHBondContact O-N 2.96Å
149N86.6Confident85.1Confident83 Ų8362.9 Ų62.944%0.44437%0.368SS..Hα-helixtrans-63.9-44.3174.8-71-27.7000112.2H145 T151 K152 N153H145-N149 VanDerWaalsContact O-CB 3.26Å; H145-N149 WeakPolarHBondContact O-CB 3.18Å; H145-N149 PolarHBondContact O-N 3.25Å; H145-N149 VanDerWaalsContact O-N 3.12Å; H145-N149 PolarHBondContact O-ND2 3.06Å; N149-T151 PolarHBondContact O-N 3.31Å; N149-K152 PolarHBondContact O-N 3.47Å; N149-N153 WeakPolarHBondContact O-CB 3.37Å; N149-N153 PolarHBondContact O-N 3.49Å; N149-N153 PolarHBondContact O-ND2 2.87Å
150G88.2Confident84.3Confident32 Ų3267.5 Ų67.533%0.3340%0.401SS..Hα-helixtrans-62-41.3177.300000113A146 I147 N153 T154A146-G150 PolarHBondContact O-N 3.42Å; I147-G150 PolarHBondContact O-N 2.79Å; G150-N153 PolarHBondContact O-N 3.28Å; G150-T154 WeakPolarHBondContact O-CB 3.47Å; G150-T154 PolarHBondContact O-N 3.36Å; G150-T154 PolarHBondContact O-OG1 3.13Å
151T87.7Confident83.6Confident24 Ų2473.7 Ų73.715%0.14744%0.435CS..Hα-helixtrans-67.6-46.9177.8-53.40000111.1I147 S148 N149 N153 T154 I155 Y168 P169I147-T151 WeakPolarHBondContact O-CB 2.92Å; I147-T151 PolarHBondContact O-N 3.32Å; I147-T151 PolarHBondContact O-OG1 2.66Å; S148-T151 PolarHBondContact O-N 3.05Å; N149-T151 PolarHBondContact O-N 3.31Å; T151-N153 VanDerWaalsContact C-N 3.28Å; T151-N153 PolarHBondContact O-N 3.45Å; T151-T154 PolarHBondContact O-N 3.15Å; T151-I155 HydrophobicContact CG2-CD1 4.27Å; T151-I155 PolarHBondContact O-N 3.14Å; T151-Y168 HydrophobicContact CG2-CD2 4.16Å; T151-P169 HydrophobicContact CG2-CG 4.19Å
152K86.5Confident83.3Confident67 Ų6775.3 Ų75.329%0.29144%0.442SS..Hα-helixtrans-59.6-38.5176.1-74.5176.2-179.9-177.10111.8S148 N149 G156 D167S148-K152 WeakPolarHBondContact O-CB 3.18Å; S148-K152 VanDerWaalsContact O-CG 3.25Å; S148-K152 WeakPolarHBondContact O-CG 3.29Å; S148-K152 PolarHBondContact O-N 2.96Å; N149-K152 PolarHBondContact O-N 3.47Å; K152-G156 WeakPolarHBondContact O-CA 3.03Å; K152-G156 PolarHBondContact O-N 3.33Å; K152-G156 VanDerWaalsContact O-N 3.14Å; K152-D167 IonicContact NZ-OD2 3.72Å; K152-D167 PolarHBondContact NZ-OD2 3.23Å; K152-D167 VanDerWaalsContact NZ-OD2 3.13Å
153N87.7Confident82.9Confident140 Ų14078.5 Ų78.575%0.74946%0.456SS*.Hα-helixtrans-72.1-33.6178.7-70.4-16.7000113.5N149 G150 T151N149-N153 WeakPolarHBondContact O-CB 3.37Å; N149-N153 PolarHBondContact O-N 3.49Å; N149-N153 PolarHBondContact O-ND2 2.87Å; G150-N153 PolarHBondContact O-N 3.28Å; T151-N153 VanDerWaalsContact C-N 3.28Å; T151-N153 PolarHBondContact O-N 3.45Å
154T88.9Confident82.5Confident120 Ų12080.7 Ų80.774%0.73646%0.461SS*.Hα-helixtrans-90.8-43.9-173.7-51.20000112.5G150 T151G150-T154 WeakPolarHBondContact O-CB 3.47Å; G150-T154 PolarHBondContact O-N 3.36Å; G150-T154 PolarHBondContact O-OG1 3.13Å; T151-T154 PolarHBondContact O-N 3.15Å
155I84.3Confident82.6Confident103 Ų10375.4 Ų75.453%0.52844%0.437SS..THydrogen-bonded Turntrans-107.8-26.3-170.8-59.7174.5000111.3T151 P169 F171T151-I155 HydrophobicContact CG2-CD1 4.27Å; T151-I155 PolarHBondContact O-N 3.14Å; I155-P169 HydrophobicContact CG2-CG 4.04Å; I155-F171 HydrophobicContact CD1-CD2 4.23Å; I155-F171 HydrophobicContact CD1-CE2 3.36Å; I155-F171 HydrophobicContact CD1-CZ 3.9Å
156G84.8Confident82.5Confident31 Ų3171.8 Ų71.832%0.3242%0.421SS..  trans99.9164-17500000113K152K152-G156 WeakPolarHBondContact O-CA 3.03Å; K152-G156 PolarHBondContact O-N 3.33Å; K152-G156 VanDerWaalsContact O-N 3.14Å
157S84.9Confident82.2Confident85 Ų8573.6 Ų73.659%0.59442%0.422SS*.PPolyproline II helixtrans-91147.1171.756.60000110.7D167S157-D167 WeakPolarHBondContact CA-O 3.28Å; S157-D167 WeakPolarHBondContact CB-O 3.14Å
158F83.5Confident82.2Confident54 Ų5472.7 Ų72.724%0.23742%0.416CS..PPolyproline II helixtrans-67.3156.2167.3-70.3-53.6000110.7S160 L165 G166 D167 P169 L387F158-S160 PolarHBondContact O-N 3.24Å; F158-L165 HydrophobicContact CB-CB 3.95Å; F158-L165 HydrophobicContact CB-CD1 4.22Å; F158-L165 HydrophobicContact CD1-CD1 4.14Å; F158-L165 HydrophobicContact CD2-CB 4.28Å; F158-L165 HydrophobicContact CG-CB 4.14Å; F158-L165 HydrophobicContact CG-CD1 4.22Å; F158-G166 VanDerWaalsContact CB-O 3.28Å; F158-G166 WeakPolarHBondContact CB-O 3.44Å; F158-G166 VanDerWaalsContact CD2-O 3.25Å; F158-G166 WeakPolarHBondContact CD2-O 3.44Å; F158-D167 PolarHBondContact N-O 3.27Å; F158-D167 VanDerWaalsContact N-O 3.08Å; F158-P169 HydrophobicContact CE2-CB 3.95Å; F158-P169 HydrophobicContact CE2-CG 4.38Å; F158-P169 HydrophobicContact CZ-CB 3.98Å; F158-P169 HydrophobicContact CZ-CG 4.37Å; F158-L387 HydrophobicContact CZ-CD2 3.93Å
159P80.2Confident82.5Confident71 Ų7172.7 Ų72.746%0.46142%0.416SS..PPolyproline II helixtrans-73127.2-177.832.2-36.8000110.7N161 V162P159-N161 WeakPolarHBondContact CB-OD1 3.32Å; P159-N161 PolarHBondContact O-N 3.3Å; P159-N161 VanDerWaalsContact O-N 3.12Å; P159-V162 HydrophobicContact CG-CG2 4.25Å; P159-V162 PolarHBondContact O-N 3.2Å
160S73Confident82.7Confident129 Ų12969 Ų6990%0.90240%0.396SS*.THydrogen-bonded Turntrans-69.3-7.5-174.554.10000114.9F158 V162F158-S160 PolarHBondContact O-N 3.24Å; S160-V162 VanDerWaalsContact C-N 3.33Å
161N72.4Confident83Confident135 Ų13572.4 Ų72.472%0.72240%0.402SS*.THydrogen-bonded Turntrans-80-15.8175.866.2-22.1000113P159P159-N161 WeakPolarHBondContact CB-OD1 3.32Å; P159-N161 PolarHBondContact O-N 3.3Å; P159-N161 VanDerWaalsContact O-N 3.12Å
162V74.9Confident83.2Confident60 Ų6074 Ų7436%0.36441%0.409SS..  trans-98.695.9177.4-174.90000108.2P159 S160 F164 L165P159-V162 HydrophobicContact CG-CG2 4.25Å; P159-V162 PolarHBondContact O-N 3.2Å; S160-V162 VanDerWaalsContact C-N 3.33Å; V162-F164 HydrophobicContact CG1-CB 4.01Å; V162-F164 PolarHBondContact O-N 3.07Å; V162-L165 HydrophobicContact CB-CD1 4.25Å; V162-L165 HydrophobicContact CB-CG 4.43Å; V162-L165 HydrophobicContact CG1-CD1 4.19Å; V162-L165 HydrophobicContact CG1-CG 4.06Å; V162-L165 PolarHBondContact O-N 3.26Å
163E73.4Confident83.6Confident128 Ų12870.8 Ų70.860%0.59840%0.395SS*.THydrogen-bonded Turntrans-48.7-36.5-179.9-158.7-172.2178.500111.9L165 L392E163-L165 PolarHBondContact O-N 3.28Å; E163-L392 HydrophobicContact CB-CD1 4.43Å; E163-L392 HydrophobicContact CG-CD1 4.11Å; E163-L392 HydrophobicContact CG-CD2 4.18Å; E163-L392 WeakPolarHBondContact O-CD1 3.38Å
164F78.1Confident83.9Confident84 Ų8464.8 Ų64.837%0.36837%0.365SS..THydrogen-bonded Turntrans-58.9-37.9-179.1-175.8-108.9000114.8V162 C388 D389 L392 R580V162-F164 HydrophobicContact CG1-CB 4.01Å; V162-F164 PolarHBondContact O-N 3.07Å; F164-C388 VanDerWaalsContact CE1-SG 3.54Å; F164-C388 WeakPolarHBondContact CZ-SG 3.43Å; F164-C388 VanDerWaalsContact O-CA 3.31Å; F164-C388 WeakPolarHBondContact O-CA 3.28Å; F164-D389 PolarHBondContact O-N 3.14Å; F164-L392 VanDerWaalsContact CA-CD1 3.46Å; F164-R580 VanDerWaalsContact CD2-NH1 3.35Å
165L82.9Confident84.2Confident43 Ų4363.8 Ų63.823%0.22536%0.355CS..BIsolated β-bridgetrans-85.7139.2-173.2-66.4173.3000110F158 V162 E163 L387F158-L165 HydrophobicContact CB-CB 3.95Å; F158-L165 HydrophobicContact CB-CD1 4.22Å; F158-L165 HydrophobicContact CD1-CD1 4.14Å; F158-L165 HydrophobicContact CD2-CB 4.28Å; F158-L165 HydrophobicContact CG-CB 4.14Å; F158-L165 HydrophobicContact CG-CD1 4.22Å; V162-L165 HydrophobicContact CB-CD1 4.25Å; V162-L165 HydrophobicContact CB-CG 4.43Å; V162-L165 HydrophobicContact CG1-CD1 4.19Å; V162-L165 HydrophobicContact CG1-CG 4.06Å; V162-L165 PolarHBondContact O-N 3.26Å; E163-L165 PolarHBondContact O-N 3.28Å; L165-L387 CarbonylContact C-O 3.37Å; L165-L387 VanDerWaalsContact CA-O 3.3Å; L165-L387 WeakPolarHBondContact CA-O 3.19Å; L165-L387 HydrophobicContact CD2-CB 4.14Å
166G79.7Confident84.8Confident3 Ų359.7 Ų59.73%0.03133%0.334CS..  trans-67.1173.9169.800000111.6F158 Y168 L387F158-G166 VanDerWaalsContact CB-O 3.28Å; F158-G166 WeakPolarHBondContact CB-O 3.44Å; F158-G166 VanDerWaalsContact CD2-O 3.25Å; F158-G166 WeakPolarHBondContact CD2-O 3.44Å; G166-Y168 VanDerWaalsContact C-N 3.26Å; G166-Y168 PolarHBondContact O-N 3.22Å; G166-L387 PolarHBondContact N-O 3.4Å
167D80.8Confident85.3Confident98 Ų9858.3 Ų58.352%0.52432%0.319SS..SBendtrans-60.5-36177.4-84.98.7000113.8K152 S157 F158K152-D167 IonicContact NZ-OD2 3.72Å; K152-D167 PolarHBondContact NZ-OD2 3.23Å; K152-D167 VanDerWaalsContact NZ-OD2 3.13Å; S157-D167 WeakPolarHBondContact CA-O 3.28Å; S157-D167 WeakPolarHBondContact CB-O 3.14Å; F158-D167 PolarHBondContact N-O 3.27Å; F158-D167 VanDerWaalsContact N-O 3.08Å
168Y84.5Confident85.8Confident28 Ų2858.5 Ų58.511%0.1131%0.312CS..SBendtrans-150156.4-17564.1-89000110.5R133 T151 G166 D170R133-Y168 PolarHBondContact NH2-O 2.98Å; T151-Y168 HydrophobicContact CG2-CD2 4.16Å; G166-Y168 VanDerWaalsContact C-N 3.26Å; G166-Y168 PolarHBondContact O-N 3.22Å; Y168-D170 HydrophobicContact CE2-CB 4.44Å; Y168-D170 PolarHBondContact O-N 3.49Å
169P90.2Very high86.2Confident9 Ų960 Ų606%0.05832%0.322CS..  trans-67.8118.2173.425.6-33.2000111.5T151 I155 F158 F171 L386T151-P169 HydrophobicContact CG2-CG 4.19Å; I155-P169 HydrophobicContact CG2-CG 4.04Å; F158-P169 HydrophobicContact CE2-CB 3.95Å; F158-P169 HydrophobicContact CE2-CG 4.38Å; F158-P169 HydrophobicContact CZ-CB 3.98Å; F158-P169 HydrophobicContact CZ-CG 4.37Å; P169-F171 HydrophobicContact CB-CD2 4.32Å; P169-F171 HydrophobicContact CB-CE2 3.69Å; P169-F171 HydrophobicContact CB-CZ 4.05Å; P169-F171 HydrophobicContact CG-CD2 4.47Å; P169-F171 HydrophobicContact CG-CE2 3.66Å; P169-F171 HydrophobicContact CG-CZ 4.26Å; P169-F171 WeakPolarHBondContact O-CD2 3.43Å; P169-F171 PolarHBondContact O-N 3.11Å; P169-L386 VanDerWaalsContact CA-O 3.31Å; P169-L386 WeakPolarHBondContact CA-O 3.16Å; P169-L386 HydrophobicContact CB-CD1 3.83Å; P169-L386 HydrophobicContact CB-CG 4.27Å
170D91.2Very high86.8Confident4 Ų457.2 Ų57.22%0.02130%0.303CS..  trans-9083.4-177.7-177.49.1000112.4S136 Y168 I172 G173 A174 L386S136-D170 VanDerWaalsContact CB-OD1 3.28Å; S136-D170 WeakPolarHBondContact CB-OD1 3.36Å; S136-D170 VanDerWaalsContact CB-OD2 3.3Å; S136-D170 WeakPolarHBondContact CB-OD2 3.28Å; S136-D170 VanDerWaalsContact OG-CG 3.23Å; S136-D170 PolarHBondContact OG-OD1 3.3Å; S136-D170 PolarHBondContact OG-OD2 3.12Å; Y168-D170 HydrophobicContact CE2-CB 4.44Å; Y168-D170 PolarHBondContact O-N 3.49Å; D170-I172 VanDerWaalsContact C-N 3.31Å; D170-I172 PolarHBondContact O-N 3.37Å; D170-I172 PolarHBondContact OD1-N 2.97Å; D170-G173 PolarHBondContact OD1-N 2.75Å; D170-A174 PolarHBondContact O-N 3.08Å; D170-L386 PolarHBondContact N-O 3.08Å
171F92.7Very high87.7Confident105 Ų10551.4 Ų51.446%0.46126%0.263SS..Hα-helixtrans-67.2-30.5177.5-65.7-80.1000113.2I155 P169 L175 L386I155-F171 HydrophobicContact CD1-CD2 4.23Å; I155-F171 HydrophobicContact CD1-CE2 3.36Å; I155-F171 HydrophobicContact CD1-CZ 3.9Å; P169-F171 HydrophobicContact CB-CD2 4.32Å; P169-F171 HydrophobicContact CB-CE2 3.69Å; P169-F171 HydrophobicContact CB-CZ 4.05Å; P169-F171 HydrophobicContact CG-CD2 4.47Å; P169-F171 HydrophobicContact CG-CE2 3.66Å; P169-F171 HydrophobicContact CG-CZ 4.26Å; P169-F171 WeakPolarHBondContact O-CD2 3.43Å; P169-F171 PolarHBondContact O-N 3.11Å; F171-L175 WeakPolarHBondContact O-CB 3.36Å; F171-L175 PolarHBondContact O-N 3.24Å; F171-L386 HydrophobicContact CD1-CD1 3.72Å; F171-L386 HydrophobicContact CD2-CD1 4.4Å; F171-L386 HydrophobicContact CE1-CD1 3.79Å; F171-L386 HydrophobicContact CE2-CD1 4.44Å; F171-L386 HydrophobicContact CG-CD1 4.05Å; F171-L386 HydrophobicContact CZ-CD1 4.16Å
172I93.1Very high88.6Confident57 Ų5749.8 Ų49.829%0.29225%0.254SS..Hα-helixtrans-70.9-46.8-177.6-63.9-174000109.8W135 I147 D170 L175 L176W135-I172 HydrophobicContact CE3-CG2 4.22Å; W135-I172 HydrophobicContact CZ3-CG2 3.71Å; I147-I172 HydrophobicContact CD1-CD1 3.78Å; I147-I172 HydrophobicContact CG1-CD1 4.34Å; I147-I172 HydrophobicContact CG2-CD1 3.57Å; D170-I172 VanDerWaalsContact C-N 3.31Å; D170-I172 PolarHBondContact O-N 3.37Å; D170-I172 PolarHBondContact OD1-N 2.97Å; I172-L175 PolarHBondContact O-N 2.9Å; I172-L176 WeakPolarHBondContact O-CB 3.47Å; I172-L176 PolarHBondContact O-N 2.93Å
173G94Very high89.3Confident0 Ų048.2 Ų48.20%025%0.245CC..Hα-helixtrans-60.6-44.917500000111.9D170 L176 I177 T385D170-G173 PolarHBondContact OD1-N 2.75Å; G173-L176 WeakPolarHBondContact O-CB 3.33Å; G173-L176 PolarHBondContact O-N 3.43Å; G173-I177 PolarHBondContact O-N 2.98Å; G173-I177 VanDerWaalsContact O-N 3.15Å; G173-T385 VanDerWaalsContact C-CG2 3.5Å
174A95.3Very high89.9Confident13 Ų1342.4 Ų42.411%0.10722%0.218CC..Hα-helixtrans-63.2-43.417800000112.4D170 L176 I177 I178 A382D170-A174 PolarHBondContact O-N 3.08Å; A174-L176 VanDerWaalsContact C-N 3.33Å; A174-L176 PolarHBondContact O-N 2.87Å; A174-I177 PolarHBondContact O-N 2.94Å; A174-I178 WeakPolarHBondContact O-CG1 3.12Å; A174-I178 PolarHBondContact O-N 3.06Å; A174-A382 HydrophobicContact CB-CB 4.25Å
175L95.4Very high90.4Very high100 Ų10041.1 Ų41.152%0.52421%0.212SC..Hα-helixtrans-63.2-40176.2179.362.9000111.6F171 I172 I177 I178 I179F171-L175 WeakPolarHBondContact O-CB 3.36Å; F171-L175 PolarHBondContact O-N 3.24Å; I172-L175 PolarHBondContact O-N 2.9Å; L175-I177 PolarHBondContact O-N 3.45Å; L175-I178 PolarHBondContact O-N 3.44Å; L175-I179 HydrophobicContact CD1-CD1 4.22Å; L175-I179 HydrophobicContact CD1-CG1 4.36Å; L175-I179 HydrophobicContact CD2-CD1 4.4Å; L175-I179 HydrophobicContact CG-CD1 3.85Å; L175-I179 HydrophobicContact CG-CG1 4.41Å; L175-I179 WeakPolarHBondContact O-CG1 3.46Å; L175-I179 PolarHBondContact O-N 3.35Å
176L94.9Very high90.5Very high17 Ų1747.3 Ų47.39%0.08923%0.233CC..Hα-helixtrans-58.9-46.6176.9179.467.3000111.3W135 I172 G173 A174 I178 I179 L180 L336W135-L176 HydrophobicContact CB-CD2 3.86Å; W135-L176 HydrophobicContact CD2-CD2 3.38Å; W135-L176 HydrophobicContact CE3-CD2 3.71Å; W135-L176 HydrophobicContact CG-CD2 3.43Å; W135-L176 VanDerWaalsContact CG-CD2 3.43Å; W135-L176 HydrophobicContact CZ2-CD1 4.4Å; W135-L176 HydrophobicContact CZ3-CD2 4.4Å; I172-L176 WeakPolarHBondContact O-CB 3.47Å; I172-L176 PolarHBondContact O-N 2.93Å; G173-L176 WeakPolarHBondContact O-CB 3.33Å; G173-L176 PolarHBondContact O-N 3.43Å; A174-L176 VanDerWaalsContact C-N 3.33Å; A174-L176 PolarHBondContact O-N 2.87Å; L176-I178 VanDerWaalsContact C-N 3.27Å; L176-I178 PolarHBondContact O-N 3.5Å; L176-I179 PolarHBondContact O-N 3.39Å; L176-I179 VanDerWaalsContact O-N 3.17Å; L176-L180 HydrophobicContact CD1-CD1 4.21Å; L176-L180 HydrophobicContact CD1-CD2 4.19Å; L176-L180 HydrophobicContact CD1-CG 4.01Å; L176-L180 HydrophobicContact CG-CD1 4.2Å; L176-L180 HydrophobicContact CG-CG 4.25Å; L176-L180 WeakPolarHBondContact O-CG 3.11Å; L176-L180 PolarHBondContact O-N 3.37Å; L176-L336 HydrophobicContact CD2-CD1 3.43Å; L176-L336 VanDerWaalsContact CD2-CD1 3.43Å; L176-L336 HydrophobicContact CG-CD1 4.14Å
177I96.3Very high90.6Very high2 Ų247.4 Ų47.41%0.0123%0.234CC..Hα-helixtrans-56.1-45.1176.8-68167.8000110.6V128 A132 G173 A174 L175 L180 G181 M340 A381 A382 T385V128-I177 HydrophobicContact CG1-CD1 3.76Å; V128-I177 HydrophobicContact CG1-CG1 3.76Å; V128-I177 HydrophobicContact CG1-CG2 4.1Å; A132-I177 HydrophobicContact CB-CD1 3.63Å; A132-I177 HydrophobicContact CB-CG1 3.77Å; G173-I177 PolarHBondContact O-N 2.98Å; G173-I177 VanDerWaalsContact O-N 3.15Å; A174-I177 PolarHBondContact O-N 2.94Å; L175-I177 PolarHBondContact O-N 3.45Å; I177-L180 PolarHBondContact O-N 3.37Å; I177-G181 PolarHBondContact O-N 2.89Å; I177-M340 HydrophobicContact CG2-CE 3.88Å; I177-M340 HydrophobicContact CG2-SD 4.12Å; I177-M340 WeakPolarHBondContact O-CE 3.42Å; I177-A381 HydrophobicContact CD1-CB 4.34Å; I177-A382 HydrophobicContact CB-CB 4.4Å; I177-A382 HydrophobicContact CD1-CB 4.44Å; I177-A382 HydrophobicContact CG2-CB 4.29Å; I177-T385 HydrophobicContact CD1-CG2 4.37Å; I177-T385 WeakPolarHBondContact CD1-OG1 3.38Å
178I95Very high90.3Very high89 Ų8944.2 Ų44.246%0.45622%0.218SC..Hα-helixtrans-62.4-46.8178.7-63.5168.8000110.6A174 L175 L176 L180 G181 L182A174-I178 WeakPolarHBondContact O-CG1 3.12Å; A174-I178 PolarHBondContact O-N 3.06Å; L175-I178 PolarHBondContact O-N 3.44Å; L176-I178 VanDerWaalsContact C-N 3.27Å; L176-I178 PolarHBondContact O-N 3.5Å; I178-L180 PolarHBondContact O-N 2.87Å; I178-G181 PolarHBondContact O-N 2.91Å; I178-L182 HydrophobicContact CG2-CD1 4.32Å; I178-L182 WeakPolarHBondContact O-CG 3.27Å; I178-L182 PolarHBondContact O-N 3.42Å
179I93.2Very high89.9Confident84 Ų8449.9 Ų49.943%0.43124%0.243SC..Hα-helixtrans-60.2-48.5179.2-68.8168.7000110.8L175 L176 G181 L182 V183L175-I179 HydrophobicContact CD1-CD1 4.22Å; L175-I179 HydrophobicContact CD1-CG1 4.36Å; L175-I179 HydrophobicContact CD2-CD1 4.4Å; L175-I179 HydrophobicContact CG-CD1 3.85Å; L175-I179 HydrophobicContact CG-CG1 4.41Å; L175-I179 WeakPolarHBondContact O-CG1 3.46Å; L175-I179 PolarHBondContact O-N 3.35Å; L176-I179 PolarHBondContact O-N 3.39Å; L176-I179 VanDerWaalsContact O-N 3.17Å; I179-G181 VanDerWaalsContact C-N 3.34Å; I179-G181 PolarHBondContact O-N 3.1Å; I179-L182 PolarHBondContact O-N 2.86Å; I179-V183 WeakPolarHBondContact O-CG2 3.17Å; I179-V183 PolarHBondContact O-N 3.04Å; I179-V183 VanDerWaalsContact O-N 3.12Å
180L91.9Very high89.5Confident13 Ų1352.9 Ų52.97%0.06826%0.258CS..Hα-helixtrans-66.9-36.9-179.7-60.4-167.5000111.6L176 I177 I178 L182 V183 L184 L336 F337 M340L176-L180 HydrophobicContact CD1-CD1 4.21Å; L176-L180 HydrophobicContact CD1-CD2 4.19Å; L176-L180 HydrophobicContact CD1-CG 4.01Å; L176-L180 HydrophobicContact CG-CD1 4.2Å; L176-L180 HydrophobicContact CG-CG 4.25Å; L176-L180 WeakPolarHBondContact O-CG 3.11Å; L176-L180 PolarHBondContact O-N 3.37Å; I177-L180 PolarHBondContact O-N 3.37Å; I178-L180 PolarHBondContact O-N 2.87Å; L180-L182 VanDerWaalsContact C-N 3.35Å; L180-L182 PolarHBondContact O-N 3.15Å; L180-V183 WeakPolarHBondContact O-CB 3.25Å; L180-V183 PolarHBondContact O-N 2.88Å; L180-V183 VanDerWaalsContact O-N 3.15Å; L180-L184 WeakPolarHBondContact O-CG 3.4Å; L180-L184 PolarHBondContact O-N 2.77Å; L180-L336 HydrophobicContact CD1-CB 3.69Å; L180-L336 HydrophobicContact CD1-CD1 4.06Å; L180-L336 HydrophobicContact CD1-CG 4.49Å; L180-F337 HydrophobicContact CB-CE1 4.32Å; L180-F337 HydrophobicContact CB-CZ 4.32Å; L180-F337 HydrophobicContact CD1-CD2 4.1Å; L180-F337 HydrophobicContact CD1-CE2 4.17Å; L180-F337 HydrophobicContact CD2-CD2 4.25Å; L180-F337 HydrophobicContact CD2-CE1 4.39Å; L180-F337 HydrophobicContact CD2-CE2 3.48Å; L180-F337 VanDerWaalsContact CD2-CE2 3.48Å; L180-F337 HydrophobicContact CD2-CZ 3.58Å; L180-F337 HydrophobicContact CG-CE2 4.28Å; L180-F337 HydrophobicContact CG-CZ 4.36Å; L180-M340 HydrophobicContact CB-SD 4.08Å
181G92.3Very high89.1Confident7 Ų752.9 Ų52.97%0.07226%0.259CS..Hα-helixtrans-59-43172.200000112.8I177 I178 I179 V183 L184 F185I177-G181 PolarHBondContact O-N 2.89Å; I178-G181 PolarHBondContact O-N 2.91Å; I179-G181 VanDerWaalsContact C-N 3.34Å; I179-G181 PolarHBondContact O-N 3.1Å; G181-V183 VanDerWaalsContact C-N 3.3Å; G181-V183 PolarHBondContact O-N 3.33Å; G181-L184 PolarHBondContact O-N 3.22Å; G181-F185 PolarHBondContact O-N 3.31Å
182L90.5Very high88.4Confident102 Ų10248.6 Ų48.653%0.53424%0.243SC..Hα-helixtrans-63.9-34.3174.7-68.9173.2000112.5I178 I179 L180 F185I178-L182 HydrophobicContact CG2-CD1 4.32Å; I178-L182 WeakPolarHBondContact O-CG 3.27Å; I178-L182 PolarHBondContact O-N 3.42Å; I179-L182 PolarHBondContact O-N 2.86Å; L180-L182 VanDerWaalsContact C-N 3.35Å; L180-L182 PolarHBondContact O-N 3.15Å; L182-F185 HydrophobicContact CD2-CD2 3.98Å; L182-F185 HydrophobicContact CD2-CE2 3.99Å
183V89.3Confident88Confident27 Ų2749.9 Ų49.916%0.16425%0.249CC..Hα-helixtrans-67.1-42.8174.2176.10000110.8I179 L180 G181 F185 R186 L194 F337I179-V183 WeakPolarHBondContact O-CG2 3.17Å; I179-V183 PolarHBondContact O-N 3.04Å; I179-V183 VanDerWaalsContact O-N 3.12Å; L180-V183 WeakPolarHBondContact O-CB 3.25Å; L180-V183 PolarHBondContact O-N 2.88Å; L180-V183 VanDerWaalsContact O-N 3.15Å; G181-V183 VanDerWaalsContact C-N 3.3Å; G181-V183 PolarHBondContact O-N 3.33Å; V183-F185 PolarHBondContact O-N 3.04Å; V183-R186 WeakPolarHBondContact O-CB 3.21Å; V183-R186 PolarHBondContact O-N 2.85Å; V183-L194 HydrophobicContact CG1-CD1 3.77Å; V183-F337 HydrophobicContact CB-CE1 4.03Å; V183-F337 HydrophobicContact CB-CZ 4.07Å; V183-F337 HydrophobicContact CG1-CE1 3.81Å; V183-F337 HydrophobicContact CG1-CZ 3.82Å
184L87.7Confident87.7Confident6 Ų652.5 Ų52.53%0.03126%0.263CS..Hα-helixtrans-62-28.4179-74.1172.5000113.1L180 G181 R186 G187 S191 F337 M340 Y341 L374L180-L184 WeakPolarHBondContact O-CG 3.4Å; L180-L184 PolarHBondContact O-N 2.77Å; G181-L184 PolarHBondContact O-N 3.22Å; L184-R186 PolarHBondContact O-N 2.81Å; L184-R186 VanDerWaalsContact O-N 3.14Å; L184-G187 PolarHBondContact O-N 3.46Å; L184-G187 VanDerWaalsContact O-N 3.12Å; L184-S191 WeakPolarHBondContact CD2-OG 3.49Å; L184-F337 HydrophobicContact CD2-CD1 3.88Å; L184-F337 HydrophobicContact CD2-CE1 4.26Å; L184-F337 HydrophobicContact CG-CD1 4.07Å; L184-F337 HydrophobicContact CG-CE1 4.19Å; L184-M340 HydrophobicContact CD1-CB 3.34Å; L184-M340 HydrophobicContact CD1-CE 4.42Å; L184-M340 HydrophobicContact CD1-CG 4.49Å; L184-Y341 HydrophobicContact CD2-CD2 4.28Å; L184-L374 HydrophobicContact CB-CD2 3.85Å; L184-L374 HydrophobicContact CD1-CD1 4.31Å; L184-L374 HydrophobicContact CD1-CD2 4.49Å
185F88.2Confident87.2Confident56 Ų5652.1 Ų52.125%0.24626%0.259CS..THydrogen-bonded Turntrans-60.6-21.3174-68.6-36.8000114G181 L182 V183 G187 T367 V371 L374 S375G181-F185 PolarHBondContact O-N 3.31Å; L182-F185 HydrophobicContact CD2-CD2 3.98Å; L182-F185 HydrophobicContact CD2-CE2 3.99Å; V183-F185 PolarHBondContact O-N 3.04Å; F185-G187 PolarHBondContact O-N 3.25Å; F185-T367 WeakPolarHBondContact O-CB 3.39Å; F185-T367 WeakPolarHBondContact O-CG2 3.38Å; F185-T367 PolarHBondContact O-OG1 3.42Å; F185-V371 HydrophobicContact CD1-CG1 3.64Å; F185-V371 HydrophobicContact CE1-CB 4.11Å; F185-V371 HydrophobicContact CE1-CG1 3.7Å; F185-L374 HydrophobicContact CD1-CD2 3.73Å; F185-L374 HydrophobicContact CE1-CB 4.18Å; F185-L374 HydrophobicContact CE1-CD2 3.54Å; F185-L374 HydrophobicContact CE1-CG 3.98Å; F185-L374 HydrophobicContact CZ-CD2 4.35Å; F185-L374 HydrophobicContact CZ-CG 4.5Å; F185-S375 WeakPolarHBondContact CZ-OG 3.3Å
186R84.8Confident86.8Confident174 Ų17448.5 Ų48.566%0.65724%0.241SC*.THydrogen-bonded Turntrans-72.3-6.7177.1-68.2-176.7164.2115.5-3.2114V183 L184 L190V183-R186 WeakPolarHBondContact O-CB 3.21Å; V183-R186 PolarHBondContact O-N 2.85Å; L184-R186 PolarHBondContact O-N 2.81Å; L184-R186 VanDerWaalsContact O-N 3.14Å; R186-L190 HydrophobicContact CB-CD2 3.73Å; R186-L190 HydrophobicContact CG-CD2 4.4Å
187G80.4Confident86.7Confident5 Ų552 Ų525%0.05226%0.259CS..  trans111.9167.2169.800000115L184 F185 S191L184-G187 PolarHBondContact O-N 3.46Å; L184-G187 VanDerWaalsContact O-N 3.12Å; F185-G187 PolarHBondContact O-N 3.25Å; G187-S191 PolarHBondContact O-N 3.36Å; G187-S191 PolarHBondContact O-OG 2.9Å
188P75.9Confident86.5Confident31 Ų3153.2 Ų53.220%0.20127%0.265CS..Hα-helixtrans-70.3-38.7-167.824.7-33.9000114L190 S191 A192 Y341 T367P188-L190 PolarHBondContact O-N 2.68Å; P188-S191 WeakPolarHBondContact O-CB 3.48Å; P188-S191 PolarHBondContact O-N 2.97Å; P188-A192 PolarHBondContact O-N 3.47Å; P188-Y341 HydrophobicContact CB-CE2 4.02Å; P188-T367 VanDerWaalsContact CD-O 3.29Å; P188-T367 WeakPolarHBondContact CD-O 3.37Å
189K76.6Confident86.4Confident146 Ų14649 Ų4964%0.63524%0.244SC*.Hα-helixtrans-62.8-44.9-177.6-173.4178.4179.6-176.90112.3S191 A192 I193K189-S191 VanDerWaalsContact C-N 3.31Å; K189-A192 PolarHBondContact O-N 3.49Å; K189-I193 HydrophobicContact CG-CD1 4.16Å; K189-I193 WeakPolarHBondContact O-CG1 3.48Å; K189-I193 PolarHBondContact O-N 2.91Å; K189-I193 VanDerWaalsContact O-N 3.13Å
190L81.5Confident86.4Confident72 Ų7249 Ų4938%0.37724%0.243SC..Hα-helixtrans-63.6-42.7175.9179.963.8000110.3R186 P188 A192 I193 L194R186-L190 HydrophobicContact CB-CD2 3.73Å; R186-L190 HydrophobicContact CG-CD2 4.4Å; P188-L190 PolarHBondContact O-N 2.68Å; L190-A192 PolarHBondContact O-N 3.11Å; L190-I193 PolarHBondContact O-N 3.15Å; L190-L194 HydrophobicContact CD1-CD1 4.08Å; L190-L194 HydrophobicContact CD1-CG 4.11Å; L190-L194 HydrophobicContact CD2-CD1 4.42Å; L190-L194 HydrophobicContact CG-CD1 3.85Å; L190-L194 HydrophobicContact CG-CG 4.3Å; L190-L194 WeakPolarHBondContact O-CB 3.28Å; L190-L194 WeakPolarHBondContact O-CG 3.42Å; L190-L194 PolarHBondContact O-N 3.36Å
191S81.5Confident86.5Confident5 Ų552.7 Ų52.74%0.03526%0.262CS..Hα-helixtrans-59.2-44.7178.6-54.30000111.9L184 G187 P188 K189 N195L184-S191 WeakPolarHBondContact CD2-OG 3.49Å; G187-S191 PolarHBondContact O-N 3.36Å; G187-S191 PolarHBondContact O-OG 2.9Å; P188-S191 WeakPolarHBondContact O-CB 3.48Å; P188-S191 PolarHBondContact O-N 2.97Å; K189-S191 VanDerWaalsContact C-N 3.31Å; S191-N195 VanDerWaalsContact O-CB 3.3Å; S191-N195 WeakPolarHBondContact O-CB 3.37Å; S191-N195 PolarHBondContact O-N 3.19Å
192A78.3Confident86.5Confident14 Ų1452.4 Ų52.412%0.11626%0.259CS..Hα-helixtrans-64.6-45.3177.500000112.4L35 P188 K189 L190 N195 T196L35-A192 HydrophobicContact CD2-CB 3.81Å; P188-A192 PolarHBondContact O-N 3.47Å; K189-A192 PolarHBondContact O-N 3.49Å; L190-A192 PolarHBondContact O-N 3.11Å; A192-N195 PolarHBondContact O-N 3.23Å; A192-T196 WeakPolarHBondContact O-CB 3.45Å; A192-T196 PolarHBondContact O-N 2.67Å; A192-T196 PolarHBondContact O-OG1 2.9Å
193I85.3Confident86.7Confident84 Ų8448.5 Ų48.543%0.43124%0.239SC..Hα-helixtrans-63.1-47.2178.5-67.6167000110.9K189 L190 N195 T196 I197K189-I193 HydrophobicContact CG-CD1 4.16Å; K189-I193 WeakPolarHBondContact O-CG1 3.48Å; K189-I193 PolarHBondContact O-N 2.91Å; K189-I193 VanDerWaalsContact O-N 3.13Å; L190-I193 PolarHBondContact O-N 3.15Å; I193-N195 VanDerWaalsContact C-N 3.34Å; I193-N195 PolarHBondContact O-N 3.4Å; I193-T196 WeakPolarHBondContact O-CB 3.36Å; I193-T196 PolarHBondContact O-N 2.93Å; I193-I197 HydrophobicContact CG2-CD1 3.91Å; I193-I197 WeakPolarHBondContact O-CG1 3.37Å; I193-I197 PolarHBondContact O-N 3.03Å
194L86.5Confident87Confident56 Ų5651.7 Ų51.729%0.29326%0.258SS..Hα-helixtrans-60-45.7177.7-73.9174.4000111V183 L190 T196 I197 I198V183-L194 HydrophobicContact CG1-CD1 3.77Å; L190-L194 HydrophobicContact CD1-CD1 4.08Å; L190-L194 HydrophobicContact CD1-CG 4.11Å; L190-L194 HydrophobicContact CD2-CD1 4.42Å; L190-L194 HydrophobicContact CG-CD1 3.85Å; L190-L194 HydrophobicContact CG-CG 4.3Å; L190-L194 WeakPolarHBondContact O-CB 3.28Å; L190-L194 WeakPolarHBondContact O-CG 3.42Å; L190-L194 PolarHBondContact O-N 3.36Å; L194-T196 VanDerWaalsContact C-N 3.35Å; L194-T196 PolarHBondContact O-N 3.37Å; L194-I197 PolarHBondContact O-N 2.63Å; L194-I198 VanDerWaalsContact O-CG1 3.26Å; L194-I198 WeakPolarHBondContact O-CG1 3.48Å; L194-I198 PolarHBondContact O-N 2.89Å
195N84.8Confident87.4Confident4 Ų452.5 Ų52.52%0.02126%0.263CS..Hα-helixtrans-60.8-43177.2-176.269.4000112.4S191 A192 I193 I197 I198 T199 A334 T338S191-N195 VanDerWaalsContact O-CB 3.3Å; S191-N195 WeakPolarHBondContact O-CB 3.37Å; S191-N195 PolarHBondContact O-N 3.19Å; A192-N195 PolarHBondContact O-N 3.23Å; I193-N195 VanDerWaalsContact C-N 3.34Å; I193-N195 PolarHBondContact O-N 3.4Å; N195-I197 PolarHBondContact O-N 3.24Å; N195-I198 PolarHBondContact O-N 3.03Å; N195-T199 VanDerWaalsContact O-CB 3.23Å; N195-T199 WeakPolarHBondContact O-CB 3.3Å; N195-T199 PolarHBondContact O-N 3.36Å; N195-T199 PolarHBondContact O-OG1 2.69Å; N195-A334 PolarHBondContact OD1-O 2.98Å; N195-T338 PolarHBondContact OD1-OG1 2.64Å
196T87.9Confident87.7Confident24 Ų2450 Ų5015%0.14725%0.252CS..Hα-helixtrans-58-46.8175.8-76.20000111.7L42 A192 I193 L194 M200L42-T196 HydrophobicContact CD1-CG2 3.57Å; A192-T196 WeakPolarHBondContact O-CB 3.45Å; A192-T196 PolarHBondContact O-N 2.67Å; A192-T196 PolarHBondContact O-OG1 2.9Å; I193-T196 WeakPolarHBondContact O-CB 3.36Å; I193-T196 PolarHBondContact O-N 2.93Å; L194-T196 VanDerWaalsContact C-N 3.35Å; L194-T196 PolarHBondContact O-N 3.37Å; T196-M200 WeakPolarHBondContact O-CB 3.15Å; T196-M200 VanDerWaalsContact O-CG 3.23Å; T196-M200 WeakPolarHBondContact O-CG 3.31Å; T196-M200 PolarHBondContact O-N 2.89Å
197I91.8Very high88.2Confident91 Ų9146 Ų4647%0.46724%0.243SC..Hα-helixtrans-63.5-50.5179.3-66.4165.7000110.8I193 L194 N195 T199 M200 L201I193-I197 HydrophobicContact CG2-CD1 3.91Å; I193-I197 WeakPolarHBondContact O-CG1 3.37Å; I193-I197 PolarHBondContact O-N 3.03Å; L194-I197 PolarHBondContact O-N 2.63Å; N195-I197 PolarHBondContact O-N 3.24Å; I197-T199 VanDerWaalsContact C-N 3.34Å; I197-T199 PolarHBondContact O-N 3.04Å; I197-M200 PolarHBondContact O-N 3.16Å; I197-L201 HydrophobicContact CG2-CD1 4.09Å; I197-L201 WeakPolarHBondContact O-CG 3.3Å; I197-L201 PolarHBondContact O-N 2.95Å
198I92.8Very high88.9Confident27 Ų2749.8 Ų49.814%0.13826%0.262CS..Hα-helixtrans-62-44-178-65.8169.3000110.5L194 N195 L201 N202 L330 A334 F337L194-I198 VanDerWaalsContact O-CG1 3.26Å; L194-I198 WeakPolarHBondContact O-CG1 3.48Å; L194-I198 PolarHBondContact O-N 2.89Å; N195-I198 PolarHBondContact O-N 3.03Å; I198-L201 PolarHBondContact O-N 2.89Å; I198-N202 WeakPolarHBondContact O-CB 3.22Å; I198-N202 PolarHBondContact O-N 3.2Å; I198-L330 HydrophobicContact CG2-CB 3.94Å; I198-L330 HydrophobicContact CG2-CD2 4.08Å; I198-L330 WeakPolarHBondContact CG2-O 3.24Å; I198-A334 HydrophobicContact CG2-CB 3.86Å; I198-F337 HydrophobicContact CD1-CD2 4.18Å; I198-F337 HydrophobicContact CD1-CE2 4.06Å
199T92.6Very high89.8Confident0 Ų048.4 Ų48.40%025%0.253CS..Hα-helixtrans-64.1-43.9179.3-58.50000111.5L42 I45 G46 N195 I197 N202 L203L42-T199 HydrophobicContact CD2-CG2 4.16Å; I45-T199 HydrophobicContact CB-CG2 4.33Å; I45-T199 HydrophobicContact CG2-CG2 4.11Å; G46-T199 WeakPolarHBondContact CA-OG1 3.39Å; N195-T199 VanDerWaalsContact O-CB 3.23Å; N195-T199 WeakPolarHBondContact O-CB 3.3Å; N195-T199 PolarHBondContact O-N 3.36Å; N195-T199 PolarHBondContact O-OG1 2.69Å; I197-T199 VanDerWaalsContact C-N 3.34Å; I197-T199 PolarHBondContact O-N 3.04Å; T199-N202 PolarHBondContact O-N 2.99Å; T199-L203 HydrophobicContact CG2-CD1 4.2Å; T199-L203 HydrophobicContact CG2-CG 4.38Å; T199-L203 WeakPolarHBondContact O-CB 3.42Å; T199-L203 WeakPolarHBondContact O-CG 3.39Å; T199-L203 PolarHBondContact O-N 3.49Å
200M93.3Very high90.7Very high86 Ų8641.9 Ų41.942%0.42423%0.225SC..Hα-helixtrans-62.5-44.7178.4-75.4-71-92.800111.8F38 L42 T196 I197 L203 V204F38-M200 HydrophobicContact CZ-CE 4.16Å; F38-M200 HydrophobicContact CZ-SD 4.47Å; L42-M200 HydrophobicContact CD1-CG 3.83Å; L42-M200 HydrophobicContact CD1-SD 4.06Å; L42-M200 HydrophobicContact CD2-CG 4.29Å; L42-M200 HydrophobicContact CD2-SD 3.88Å; T196-M200 WeakPolarHBondContact O-CB 3.15Å; T196-M200 VanDerWaalsContact O-CG 3.23Å; T196-M200 WeakPolarHBondContact O-CG 3.31Å; T196-M200 PolarHBondContact O-N 2.89Å; I197-M200 PolarHBondContact O-N 3.16Å; M200-L203 PolarHBondContact O-N 2.98Å; M200-V204 WeakPolarHBondContact O-CG2 3.38Å; M200-V204 PolarHBondContact O-N 3.23Å
201L94.1Very high91.4Very high89 Ų8942.1 Ų42.147%0.46623%0.232SC..Hα-helixtrans-62-44.5176.1-70.5172.8000111.7I197 I198 L203 V204 V205 L330I197-L201 HydrophobicContact CG2-CD1 4.09Å; I197-L201 WeakPolarHBondContact O-CG 3.3Å; I197-L201 PolarHBondContact O-N 2.95Å; I198-L201 PolarHBondContact O-N 2.89Å; L201-L203 PolarHBondContact O-N 3.48Å; L201-V204 PolarHBondContact O-N 3.34Å; L201-V205 WeakPolarHBondContact O-CG2 3.32Å; L201-V205 PolarHBondContact O-N 3.37Å; L201-L330 HydrophobicContact CB-CD1 3.84Å; L201-L330 HydrophobicContact CD1-CD1 4.36Å
202N93.3Very high92Very high1 Ų143.5 Ų43.51%0.00524%0.24CC..Hα-helixtrans-57.2-49.2174.3172.534.8000111.4Y54 I198 T199 V204 V205 I206 G327 L330 G331Y54-N202 WeakPolarHBondContact CE2-OD1 3.47Å; Y54-N202 PolarHBondContact OH-OD1 2.8Å; I198-N202 WeakPolarHBondContact O-CB 3.22Å; I198-N202 PolarHBondContact O-N 3.2Å; T199-N202 PolarHBondContact O-N 2.99Å; N202-V204 VanDerWaalsContact C-N 3.33Å; N202-V204 PolarHBondContact O-N 3.12Å; N202-V205 PolarHBondContact O-N 2.93Å; N202-V205 VanDerWaalsContact O-N 3.15Å; N202-I206 WeakPolarHBondContact O-CG2 3.2Å; N202-I206 PolarHBondContact O-N 3.19Å; N202-G327 PolarHBondContact OD1-O 3.04Å; N202-L330 HydrophobicContact CB-CB 4.33Å; N202-G331 WeakPolarHBondContact ND2-CA 3.49Å
203L94.8Very high92.8Very high20 Ų2042.8 Ų42.811%0.10524%0.235CC..Hα-helixtrans-58-43.6178.8-75176.8000112.4L42 I45 T199 M200 L201 V205 I206 I207 L285L42-L203 HydrophobicContact CD2-CD1 4.21Å; I45-L203 HydrophobicContact CG2-CD1 3.88Å; I45-L203 HydrophobicContact CG2-CD2 3.73Å; I45-L203 HydrophobicContact CG2-CG 4.13Å; T199-L203 HydrophobicContact CG2-CD1 4.2Å; T199-L203 HydrophobicContact CG2-CG 4.38Å; T199-L203 WeakPolarHBondContact O-CB 3.42Å; T199-L203 WeakPolarHBondContact O-CG 3.39Å; T199-L203 PolarHBondContact O-N 3.49Å; M200-L203 PolarHBondContact O-N 2.98Å; L201-L203 PolarHBondContact O-N 3.48Å; L203-V205 VanDerWaalsContact C-N 3.35Å; L203-V205 PolarHBondContact O-N 3.4Å; L203-I206 VanDerWaalsContact O-CG2 3.31Å; L203-I206 WeakPolarHBondContact O-CG2 3.48Å; L203-I207 VanDerWaalsContact O-CB 3.29Å; L203-I207 WeakPolarHBondContact O-CB 3.21Å; L203-I207 WeakPolarHBondContact O-CD1 3.33Å; L203-I207 WeakPolarHBondContact O-CG1 3.23Å; L203-I207 PolarHBondContact O-N 3.34Å; L203-L285 HydrophobicContact CD2-CD2 4.05Å
204V95.3Very high93.3Very high94 Ų9442.5 Ų42.557%0.5723%0.23SC*.Hα-helixtrans-60.5-46176.2170.40000110.8M200 L201 N202 L208M200-V204 WeakPolarHBondContact O-CG2 3.38Å; M200-V204 PolarHBondContact O-N 3.23Å; L201-V204 PolarHBondContact O-N 3.34Å; N202-V204 VanDerWaalsContact C-N 3.33Å; N202-V204 PolarHBondContact O-N 3.12Å; V204-L208 VanDerWaalsContact O-CB 3.26Å; V204-L208 WeakPolarHBondContact O-CB 3.14Å; V204-L208 PolarHBondContact O-N 3.03Å
205V95.1Very high93.6Very high23 Ų2343.3 Ų43.314%0.13925%0.245CC..Hα-helixtrans-63.4-48.5-179.3172.10000111.5L201 N202 L203 L208 A209 I323 T324L201-V205 WeakPolarHBondContact O-CG2 3.32Å; L201-V205 PolarHBondContact O-N 3.37Å; N202-V205 PolarHBondContact O-N 2.93Å; N202-V205 VanDerWaalsContact O-N 3.15Å; L203-V205 VanDerWaalsContact C-N 3.35Å; L203-V205 PolarHBondContact O-N 3.4Å; V205-L208 PolarHBondContact O-N 3.49Å; V205-A209 VanDerWaalsContact O-CB 3.25Å; V205-A209 WeakPolarHBondContact O-CB 3.15Å; V205-A209 PolarHBondContact O-N 3.27Å; V205-I323 HydrophobicContact CG1-CG2 3.97Å; V205-I323 WeakPolarHBondContact CG1-O 3.33Å; V205-I323 HydrophobicContact CG2-CG2 4.14Å; V205-T324 HydrophobicContact CG1-CG2 4.47Å
206I94.7Very high93.8Very high3 Ų349.9 Ų49.92%0.01527%0.27CS..Hα-helixtrans-69.2-36-177.4-169.464.7000112.3I53 Y54 N202 L203 T210 L285 F308I53-I206 HydrophobicContact CD1-CD1 3.89Å; I53-I206 HydrophobicContact CD1-CG1 3.91Å; Y54-I206 HydrophobicContact CE1-CD1 4.06Å; N202-I206 WeakPolarHBondContact O-CG2 3.2Å; N202-I206 PolarHBondContact O-N 3.19Å; L203-I206 VanDerWaalsContact O-CG2 3.31Å; L203-I206 WeakPolarHBondContact O-CG2 3.48Å; I206-T210 VanDerWaalsContact O-CB 3.29Å; I206-T210 WeakPolarHBondContact O-CB 3.35Å; I206-T210 PolarHBondContact O-N 3.38Å; I206-T210 PolarHBondContact O-OG1 3.46Å; I206-L285 HydrophobicContact CG1-CD1 4.05Å; I206-L285 HydrophobicContact CG1-CD2 4.43Å; I206-L285 HydrophobicContact CG1-CG 4.46Å; I206-L285 HydrophobicContact CG2-CD1 3.77Å; I206-L285 HydrophobicContact CG2-CD2 3.81Å; I206-L285 HydrophobicContact CG2-CG 4.35Å; I206-F308 HydrophobicContact CD1-CD1 4.18Å; I206-F308 HydrophobicContact CD1-CE1 4.14Å; I206-F308 HydrophobicContact CD1-CG 4.43Å; I206-F308 HydrophobicContact CD1-CZ 4.34Å
207I95.9Very high93.8Very high91 Ų9151.9 Ų51.947%0.46728%0.283SS..Hα-helixtrans-64.6-47.5174.3-69.7167.2000109.7L203 A209 T210 C211 L285L203-I207 VanDerWaalsContact O-CB 3.29Å; L203-I207 WeakPolarHBondContact O-CB 3.21Å; L203-I207 WeakPolarHBondContact O-CD1 3.33Å; L203-I207 WeakPolarHBondContact O-CG1 3.23Å; L203-I207 PolarHBondContact O-N 3.34Å; I207-A209 PolarHBondContact O-N 3Å; I207-T210 WeakPolarHBondContact O-CB 2.88Å; I207-T210 PolarHBondContact O-N 3.04Å; I207-C211 PolarHBondContact O-N 2.72Å; I207-C211 PolarHBondContact O-SG 3.42Å; I207-L285 HydrophobicContact CG1-CD1 4.14Å
208L94.8Very high93.4Very high84 Ų8448.7 Ų48.744%0.4427%0.267SS..Hα-helixtrans-63.5-43.2179-172.6130.8000111.8V204 V205 T210 C211 V212V204-L208 VanDerWaalsContact O-CB 3.26Å; V204-L208 WeakPolarHBondContact O-CB 3.14Å; V204-L208 PolarHBondContact O-N 3.03Å; V205-L208 PolarHBondContact O-N 3.49Å; L208-T210 VanDerWaalsContact C-N 3.34Å; L208-T210 PolarHBondContact O-N 3Å; L208-C211 PolarHBondContact O-N 2.79Å; L208-V212 HydrophobicContact CD2-CG2 4.37Å; L208-V212 WeakPolarHBondContact O-CG2 3.47Å; L208-V212 PolarHBondContact O-N 3.19Å
209A94.7Very high92.6Very high3 Ų355.6 Ų55.63%0.02530%0.298CS..Hα-helixtrans-57.6-46.7174.100000111.6V205 I207 C211 V212 M213 F312 T324V205-A209 VanDerWaalsContact O-CB 3.25Å; V205-A209 WeakPolarHBondContact O-CB 3.15Å; V205-A209 PolarHBondContact O-N 3.27Å; I207-A209 PolarHBondContact O-N 3Å; A209-C211 PolarHBondContact O-N 2.88Å; A209-V212 PolarHBondContact O-N 3.29Å; A209-M213 WeakPolarHBondContact O-CB 3.31Å; A209-M213 VanDerWaalsContact O-CG 3.26Å; A209-M213 WeakPolarHBondContact O-CG 3.3Å; A209-M213 PolarHBondContact O-N 2.92Å; A209-F312 HydrophobicContact CB-CE2 4.03Å; A209-F312 HydrophobicContact CB-CZ 4.4Å; A209-T324 HydrophobicContact CB-CG2 3.69Å
210T95.6Very high91.2Very high8 Ų864 Ų645%0.04934%0.337CS..Hα-helixtrans-60.7-44.3177-58.80000111.3I206 I207 L208 M213 F214 L288 A289 A292I206-T210 VanDerWaalsContact O-CB 3.29Å; I206-T210 WeakPolarHBondContact O-CB 3.35Å; I206-T210 PolarHBondContact O-N 3.38Å; I206-T210 PolarHBondContact O-OG1 3.46Å; I207-T210 WeakPolarHBondContact O-CB 2.88Å; I207-T210 PolarHBondContact O-N 3.04Å; L208-T210 VanDerWaalsContact C-N 3.34Å; L208-T210 PolarHBondContact O-N 3Å; T210-M213 PolarHBondContact O-N 2.9Å; T210-F214 HydrophobicContact CG2-CD2 3.87Å; T210-F214 HydrophobicContact CG2-CE2 3.67Å; T210-F214 VanDerWaalsContact O-CD2 3.28Å; T210-F214 WeakPolarHBondContact O-CD2 3.35Å; T210-F214 PolarHBondContact O-N 3.16Å; T210-L288 HydrophobicContact CG2-CB 4.1Å; T210-A289 HydrophobicContact CG2-CB 4.47Å; T210-A289 WeakPolarHBondContact OG1-CB 3.28Å; T210-A292 HydrophobicContact CG2-CB 3.84Å
211C96.2Very high89.6Confident77 Ų7761.5 Ų61.552%0.5233%0.328SS..Hα-helixtrans-63.1-44.3176.7-700000112.6I207 L208 A209 M213 F214 A215I207-C211 PolarHBondContact O-N 2.72Å; I207-C211 PolarHBondContact O-SG 3.42Å; L208-C211 PolarHBondContact O-N 2.79Å; A209-C211 PolarHBondContact O-N 2.88Å; C211-M213 VanDerWaalsContact C-N 3.33Å; C211-M213 PolarHBondContact O-N 3.35Å; C211-F214 PolarHBondContact O-N 2.91Å; C211-A215 WeakPolarHBondContact O-CB 3.26Å; C211-A215 PolarHBondContact O-N 2.88Å
212V94.9Very high87.9Confident34 Ų3462.9 Ų62.921%0.20635%0.345CS..Hα-helixtrans-63.3-41.7177.1173.50000110.8L208 A209 A215 R216 F312L208-V212 HydrophobicContact CD2-CG2 4.37Å; L208-V212 WeakPolarHBondContact O-CG2 3.47Å; L208-V212 PolarHBondContact O-N 3.19Å; A209-V212 PolarHBondContact O-N 3.29Å; V212-A215 PolarHBondContact O-N 3.34Å; V212-R216 PolarHBondContact O-N 2.95Å; V212-R216 VanDerWaalsContact O-N 3.09Å; V212-F312 HydrophobicContact CB-CE1 4.46Å; V212-F312 HydrophobicContact CB-CZ 4.33Å; V212-F312 HydrophobicContact CG1-CE1 3.79Å; V212-F312 HydrophobicContact CG1-CZ 4.16Å
213M94.7Very high86.8Confident0 Ų067.7 Ų67.70%037%0.368CS..Hα-helixtrans-61.3-43.8177-76.9176.116400112A209 T210 C211 A215 R216 A292 L293 F296 F308 A311 F312A209-M213 WeakPolarHBondContact O-CB 3.31Å; A209-M213 VanDerWaalsContact O-CG 3.26Å; A209-M213 WeakPolarHBondContact O-CG 3.3Å; A209-M213 PolarHBondContact O-N 2.92Å; T210-M213 PolarHBondContact O-N 2.9Å; C211-M213 VanDerWaalsContact C-N 3.33Å; C211-M213 PolarHBondContact O-N 3.35Å; M213-A215 VanDerWaalsContact C-N 3.35Å; M213-A215 PolarHBondContact O-N 3.48Å; M213-R216 CarbonylContact O-C 3.5Å; M213-R216 PolarHBondContact O-N 2.81Å; M213-A292 HydrophobicContact CB-CB 3.74Å; M213-L293 HydrophobicContact CE-CD1 3.8Å; M213-L293 HydrophobicContact SD-CB 4.4Å; M213-L293 HydrophobicContact SD-CD1 4.4Å; M213-F296 HydrophobicContact CB-CB 3.92Å; M213-F296 HydrophobicContact CB-CD2 4.14Å; M213-F296 HydrophobicContact CB-CG 4.08Å; M213-F296 HydrophobicContact CE-CD1 3.93Å; M213-F296 HydrophobicContact CE-CE1 4.38Å; M213-F296 HydrophobicContact CE-CG 4.49Å; M213-F296 HydrophobicContact CG-CB 3.84Å; M213-F296 HydrophobicContact CG-CD1 3.96Å; M213-F296 HydrophobicContact CG-CD2 3.97Å; M213-F296 HydrophobicContact CG-CE1 4.5Å; M213-F296 HydrophobicContact CG-CG 3.66Å; M213-F308 HydrophobicContact CE-CB 4.47Å; M213-F308 HydrophobicContact CE-CD1 3.92Å; M213-F308 HydrophobicContact SD-CD1 4.01Å; M213-F308 HydrophobicContact SD-CE1 4.4Å; M213-A311 HydrophobicContact CE-CB 4.04Å; M213-F312 HydrophobicContact CE-CD2 4Å; M213-F312 HydrophobicContact CE-CE2 3.54Å; M213-F312 HydrophobicContact CE-CZ 3.98Å; M213-F312 HydrophobicContact CG-CE1 4.46Å; M213-F312 HydrophobicContact CG-CE2 4.3Å; M213-F312 HydrophobicContact CG-CZ 3.81Å; M213-F312 HydrophobicContact SD-CE2 4.44Å
214F94.4Very high85.9Confident77 Ų7769.8 Ų69.834%0.33838%0.376SS..Hα-helixtrans-65.6-34.9173.4-82.9-59.4000113.5T210 C211 R216 L288 L291 A292 L295T210-F214 HydrophobicContact CG2-CD2 3.87Å; T210-F214 HydrophobicContact CG2-CE2 3.67Å; T210-F214 VanDerWaalsContact O-CD2 3.28Å; T210-F214 WeakPolarHBondContact O-CD2 3.35Å; T210-F214 PolarHBondContact O-N 3.16Å; C211-F214 PolarHBondContact O-N 2.91Å; F214-R216 VanDerWaalsContact C-N 3.26Å; F214-R216 PolarHBondContact O-N 2.67Å; F214-L288 HydrophobicContact CE2-CB 4.26Å; F214-L288 HydrophobicContact CE2-CD2 4.4Å; F214-L288 WeakPolarHBondContact CE2-O 3.38Å; F214-L288 HydrophobicContact CZ-CD2 4.39Å; F214-L288 WeakPolarHBondContact CZ-O 3.41Å; F214-L291 HydrophobicContact CE1-CD2 4.15Å; F214-L291 HydrophobicContact CE1-CG 4.03Å; F214-L291 HydrophobicContact CZ-CB 4.24Å; F214-L291 HydrophobicContact CZ-CD2 4.08Å; F214-L291 HydrophobicContact CZ-CG 4.08Å; F214-A292 HydrophobicContact CD1-CB 4.29Å; F214-A292 HydrophobicContact CD2-CB 3.73Å; F214-A292 HydrophobicContact CE1-CB 4.17Å; F214-A292 HydrophobicContact CE2-CB 3.61Å; F214-A292 HydrophobicContact CG-CB 4.07Å; F214-A292 HydrophobicContact CZ-CB 3.82Å; F214-L295 HydrophobicContact CD1-CD1 3.83Å; F214-L295 HydrophobicContact CE1-CD1 3.59Å
215A93.2Very high85.2Confident73 Ų7366.3 Ų66.360%0.60336%0.357SS*.Hα-helixtrans-73.5-17.5179.100000113.3C211 V212 M213C211-A215 WeakPolarHBondContact O-CB 3.26Å; C211-A215 PolarHBondContact O-N 2.88Å; V212-A215 PolarHBondContact O-N 3.34Å; M213-A215 VanDerWaalsContact C-N 3.35Å; M213-A215 PolarHBondContact O-N 3.48Å
216R90.2Very high84.5Confident143 Ų14365.9 Ų65.954%0.5436%0.355SS..SBendtrans-131.260.1-175-63.1-63.3-173116.21.1112.2V212 M213 F214 F296 Y317V212-R216 PolarHBondContact O-N 2.95Å; V212-R216 VanDerWaalsContact O-N 3.09Å; M213-R216 CarbonylContact O-C 3.5Å; M213-R216 PolarHBondContact O-N 2.81Å; F214-R216 VanDerWaalsContact C-N 3.26Å; F214-R216 PolarHBondContact O-N 2.67Å; R216-F296 HydrophobicContact CB-CD2 4.39Å; R216-F296 HydrophobicContact CB-CE2 4.01Å; R216-F296 WeakPolarHBondContact O-CD2 3.38Å; R216-Y317 PolarHBondContact NH1-OH 2.82Å
217P86.8Confident83.8Confident65 Ų6569.6 Ų69.642%0.42239%0.387SS..  trans-62.1164.917929.2-35.1000111.9E219 R315P217-E219 PolarHBondContact O-N 3.21Å; P217-R315 PolarHBondContact O-NH2 3.35Å
218N83.9Confident83.1Confident25 Ų2570.1 Ų70.113%0.13440%0.398CS..  trans-73.9106.9177.6-168.723.3000113.1H220 S221 L295 R315N218-H220 VanDerWaalsContact C-N 3.3Å; N218-H220 PolarHBondContact O-N 2.93Å; N218-H220 PolarHBondContact OD1-N 2.78Å; N218-S221 WeakPolarHBondContact CB-OG 3.42Å; N218-S221 PolarHBondContact ND2-OG 3.11Å; N218-L295 PolarHBondContact N-O 3.16Å; N218-R315 VanDerWaalsContact CB-NH2 3.28Å
219E75.2Confident82.6Confident171 Ų17169.8 Ų69.880%0.79939%0.394SS*.THydrogen-bonded Turntrans-64.6-32177.5-63.1179-176.700113P217P217-E219 PolarHBondContact O-N 3.21Å
220H63.6Low82.1Confident176 Ų17671.9 Ų71.982%0.81542%0.416SS*.THydrogen-bonded Turntrans-77.4-23.9-173.4-71.575.4000113.2N218N218-H220 VanDerWaalsContact C-N 3.3Å; N218-H220 PolarHBondContact O-N 2.93Å; N218-H220 PolarHBondContact OD1-N 2.78Å
221S60.2Low81.8Confident34 Ų3472.1 Ų72.124%0.23842%0.42CS..  trans-101.890.6169.456.80000107.4N218 E223N218-S221 WeakPolarHBondContact CB-OG 3.42Å; N218-S221 PolarHBondContact ND2-OG 3.11Å; S221-E223 PolarHBondContact O-N 3.46Å
222S58.5Low81.5Confident118 Ų11871.3 Ų71.383%0.82541%0.41SS*.SBendtrans-55.4-11.4176.152.20000113.7
223E69.6Low81.4Confident102 Ų10273.2 Ų73.248%0.47742%0.416SS..SBendtrans-118.5125.7176.4-66.5173.7-168.600110.2S221 A225 P226 A227S221-E223 PolarHBondContact O-N 3.46Å; E223-A225 PolarHBondContact O-N 2.9Å; E223-P226 HydrophobicContact CB-CB 4.2Å; E223-P226 VanDerWaalsContact OE2-CA 3.25Å; E223-P226 WeakPolarHBondContact OE2-CA 3.42Å; E223-A227 PolarHBondContact OE2-N 3.41Å
224F76.8Confident81.3Confident64 Ų6474.9 Ų74.928%0.28143%0.427SS..SBendtrans-51.4-35.5168.6164.7-116.8000112.2P67 F70 L232 L291 T294 L295P67-F224 HydrophobicContact CB-CE1 3.94Å; P67-F224 HydrophobicContact CB-CE2 4.42Å; P67-F224 HydrophobicContact CB-CZ 3.84Å; F70-F224 HydrophobicContact CE1-CE1 4.37Å; F70-F224 HydrophobicContact CE1-CZ 4.26Å; F224-L232 HydrophobicContact CD1-CD1 4.44Å; F224-L232 HydrophobicContact CE1-CD1 3.7Å; F224-L291 HydrophobicContact CE1-CD1 4.32Å; F224-L291 HydrophobicContact CE2-CD1 3.72Å; F224-L291 HydrophobicContact CZ-CD1 3.47Å; F224-L291 VanDerWaalsContact CZ-CD1 3.47Å; F224-T294 WeakPolarHBondContact CE2-OG1 3.49Å; F224-L295 HydrophobicContact CB-CD2 3.98Å; F224-L295 HydrophobicContact CD2-CD2 3.29Å; F224-L295 HydrophobicContact CD2-CG 3.57Å; F224-L295 HydrophobicContact CE2-CD2 4.02Å; F224-L295 HydrophobicContact CE2-CG 3.78Å; F224-L295 HydrophobicContact CG-CD2 3.92Å
225A79.8Confident81Confident21 Ų2176 Ų7617%0.17443%0.43CS..SBendtrans-139.184.5-177.500000108.6P67 E223 G231 L232P67-A225 HydrophobicContact CB-CB 4.15Å; P67-A225 HydrophobicContact CG-CB 4.03Å; E223-A225 PolarHBondContact O-N 2.9Å; A225-G231 WeakPolarHBondContact O-CA 3.38Å; A225-L232 HydrophobicContact CB-CB 4.34Å
226P81.2Confident80.8Confident15 Ų1574.1 Ų74.110%0.09742%0.417CS..  trans-66.7136.8-171.321.6-28000111.9E223 S228 H229 G231 W300E223-P226 HydrophobicContact CB-CB 4.2Å; E223-P226 VanDerWaalsContact OE2-CA 3.25Å; E223-P226 WeakPolarHBondContact OE2-CA 3.42Å; P226-S228 PolarHBondContact O-N 3.07Å; P226-H229 HydrophobicContact CG-CB 4.39Å; P226-H229 PolarHBondContact O-N 3.17Å; P226-G231 PolarHBondContact O-N 2.96Å; P226-G231 VanDerWaalsContact O-N 3.09Å; P226-W300 HydrophobicContact CG-CH2 3.67Å; P226-W300 HydrophobicContact CG-CZ3 3.67Å
227A79.4Confident80.6Confident81 Ų8173.8 Ų73.867%0.66942%0.42SS*.G310 helixtrans-59.1-30.7-179.600000112.6E223 H229 G230E223-A227 PolarHBondContact OE2-N 3.41Å; A227-H229 PolarHBondContact O-N 2.71Å; A227-G230 PolarHBondContact O-N 3.45Å; A227-G230 VanDerWaalsContact O-N 3.1Å
228S82.6Confident80.4Confident102 Ų10273 Ų7371%0.71342%0.424SS*.G310 helixtrans-61.6-22176.5580000114.2P226P226-S228 PolarHBondContact O-N 3.07Å
229H83.1Confident80.5Confident77 Ų7772.5 Ų72.536%0.35643%0.425SS..G310 helixtrans-113.725.8178-65.271.4000111.3P226 A227 P234 W299 W300P226-H229 HydrophobicContact CG-CB 4.39Å; P226-H229 PolarHBondContact O-N 3.17Å; A227-H229 PolarHBondContact O-N 2.71Å; H229-P234 WeakPolarHBondContact O-CB 3.24Å; H229-W299 HydrophobicContact CB-CZ2 3.98Å; H229-W299 WeakPolarHBondContact O-CZ2 3.33Å; H229-W300 HydrophobicContact CB-CE3 4.01Å; H229-W300 HydrophobicContact CB-CZ3 3.81Å; H229-W300 AromaticContact CD2-CD2 3.57Å; H229-W300 AromaticContact CD2-CE2 3.82Å; H229-W300 AromaticContact CD2-CE3 3.51Å; H229-W300 AromaticContact CD2-CH2 3.96Å; H229-W300 AromaticContact CD2-CZ3 3.72Å; H229-W300 AromaticContact CE1-CH2 3.77Å; H229-W300 AromaticContact CE1-CZ2 3.73Å; H229-W300 AromaticContact CG-CE3 3.74Å; H229-W300 AromaticContact CG-CH2 3.83Å; H229-W300 AromaticContact CG-CZ3 3.52Å; H229-W300 AromaticContact ND1-CH2 3.7Å; H229-W300 AromaticContact ND1-CZ3 3.87Å; H229-W300 AromaticContact NE2-CD2 3.88Å; H229-W300 AromaticContact NE2-CE2 3.61Å; H229-W300 AromaticContact NE2-CH2 3.94Å; H229-W300 AromaticContact NE2-CZ2 3.64Å
230G83.4Confident81.3Confident46 Ų4665 Ų6547%0.47439%0.39SS..THydrogen-bonded Turntrans87.18175.300000115.5A227 F233A227-G230 PolarHBondContact O-N 3.45Å; A227-G230 VanDerWaalsContact O-N 3.1Å; G230-F233 CarbonylContact O-C 3.52Å
231G89.7Confident82.4Confident14 Ų1459.7 Ų59.714%0.14437%0.367CS..THydrogen-bonded Turntrans67.3-148.5175.400000113.4A225 P226 F233A225-G231 WeakPolarHBondContact O-CA 3.38Å; P226-G231 PolarHBondContact O-N 2.96Å; P226-G231 VanDerWaalsContact O-N 3.09Å; G231-F233 VanDerWaalsContact C-N 3.28Å; G231-F233 PolarHBondContact O-N 2.87Å
232L91Very high83.5Confident60 Ų6058.9 Ų58.931%0.31436%0.363SS..THydrogen-bonded Turntrans-66.1-31-177-17761.8000112.6P67 S68 F70 F224 A225 P234P67-L232 HydrophobicContact CB-CD1 4.06Å; S68-L232 WeakPolarHBondContact CB-O 3.45Å; S68-L232 PolarHBondContact N-O 3.48Å; F70-L232 HydrophobicContact CE1-CD1 4.18Å; F224-L232 HydrophobicContact CD1-CD1 4.44Å; F224-L232 HydrophobicContact CE1-CD1 3.7Å; A225-L232 HydrophobicContact CB-CB 4.34Å; L232-P234 VanDerWaalsContact O-CD 3.26Å; L232-P234 WeakPolarHBondContact O-CD 3.38Å
233F92.8Very high84.8Confident74 Ų7453.2 Ų53.233%0.32532%0.324SS..  trans-119.767.3-175.8-61.8-79.6000111L71 G230 G231 Y235 G236 M240L71-F233 HydrophobicContact CD1-CE1 4.21Å; L71-F233 HydrophobicContact CD1-CZ 4.03Å; G230-F233 CarbonylContact O-C 3.52Å; G231-F233 VanDerWaalsContact C-N 3.28Å; G231-F233 PolarHBondContact O-N 2.87Å; F233-Y235 PolarHBondContact O-N 3.33Å; F233-G236 WeakPolarHBondContact O-CA 3.4Å; F233-G236 PolarHBondContact O-N 3.21Å; F233-M240 HydrophobicContact CD1-CB 4.11Å; F233-M240 HydrophobicContact CE1-CB 4.09Å; F233-M240 HydrophobicContact CE1-CE 4.29Å; F233-M240 HydrophobicContact CE1-CG 4.18Å
234P91.6Very high85.8Confident35 Ų3548.7 Ų48.723%0.22730%0.304CS..THydrogen-bonded Turntrans-61.9-31-177.124.4-33000113H229 L232 W299H229-P234 WeakPolarHBondContact O-CB 3.24Å; L232-P234 VanDerWaalsContact O-CD 3.26Å; L232-P234 WeakPolarHBondContact O-CD 3.38Å; P234-W299 HydrophobicContact CB-CH2 3.74Å; P234-W299 HydrophobicContact CB-CZ2 3.62Å; P234-W299 HydrophobicContact CG-CH2 3.85Å; P234-W299 HydrophobicContact CG-CZ2 3.76Å; P234-W299 HydrophobicContact CG-CZ3 4.35Å
235Y89.5Confident86.1Confident101 Ų10147 Ų4740%0.39630%0.304SS..THydrogen-bonded Turntrans-98.615.3175.1-59.6-78.9000112.8R62 K64 F233 G239 W299R62-Y235 PolarHBondContact O-OH 2.98Å; K64-Y235 WeakPolarHBondContact O-CB 3.33Å; K64-Y235 WeakPolarHBondContact O-CD2 3.23Å; K64-Y235 VanDerWaalsContact O-CG 3.23Å; F233-Y235 PolarHBondContact O-N 3.33Å; Y235-G239 WeakPolarHBondContact O-CA 3.37Å; Y235-G239 PolarHBondContact O-N 3.06Å; Y235-G239 VanDerWaalsContact O-N 3.13Å; Y235-W299 HydrophobicContact CE2-CH2 4.27Å; Y235-W299 AromaticContact CE2-CZ3 3.95Å; Y235-W299 HydrophobicContact CE2-CZ3 3.95Å
236G88.7Confident86.3Confident33 Ų3347 Ų4734%0.3430%0.302SS..Hα-helixtrans66.3-179.9-173.100000113.8F233 G238 G239 M240F233-G236 WeakPolarHBondContact O-CA 3.4Å; F233-G236 PolarHBondContact O-N 3.21Å; G236-G238 PolarHBondContact O-N 2.84Å; G236-G239 PolarHBondContact O-N 3.48Å; G236-G239 VanDerWaalsContact O-N 3.12Å; G236-M240 PolarHBondContact O-N 3.01Å
237F85Confident86.6Confident135 Ų13546.3 Ų46.359%0.59230%0.297SS*.Hα-helixtrans-61.8-34.3177-171.7-98.8000112.1G239 M240 I241F237-G239 VanDerWaalsContact C-N 3.29Å; F237-G239 PolarHBondContact O-N 3.22Å; F237-M240 HydrophobicContact CD2-CE 4.16Å; F237-M240 HydrophobicContact CE2-CE 3.64Å; F237-M240 HydrophobicContact CZ-CE 4.28Å; F237-M240 PolarHBondContact O-N 2.95Å; F237-I241 HydrophobicContact CD1-CG1 3.99Å; F237-I241 HydrophobicContact CE1-CD1 4.02Å; F237-I241 HydrophobicContact CE1-CG1 3.61Å; F237-I241 HydrophobicContact CZ-CD1 4.01Å; F237-I241 HydrophobicContact CZ-CG1 4.06Å; F237-I241 WeakPolarHBondContact O-CG1 3.42Å; F237-I241 PolarHBondContact O-N 3.3Å
238G83.4Confident87Confident50 Ų5042.6 Ų42.652%0.51527%0.266SS..Hα-helixtrans-62-34.5174.700000113.3G236 G242G236-G238 PolarHBondContact O-N 2.84Å; G238-G242 PolarHBondContact O-N 2.8Å
239G86.3Confident86.9Confident14 Ų1438 Ų3814%0.14423%0.233CC..Hα-helixtrans-65-46.5172.100000112.4K64 S65 Y235 G236 F237 I241 G242 G243K64-G239 CarbonylContact O-C 3.51Å; K64-G239 WeakPolarHBondContact O-CA 3.44Å; S65-G239 PolarHBondContact OG-O 3.15Å; Y235-G239 WeakPolarHBondContact O-CA 3.37Å; Y235-G239 PolarHBondContact O-N 3.06Å; Y235-G239 VanDerWaalsContact O-N 3.13Å; G236-G239 PolarHBondContact O-N 3.48Å; G236-G239 VanDerWaalsContact O-N 3.12Å; F237-G239 VanDerWaalsContact C-N 3.29Å; F237-G239 PolarHBondContact O-N 3.22Å; G239-I241 PolarHBondContact O-N 3.41Å; G239-G242 CarbonylContact O-C 3.49Å; G239-G242 PolarHBondContact O-N 3.34Å; G239-G242 VanDerWaalsContact O-N 3.16Å; G239-G243 PolarHBondContact O-N 2.97Å
240M91.4Very high87.1Confident14 Ų1434.4 Ų34.47%0.06922%0.217CC..Hα-helixtrans-58-46.1176-176.8-89.8-97.400112.4S68 L71 S72 F233 G236 F237 G243 A244S68-M240 WeakPolarHBondContact OG-CB 3.48Å; L71-M240 HydrophobicContact CB-CE 3.98Å; L71-M240 HydrophobicContact CB-CG 4.04Å; L71-M240 HydrophobicContact CB-SD 4.12Å; L71-M240 HydrophobicContact CD1-CE 4.2Å; S72-M240 PolarHBondContact OG-O 3.21Å; F233-M240 HydrophobicContact CD1-CB 4.11Å; F233-M240 HydrophobicContact CE1-CB 4.09Å; F233-M240 HydrophobicContact CE1-CE 4.29Å; F233-M240 HydrophobicContact CE1-CG 4.18Å; G236-M240 PolarHBondContact O-N 3.01Å; F237-M240 HydrophobicContact CD2-CE 4.16Å; F237-M240 HydrophobicContact CE2-CE 3.64Å; F237-M240 HydrophobicContact CZ-CE 4.28Å; F237-M240 PolarHBondContact O-N 2.95Å; M240-G243 PolarHBondContact O-N 3.38Å; M240-A244 PolarHBondContact O-N 3.06Å
241I86.2Confident87.5Confident64 Ų6432.2 Ų32.233%0.32819%0.194SC..Hα-helixtrans-68.9-38.1176.5-61.9-63000111.4F237 G239 A244 G245F237-I241 HydrophobicContact CD1-CG1 3.99Å; F237-I241 HydrophobicContact CE1-CD1 4.02Å; F237-I241 HydrophobicContact CE1-CG1 3.61Å; F237-I241 HydrophobicContact CZ-CD1 4.01Å; F237-I241 HydrophobicContact CZ-CG1 4.06Å; F237-I241 WeakPolarHBondContact O-CG1 3.42Å; F237-I241 PolarHBondContact O-N 3.3Å; G239-I241 PolarHBondContact O-N 3.41Å; I241-A244 WeakPolarHBondContact O-CB 3.48Å; I241-A244 PolarHBondContact O-N 3.2Å; I241-G245 PolarHBondContact O-N 2.89Å
242G83.1Confident87.4Confident16 Ų1632.1 Ų32.117%0.16519%0.19CC..Hα-helixtrans-62.8-41.6174.300000112.9G238 G239 A244 G245G238-G242 PolarHBondContact O-N 2.8Å; G239-G242 CarbonylContact O-C 3.49Å; G239-G242 PolarHBondContact O-N 3.34Å; G239-G242 VanDerWaalsContact O-N 3.16Å; G242-A244 VanDerWaalsContact C-N 3.34Å; G242-G245 PolarHBondContact O-N 2.71Å
243G86.8Confident87.3Confident0 Ų029.3 Ų29.30%018%0.176CC..Hα-helixtrans-65.7-35.4173.100000112.2S65 G239 M240 G245 T246 C247S65-G243 WeakPolarHBondContact OG-CA 3.41Å; G239-G243 PolarHBondContact O-N 2.97Å; M240-G243 PolarHBondContact O-N 3.38Å; G243-G245 PolarHBondContact O-N 2.82Å; G243-T246 CarbonylContact O-C 3.57Å; G243-T246 PolarHBondContact O-N 2.97Å; G243-C247 WeakPolarHBondContact O-CB 3.43Å; G243-C247 PolarHBondContact O-N 3.12Å; G243-C247 PolarHBondContact O-SG 3.23Å; G243-C247 VanDerWaalsContact O-SG 3.35Å
244A89Confident87.3Confident7 Ų725.8 Ų25.86%0.05816%0.161CC..Hα-helixtrans-57.6-38.2174.700000111.7S72 V75 M240 I241 G242 T246 C247 F248S72-A244 WeakPolarHBondContact O-CB 3.37Å; V75-A244 HydrophobicContact CB-CB 4.09Å; V75-A244 HydrophobicContact CG1-CB 4.08Å; M240-A244 PolarHBondContact O-N 3.06Å; I241-A244 WeakPolarHBondContact O-CB 3.48Å; I241-A244 PolarHBondContact O-N 3.2Å; G242-A244 VanDerWaalsContact C-N 3.34Å; A244-T246 VanDerWaalsContact C-N 3.31Å; A244-T246 PolarHBondContact O-N 2.55Å; A244-C247 PolarHBondContact O-N 2.99Å; A244-F248 PolarHBondContact O-N 3.24Å
245G83.4Confident87.3Confident27 Ų2724.1 Ų24.128%0.27815%0.15SC..Hα-helixtrans-66.7-31.2175.700000114.3I241 G242 G243 F248I241-G245 PolarHBondContact O-N 2.89Å; G242-G245 PolarHBondContact O-N 2.71Å; G243-G245 PolarHBondContact O-N 2.82Å; G245-F248 WeakPolarHBondContact O-CB 3.34Å
246T83.6Confident87.2Confident22 Ų2219.4 Ų19.414%0.13513%0.131CC..Hα-helixtrans-77.5-39.5172.6-490000111.4L56 V60 K64 G243 A244 F248 Y249L56-T246 HydrophobicContact CD2-CG2 4.13Å; V60-T246 HydrophobicContact CG2-CG2 3.71Å; K64-T246 HydrophobicContact CD-CG2 4.48Å; K64-T246 WeakPolarHBondContact CD-OG1 3.39Å; K64-T246 PolarHBondContact NZ-OG1 2.84Å; G243-T246 CarbonylContact O-C 3.57Å; G243-T246 PolarHBondContact O-N 2.97Å; A244-T246 VanDerWaalsContact C-N 3.31Å; A244-T246 PolarHBondContact O-N 2.55Å; T246-F248 PolarHBondContact O-N 3.35Å; T246-Y249 VanDerWaalsContact O-CB 3.29Å; T246-Y249 WeakPolarHBondContact O-CB 3.5Å; T246-Y249 PolarHBondContact O-N 3.29Å; T246-Y249 VanDerWaalsContact O-N 3.15Å
247C88.4Confident87.3Confident0 Ų017.8 Ų17.80%012%0.115CC..Hα-helixtrans-60.7-25.8173.1-71.60000112.4Y73 A76 G243 A244 Y249 A250 F251Y73-C247 HydrophobicContact CD1-CB 3.64Å; Y73-C247 HydrophobicContact CE1-CB 3.71Å; Y73-C247 HydrophobicContact CG-CB 4.25Å; A76-C247 HydrophobicContact CB-CB 3.77Å; G243-C247 WeakPolarHBondContact O-CB 3.43Å; G243-C247 PolarHBondContact O-N 3.12Å; G243-C247 PolarHBondContact O-SG 3.23Å; G243-C247 VanDerWaalsContact O-SG 3.35Å; A244-C247 PolarHBondContact O-N 2.99Å; C247-Y249 PolarHBondContact O-N 3.04Å; C247-A250 WeakPolarHBondContact O-CB 3.45Å; C247-A250 PolarHBondContact O-N 3.15Å; C247-F251 WeakPolarHBondContact O-CD2 3.26Å
248F87.1Confident87.5Confident3 Ų311.4 Ų11.41%0.0139%0.087CC..G310 helixtrans-59.6-34.2175.4-172.2-93.4000112.4A76 T79 A80 A244 G245 T246 A250 F251 I252 L402 Y405 L569A76-F248 HydrophobicContact CB-CB 4.48Å; T79-F248 HydrophobicContact CG2-CD2 4.16Å; T79-F248 HydrophobicContact CG2-CE2 3.82Å; A80-F248 HydrophobicContact CB-CE2 4.18Å; A244-F248 PolarHBondContact O-N 3.24Å; G245-F248 WeakPolarHBondContact O-CB 3.34Å; T246-F248 PolarHBondContact O-N 3.35Å; F248-A250 PolarHBondContact O-N 2.96Å; F248-A250 VanDerWaalsContact O-N 3.15Å; F248-F251 PolarHBondContact O-N 3.45Å; F248-I252 HydrophobicContact CD1-CG1 4.48Å; F248-I252 HydrophobicContact CE1-CG1 4.4Å; F248-I252 PolarHBondContact O-N 3.14Å; F248-L402 HydrophobicContact CD1-CD2 3.92Å; F248-L402 HydrophobicContact CE1-CD2 3.41Å; F248-L402 VanDerWaalsContact CE1-CD2 3.41Å; F248-L402 HydrophobicContact CE1-CG 4.25Å; F248-L402 HydrophobicContact CZ-CD2 3.96Å; F248-Y405 HydrophobicContact CE1-CD2 4.21Å; F248-Y405 HydrophobicContact CE1-CE2 4.06Å; F248-Y405 AromaticContact CZ-CD2 3.8Å; F248-Y405 HydrophobicContact CZ-CD2 3.8Å; F248-Y405 AromaticContact CZ-CE2 3.76Å; F248-Y405 HydrophobicContact CZ-CE2 3.76Å; F248-L569 HydrophobicContact CB-CD1 3.89Å; F248-L569 HydrophobicContact CD1-CD1 3.84Å; F248-L569 HydrophobicContact CD2-CD1 3.65Å; F248-L569 HydrophobicContact CE1-CD1 4.3Å; F248-L569 HydrophobicContact CE2-CD1 4.12Å; F248-L569 HydrophobicContact CG-CD1 3.48Å; F248-L569 VanDerWaalsContact CG-CD1 3.48Å; F248-L569 HydrophobicContact CZ-CD1 4.41Å
249Y82Confident87.8Confident7 Ų79 Ų93%0.0276%0.062CC..G310 helixtrans-52.6-37.6172174.9-78.2000111.6A51 L56 S130 T246 C247 F251 I252 A394 L397A51-Y249 HydrophobicContact CB-CE1 4.21Å; L56-Y249 HydrophobicContact CD1-CD1 3.02Å; L56-Y249 HydrophobicContact CD1-CE1 3.69Å; L56-Y249 HydrophobicContact CD1-CG 3.49Å; L56-Y249 VanDerWaalsContact CD1-CG 3.49Å; L56-Y249 HydrophobicContact CG-CD1 4.22Å; S130-Y249 WeakPolarHBondContact CB-OH 3.27Å; S130-Y249 PolarHBondContact OG-OH 3.34Å; T246-Y249 VanDerWaalsContact O-CB 3.29Å; T246-Y249 WeakPolarHBondContact O-CB 3.5Å; T246-Y249 PolarHBondContact O-N 3.29Å; T246-Y249 VanDerWaalsContact O-N 3.15Å; C247-Y249 PolarHBondContact O-N 3.04Å; Y249-F251 PolarHBondContact O-N 3.49Å; Y249-F251 VanDerWaalsContact O-N 3.14Å; Y249-I252 HydrophobicContact CD2-CD1 4.22Å; Y249-I252 HydrophobicContact CG-CD1 4.5Å; Y249-I252 WeakPolarHBondContact O-CB 3.44Å; Y249-I252 PolarHBondContact O-N 3.32Å; Y249-A394 HydrophobicContact CD2-CB 3.85Å; Y249-A394 VanDerWaalsContact CE2-CA 3.48Å; Y249-A394 HydrophobicContact CE2-CB 3.48Å; Y249-A394 VanDerWaalsContact CE2-CB 3.48Å; Y249-L397 HydrophobicContact CD2-CD2 3.86Å; Y249-L397 HydrophobicContact CE2-CB 4.06Å; Y249-L397 HydrophobicContact CE2-CD2 3.21Å; Y249-L397 HydrophobicContact CE2-CG 4.14Å
250A87.6Confident87.7Confident0 Ų08.3 Ų8.30%06%0.055CC..G310 helixtrans-65.1-18.7-178.100000113.4G52 Y73 C247 F248 F286G52-A250 VanDerWaalsContact CA-CA 3.42Å; Y73-A250 HydrophobicContact CE1-CB 3.77Å; C247-A250 WeakPolarHBondContact O-CB 3.45Å; C247-A250 PolarHBondContact O-N 3.15Å; F248-A250 PolarHBondContact O-N 2.96Å; F248-A250 VanDerWaalsContact O-N 3.15Å; A250-F286 HydrophobicContact CB-CD2 4.03Å; A250-F286 HydrophobicContact CB-CE2 3.4Å; A250-F286 VanDerWaalsContact CB-CE2 3.4Å; A250-F286 HydrophobicContact CB-CZ 4.14Å; A250-F286 WeakPolarHBondContact O-CE2 3.44Å
251F90.5Very high87.4Confident0 Ų07.7 Ų7.70%05%0.052CC..G310 helixtrans-98.6-3.1176.7-67.6-80.2000113.4Y73 A76 A80 C247 F248 Y249 G253 F254 V279 V282 T283 F286Y73-F251 HydrophobicContact CD1-CE2 4.03Å; Y73-F251 HydrophobicContact CD1-CZ 4.5Å; A76-F251 HydrophobicContact CB-CD2 3.91Å; A76-F251 HydrophobicContact CB-CE2 3.71Å; A80-F251 HydrophobicContact CB-CB 3.46Å; A80-F251 VanDerWaalsContact CB-CB 3.46Å; A80-F251 HydrophobicContact CB-CD1 3.98Å; A80-F251 HydrophobicContact CB-CD2 4.37Å; A80-F251 HydrophobicContact CB-CG 3.69Å; C247-F251 WeakPolarHBondContact O-CD2 3.26Å; F248-F251 PolarHBondContact O-N 3.45Å; Y249-F251 PolarHBondContact O-N 3.49Å; Y249-F251 VanDerWaalsContact O-N 3.14Å; F251-G253 PolarHBondContact O-N 3.15Å; F251-F254 WeakPolarHBondContact O-CD1 3.48Å; F251-V279 HydrophobicContact CD1-CG1 4.45Å; F251-V282 HydrophobicContact CD1-CG1 4.09Å; F251-V282 HydrophobicContact CE1-CB 4.49Å; F251-V282 HydrophobicContact CE1-CG1 3.89Å; F251-T283 WeakPolarHBondContact CE1-OG1 3.17Å; F251-T283 HydrophobicContact CZ-CG2 4.38Å; F251-F286 HydrophobicContact CE1-CD2 4.07Å; F251-F286 HydrophobicContact CE1-CE2 4.33Å; F251-F286 HydrophobicContact CE2-CD2 4.03Å; F251-F286 HydrophobicContact CE2-CE2 4.5Å; F251-F286 AromaticContact CZ-CD2 3.71Å; F251-F286 HydrophobicContact CZ-CD2 3.71Å; F251-F286 HydrophobicContact CZ-CE2 4.31Å
252I88.9Confident87.3Confident12 Ų125.2 Ų5.26%0.0624%0.039CC..THydrogen-bonded Turntrans-64.7134.1173.4-62.2178.5000108.3F248 Y249 L397 T401F248-I252 HydrophobicContact CD1-CG1 4.48Å; F248-I252 HydrophobicContact CE1-CG1 4.4Å; F248-I252 PolarHBondContact O-N 3.14Å; Y249-I252 HydrophobicContact CD2-CD1 4.22Å; Y249-I252 HydrophobicContact CG-CD1 4.5Å; Y249-I252 WeakPolarHBondContact O-CB 3.44Å; Y249-I252 PolarHBondContact O-N 3.32Å; I252-L397 HydrophobicContact CD1-CD2 4.25Å; I252-L397 HydrophobicContact CD1-CG 4.3Å; I252-L397 HydrophobicContact CG2-CD2 4.21Å; I252-T401 HydrophobicContact CB-CG2 4.45Å; I252-T401 HydrophobicContact CD1-CG2 4.15Å; I252-T401 HydrophobicContact CG1-CG2 3.99Å; I252-T401 HydrophobicContact CG2-CG2 3.84Å
253G88.5Confident87.3Confident2 Ų24.7 Ų4.72%0.0213%0.033CC..THydrogen-bonded Turntrans119.1-6.517600000116.1N47 F251 D255 A256N47-G253 WeakPolarHBondContact ND2-CA 3.29Å; N47-G253 PolarHBondContact ND2-O 3.25Å; F251-G253 PolarHBondContact O-N 3.15Å; G253-D255 WeakPolarHBondContact CA-OD1 3.39Å; G253-D255 PolarHBondContact N-OD1 2.97Å; G253-D255 PolarHBondContact O-N 2.94Å; G253-A256 VanDerWaalsContact O-CB 3.27Å; G253-A256 WeakPolarHBondContact O-CB 3.35Å; G253-A256 PolarHBondContact O-N 3.32Å
254F91.7Very high87.3Confident0 Ų04.7 Ų4.70%03%0.033CC..THydrogen-bonded Turntrans-64.4-25.917168.5-100000112.2M48 N83 A84 Y87 F251 A256 I257 T275 V279 Y405M48-F254 HydrophobicContact CE-CB 3.87Å; M48-F254 HydrophobicContact SD-CB 3.75Å; M48-F254 HydrophobicContact SD-CD1 4.43Å; N83-F254 HydrophobicContact CB-CZ 3.94Å; A84-F254 HydrophobicContact CB-CD2 3.95Å; A84-F254 HydrophobicContact CB-CE2 3.94Å; A84-F254 HydrophobicContact CB-CG 4.31Å; A84-F254 HydrophobicContact CB-CZ 4.25Å; Y87-F254 AromaticContact CD2-CE2 3.59Å; Y87-F254 HydrophobicContact CD2-CE2 3.59Å; Y87-F254 HydrophobicContact CD2-CZ 4.09Å; Y87-F254 HydrophobicContact CE2-CE2 4.15Å; Y87-F254 HydrophobicContact CE2-CZ 4.36Å; Y87-F254 AromaticContact CG-CE2 3.8Å; Y87-F254 HydrophobicContact CG-CE2 3.8Å; F251-F254 WeakPolarHBondContact O-CD1 3.48Å; F254-A256 PolarHBondContact O-N 2.99Å; F254-I257 HydrophobicContact CB-CD1 4.42Å; F254-I257 VanDerWaalsContact O-CB 3.23Å; F254-I257 WeakPolarHBondContact O-CB 3.38Å; F254-I257 WeakPolarHBondContact O-CD1 2.99Å; F254-I257 WeakPolarHBondContact O-CG1 3.5Å; F254-I257 PolarHBondContact O-N 3.32Å; F254-T275 HydrophobicContact CD2-CG2 4.13Å; F254-V279 HydrophobicContact CB-CG2 3.69Å; F254-V279 HydrophobicContact CD1-CG2 4.07Å; F254-V279 HydrophobicContact CG-CG2 3.93Å; F254-Y405 HydrophobicContact CE1-CE1 4.48Å; F254-Y405 AromaticContact CE1-CE2 3.56Å; F254-Y405 HydrophobicContact CE1-CE2 3.56Å; F254-Y405 AromaticContact CE1-CZ 3.51Å; F254-Y405 VanDerWaalsContact CE1-OH 3.24Å; F254-Y405 WeakPolarHBondContact CE1-OH 3.45Å; F254-Y405 HydrophobicContact CZ-CD2 4.3Å; F254-Y405 AromaticContact CZ-CE1 3.97Å; F254-Y405 HydrophobicContact CZ-CE1 3.97Å; F254-Y405 AromaticContact CZ-CE2 3.61Å; F254-Y405 HydrophobicContact CZ-CE2 3.61Å; F254-Y405 AromaticContact CZ-CZ 3.4Å; F254-Y405 VanDerWaalsContact CZ-CZ 3.4Å; F254-Y405 WeakPolarHBondContact CZ-OH 3.48Å
255D91.1Very high87.1Confident0 Ų08.1 Ų8.10%05%0.049CC..Hα-helixtrans-64.8-25.2176.857.6-73.7000112.2Y87 Y124 G253 I257 T258 V259 Y405Y87-D255 HydrophobicContact CD1-CB 4.09Å; Y87-D255 HydrophobicContact CE1-CB 3.66Å; Y124-D255 PolarHBondContact OH-OD2 3.43Å; G253-D255 WeakPolarHBondContact CA-OD1 3.39Å; G253-D255 PolarHBondContact N-OD1 2.97Å; G253-D255 PolarHBondContact O-N 2.94Å; D255-I257 PolarHBondContact O-N 3.35Å; D255-T258 WeakPolarHBondContact O-CA 3.27Å; D255-T258 WeakPolarHBondContact O-CB 3.13Å; D255-T258 PolarHBondContact O-N 3.16Å; D255-T258 PolarHBondContact O-OG1 3.41Å; D255-V259 PolarHBondContact O-N 3.13Å; D255-Y405 HydrophobicContact CB-CE1 4.19Å; D255-Y405 PolarHBondContact OD1-OH 2.79Å
256A88.4Confident87.3Confident1 Ų112.2 Ų12.21%0.0087%0.065CC..Hα-helixtrans-59.4-27.617300000112.9N47 Y124 G253 F254 T258 V259 T338 A342N47-A256 WeakPolarHBondContact ND2-CB 3.38Å; Y124-A256 HydrophobicContact CE1-CB 4.42Å; G253-A256 VanDerWaalsContact O-CB 3.27Å; G253-A256 WeakPolarHBondContact O-CB 3.35Å; G253-A256 PolarHBondContact O-N 3.32Å; F254-A256 PolarHBondContact O-N 2.99Å; A256-T258 PolarHBondContact O-N 3.27Å; A256-V259 PolarHBondContact O-N 3.3Å; A256-T338 HydrophobicContact CB-CG2 3.92Å; A256-A342 HydrophobicContact CB-CB 4.09Å
257I90.2Very high87.5Confident0 Ų011.8 Ų11.80%06%0.063CC..Hα-helixtrans-57.7-43.5172-56.9169.5000109.7L40 G44 F254 D255 V259 S260 M271 A274 S278L40-I257 HydrophobicContact CB-CG2 4.11Å; L40-I257 HydrophobicContact CD2-CG2 4.27Å; G44-I257 VanDerWaalsContact CA-CG1 3.46Å; F254-I257 HydrophobicContact CB-CD1 4.42Å; F254-I257 VanDerWaalsContact O-CB 3.23Å; F254-I257 WeakPolarHBondContact O-CB 3.38Å; F254-I257 WeakPolarHBondContact O-CD1 2.99Å; F254-I257 WeakPolarHBondContact O-CG1 3.5Å; F254-I257 PolarHBondContact O-N 3.32Å; D255-I257 PolarHBondContact O-N 3.35Å; I257-V259 PolarHBondContact O-N 3.45Å; I257-S260 WeakPolarHBondContact O-CB 3.29Å; I257-S260 PolarHBondContact O-N 2.76Å; I257-S260 VanDerWaalsContact O-N 3.17Å; I257-M271 HydrophobicContact CG2-CE 4.32Å; I257-A274 HydrophobicContact CG2-CB 3.89Å; I257-S278 VanDerWaalsContact CD1-OG 3.25Å; I257-S278 WeakPolarHBondContact CD1-OG 3.48Å
258T90.8Very high87.5Confident0 Ų017.7 Ų17.70%09%0.088CC..Hα-helixtrans-79.4-18-173.471.60000113.6Y87 S99 Y103 D255 A256 S260 S261Y87-T258 HydrophobicContact CD1-CG2 4.14Å; S99-T258 WeakPolarHBondContact CB-OG1 3.35Å; S99-T258 PolarHBondContact OG-OG1 2.85Å; Y103-T258 VanDerWaalsContact OH-CB 3.3Å; Y103-T258 WeakPolarHBondContact OH-CB 3.43Å; D255-T258 WeakPolarHBondContact O-CA 3.27Å; D255-T258 WeakPolarHBondContact O-CB 3.13Å; D255-T258 PolarHBondContact O-N 3.16Å; D255-T258 PolarHBondContact O-OG1 3.41Å; A256-T258 PolarHBondContact O-N 3.27Å; T258-S260 PolarHBondContact O-N 3.4Å; T258-S261 VanDerWaalsContact O-CB 3.3Å; T258-S261 WeakPolarHBondContact O-CB 3.39Å; T258-S261 PolarHBondContact O-N 3.08Å; T258-S261 PolarHBondContact O-OG 3.5Å; T258-S261 VanDerWaalsContact O-OG 3.14Å
259V88.1Confident87.6Confident0 Ų026.4 Ų26.40%012%0.121CC..Hα-helixtrans-63.5-27.3167.8178.70000111S97 D255 A256 I257 A342 R345 V346S97-V259 PolarHBondContact OG-O 3.12Å; D255-V259 PolarHBondContact O-N 3.13Å; A256-V259 PolarHBondContact O-N 3.3Å; I257-V259 PolarHBondContact O-N 3.45Å; V259-A342 HydrophobicContact CB-CB 4.41Å; V259-A342 HydrophobicContact CG1-CB 4.33Å; V259-A342 HydrophobicContact CG2-CB 4.29Å; V259-R345 HydrophobicContact CG1-CB 3.59Å; V259-R345 HydrophobicContact CG1-CG 4.42Å; V259-V346 HydrophobicContact CG1-CG2 4.45Å; V259-V346 HydrophobicContact CG2-CG2 4.21Å
260S85.4Confident88.1Confident0 Ų026.6 Ų26.60%012%0.124CC..THydrogen-bonded Turntrans-95.213.4-179.2-45.70000113.2I257 T258 E262 E263 A264 Y341I257-S260 WeakPolarHBondContact O-CB 3.29Å; I257-S260 PolarHBondContact O-N 2.76Å; I257-S260 VanDerWaalsContact O-N 3.17Å; T258-S260 PolarHBondContact O-N 3.4Å; S260-E262 PolarHBondContact O-N 3.17Å; S260-E263 PolarHBondContact O-N 3.36Å; S260-E263 VanDerWaalsContact O-N 3.15Å; S260-A264 PolarHBondContact O-N 3.36Å; S260-Y341 WeakPolarHBondContact OG-CE1 3.41Å
261S84.7Confident88.3Confident0 Ų026.6 Ų26.60%012%0.124CC..G310 helixtrans-60.9-32.5-177.564.60000113.2K96 T258 E263 A264 M271K96-S261 PolarHBondContact N-OG 2.87Å; K96-S261 PolarHBondContact O-OG 2.97Å; T258-S261 VanDerWaalsContact O-CB 3.3Å; T258-S261 WeakPolarHBondContact O-CB 3.39Å; T258-S261 PolarHBondContact O-N 3.08Å; T258-S261 PolarHBondContact O-OG 3.5Å; T258-S261 VanDerWaalsContact O-OG 3.14Å; S261-E263 VanDerWaalsContact C-N 3.35Å; S261-A264 WeakPolarHBondContact O-CB 3.33Å; S261-A264 PolarHBondContact O-N 2.97Å; S261-M271 VanDerWaalsContact CB-SD 3.53Å
262E83Confident88.4Confident13 Ų1327.8 Ų27.86%0.06113%0.131CC..G310 helixtrans-75-23.1179.3-172.3163-158.300113.2T29 L31 R33 P95 K96 S97 S260T29-E262 WeakPolarHBondContact CB-OE1 3.34Å; T29-E262 HydrophobicContact CG2-CG 4.23Å; T29-E262 VanDerWaalsContact OG1-CD 3.29Å; T29-E262 WeakPolarHBondContact OG1-CG 3.32Å; T29-E262 PolarHBondContact OG1-OE1 3.41Å; L31-E262 HydrophobicContact CB-CG 4.42Å; L31-E262 HydrophobicContact CD1-CB 4.33Å; L31-E262 HydrophobicContact CD1-CG 4.14Å; R33-E262 WeakPolarHBondContact CG-O 3.5Å; P95-E262 WeakPolarHBondContact O-CA 3.46Å; K96-E262 WeakPolarHBondContact CD-OE1 3.49Å; K96-E262 IonicContact NZ-OE1 3.97Å; K96-E262 PolarHBondContact NZ-OE1 3.19Å; S97-E262 WeakPolarHBondContact CB-OE2 3.5Å; S97-E262 PolarHBondContact N-OE2 3.18Å; S260-E262 PolarHBondContact O-N 3.17Å
263E83.4Confident88.7Confident5 Ų530.6 Ų30.62%0.02315%0.146CC..G310 helixtrans-93.7-2.8175.8-67.6169.7177.700112.4L31 R33 C34 L35 S260 S261 Y341 R345L31-E263 HydrophobicContact CB-CG 3.87Å; L31-E263 HydrophobicContact CD1-CG 4.24Å; R33-E263 CarbonylContact C-O 3.55Å; R33-E263 WeakPolarHBondContact CA-O 3.48Å; C34-E263 PolarHBondContact N-O 3.37Å; L35-E263 HydrophobicContact CD1-CB 3.87Å; L35-E263 HydrophobicContact CG-CB 4.25Å; L35-E263 PolarHBondContact N-O 3Å; S260-E263 PolarHBondContact O-N 3.36Å; S260-E263 VanDerWaalsContact O-N 3.15Å; S261-E263 VanDerWaalsContact C-N 3.35Å; E263-Y341 PolarHBondContact OE2-OH 3.25Å; E263-R345 IonicContact OE1-CZ 2.93Å; E263-R345 IonicContact OE1-NE 2.73Å; E263-R345 PolarHBondContact OE1-NE 3.49Å; E263-R345 VanDerWaalsContact OE1-NE 3.12Å; E263-R345 IonicContact OE1-NH2 2.87Å; E263-R345 PolarHBondContact OE1-NH2 3.29Å; E263-R345 IonicContact OE2-NE 2.76Å; E263-R345 IonicContact OE2-NH2 3.93Å
264A87Confident89Confident0 Ų030.5 Ų30.50%015%0.145CC..BIsolated β-bridgetrans-75.4136.4178.700000111.5L40 S260 S261 N266 P267 M271L40-A264 HydrophobicContact CD1-CB 3.83Å; S260-A264 PolarHBondContact O-N 3.36Å; S261-A264 WeakPolarHBondContact O-CB 3.33Å; S261-A264 PolarHBondContact O-N 2.97Å; A264-N266 PolarHBondContact O-N 3.07Å; A264-P267 HydrophobicContact CB-CB 4.26Å; A264-M271 HydrophobicContact CB-CE 3.82Å
265L85.7Confident89.1Confident78 Ų7830.5 Ų30.541%0.40815%0.145SC..SBendtrans-61.3-46.7178.1-71.9168.4000112.3R33 L35 T36R33-L265 HydrophobicContact CB-CD2 4.4Å; R33-L265 WeakPolarHBondContact O-CD2 3.5Å; L35-L265 PolarHBondContact O-N 3.24Å; T36-L265 HydrophobicContact CG2-CD1 3.81Å
266N87.6Confident89.3Confident113 Ų11331.6 Ų31.660%0.60416%0.155SC*.SBendtrans-133.579.3-179.2-80.1-45.6000110.1A264 K268 R269 S270A264-N266 PolarHBondContact O-N 3.07Å; N266-K268 VanDerWaalsContact C-N 3.34Å; N266-K268 PolarHBondContact O-N 3.3Å; N266-R269 PolarHBondContact O-N 3.34Å; N266-S270 WeakPolarHBondContact O-CB 3.3Å; N266-S270 PolarHBondContact O-N 3.39Å; N266-S270 PolarHBondContact O-OG 3.42Å
267P87.1Confident89.7Confident14 Ų1434.7 Ų34.79%0.09117%0.174CC..Hα-helixtrans-61.5-38.7-170.921.3-31.8000112.9P95 A264 R269 S270 M271P95-P267 HydrophobicContact CB-CB 3.69Å; P95-P267 HydrophobicContact CB-CG 3.6Å; P95-P267 HydrophobicContact CG-CG 4.31Å; A264-P267 HydrophobicContact CB-CB 4.26Å; P267-R269 PolarHBondContact O-N 2.93Å; P267-R269 VanDerWaalsContact O-N 3.09Å; P267-S270 PolarHBondContact O-N 3.4Å; P267-M271 HydrophobicContact CB-CG 4.07Å; P267-M271 VanDerWaalsContact O-CB 3.23Å; P267-M271 WeakPolarHBondContact O-CB 3.45Å; P267-M271 WeakPolarHBondContact O-CG 3.48Å; P267-M271 PolarHBondContact O-N 3.07Å
268K88.2Confident89.9Confident123 Ų12334.7 Ų34.754%0.53517%0.174SC..Hα-helixtrans-53.2-34.9179.4-70.1-172.3178.2-174.90113.8N266 P272N266-K268 VanDerWaalsContact C-N 3.34Å; N266-K268 PolarHBondContact O-N 3.3Å; K268-P272 WeakPolarHBondContact O-CG 3.16Å
269R90.2Very high90.2Very high187 Ų18734.7 Ų34.771%0.70617%0.174SC*.Hα-helixtrans-105.3-37.3-179.1-173177.1178.1-172.80.3112.7N266 P267 P272 I273N266-R269 PolarHBondContact O-N 3.34Å; P267-R269 PolarHBondContact O-N 2.93Å; P267-R269 VanDerWaalsContact O-N 3.09Å; R269-P272 WeakPolarHBondContact O-CD 3.33Å; R269-P272 WeakPolarHBondContact O-CG 3.23Å; R269-I273 HydrophobicContact CG-CD1 3.7Å; R269-I273 WeakPolarHBondContact O-CD1 3.43Å; R269-I273 VanDerWaalsContact O-CG1 3.24Å; R269-I273 WeakPolarHBondContact O-CG1 3.36Å; R269-I273 PolarHBondContact O-N 3.38Å
270S92.1Very high90.6Very high11 Ų1136.2 Ų36.28%0.07719%0.19CC..Hα-helixtrans-74.3-38.4-174.4-51.60000112.2N266 P267 A274N266-S270 WeakPolarHBondContact O-CB 3.3Å; N266-S270 PolarHBondContact O-N 3.39Å; N266-S270 PolarHBondContact O-OG 3.42Å; P267-S270 PolarHBondContact O-N 3.4Å; S270-A274 WeakPolarHBondContact O-CB 3.4Å; S270-A274 PolarHBondContact O-N 3.48Å
271M90.9Very high91.1Very high0 Ų039 Ų390%021%0.207CC..Hα-helixtrans-59.8-54.4178.5-64.3-68.394.200112.6L40 I257 S261 A264 P267 I273 A274 T275L40-M271 HydrophobicContact CD1-CE 3.22Å; L40-M271 HydrophobicContact CD2-CE 3.85Å; L40-M271 HydrophobicContact CG-CE 4.07Å; I257-M271 HydrophobicContact CG2-CE 4.32Å; S261-M271 VanDerWaalsContact CB-SD 3.53Å; A264-M271 HydrophobicContact CB-CE 3.82Å; P267-M271 HydrophobicContact CB-CG 4.07Å; P267-M271 VanDerWaalsContact O-CB 3.23Å; P267-M271 WeakPolarHBondContact O-CB 3.45Å; P267-M271 WeakPolarHBondContact O-CG 3.48Å; P267-M271 PolarHBondContact O-N 3.07Å; M271-I273 PolarHBondContact O-N 3.01Å; M271-A274 PolarHBondContact O-N 3.08Å; M271-T275 WeakPolarHBondContact O-CB 3.36Å; M271-T275 PolarHBondContact O-N 2.93Å; M271-T275 PolarHBondContact O-OG1 2.82Å; M271-T275 VanDerWaalsContact O-OG1 3.07Å
272P93.7Very high91.6Very high24 Ų2439 Ų3916%0.15621%0.207CC..Hα-helixtrans-66.1-37.5-178.225.8-35.6000113A88 K268 R269 G276 F550A88-P272 HydrophobicContact CB-CB 4.08Å; K268-P272 WeakPolarHBondContact O-CG 3.16Å; R269-P272 WeakPolarHBondContact O-CD 3.33Å; R269-P272 WeakPolarHBondContact O-CG 3.23Å; P272-G276 PolarHBondContact O-N 2.84Å; P272-F550 HydrophobicContact CB-CB 3.73Å; P272-F550 HydrophobicContact CB-CD1 4.03Å; P272-F550 HydrophobicContact CB-CD2 4.05Å; P272-F550 HydrophobicContact CB-CG 3.65Å; P272-F550 HydrophobicContact CG-CB 3.84Å; P272-F550 HydrophobicContact CG-CG 4.3Å
273I94.7Very high92.3Very high72 Ų7239.3 Ų39.337%0.36921%0.21SC..Hα-helixtrans-65.7-49.7177.1-65.1173.2000110R269 M271 G276 V277R269-I273 HydrophobicContact CG-CD1 3.7Å; R269-I273 WeakPolarHBondContact O-CD1 3.43Å; R269-I273 VanDerWaalsContact O-CG1 3.24Å; R269-I273 WeakPolarHBondContact O-CG1 3.36Å; R269-I273 PolarHBondContact O-N 3.38Å; M271-I273 PolarHBondContact O-N 3.01Å; I273-G276 PolarHBondContact O-N 3.25Å; I273-V277 HydrophobicContact CG2-CG2 4.04Å; I273-V277 VanDerWaalsContact O-CB 3.23Å; I273-V277 WeakPolarHBondContact O-CB 3.36Å; I273-V277 WeakPolarHBondContact O-CG2 3.37Å; I273-V277 PolarHBondContact O-N 3.49Å
274A95Very high92.9Very high0 Ų044 Ų440%024%0.235CC..Hα-helixtrans-60.9-50.6-177.200000111.6L40 T41 I257 S270 M271 S278L40-A274 HydrophobicContact CB-CB 3.63Å; T41-A274 WeakPolarHBondContact OG1-CA 3.45Å; I257-A274 HydrophobicContact CG2-CB 3.89Å; S270-A274 WeakPolarHBondContact O-CB 3.4Å; S270-A274 PolarHBondContact O-N 3.48Å; M271-A274 PolarHBondContact O-N 3.08Å; A274-S278 WeakPolarHBondContact O-CB 3.26Å; A274-S278 PolarHBondContact O-N 2.96Å; A274-S278 PolarHBondContact O-OG 3.34Å
275T94.1Very high93.3Very high0 Ų044.8 Ų44.80%024%0.239CC..Hα-helixtrans-63.7-42.6-179.6-59.70000112.6A84 A88 F254 M271 S278 V279A84-T275 HydrophobicContact CB-CG2 3.6Å; A84-T275 VanDerWaalsContact O-CG2 3.28Å; A84-T275 WeakPolarHBondContact O-CG2 3.12Å; A88-T275 HydrophobicContact CB-CG2 4.41Å; F254-T275 HydrophobicContact CD2-CG2 4.13Å; M271-T275 WeakPolarHBondContact O-CB 3.36Å; M271-T275 PolarHBondContact O-N 2.93Å; M271-T275 PolarHBondContact O-OG1 2.82Å; M271-T275 VanDerWaalsContact O-OG1 3.07Å; T275-S278 PolarHBondContact O-OG 2.89Å; T275-S278 VanDerWaalsContact O-OG 3.08Å; T275-V279 WeakPolarHBondContact O-CG2 3.35Å; T275-V279 PolarHBondContact O-N 3.11Å
276G95Very high93.8Very high22 Ų2241.1 Ų41.123%0.22722%0.219CC..Hα-helixtrans-70-46.9179.100000113P272 I273 G280P272-G276 PolarHBondContact O-N 2.84Å; I273-G276 PolarHBondContact O-N 3.25Å; G276-G280 PolarHBondContact O-N 3.25Å
277V96Very high94.2Very high66 Ų6637.2 Ų37.240%0.420%0.199SC..Hα-helixtrans-67.3-41.8-179.9174.60000110.7T41 I273 V279 G280 V281T41-V277 HydrophobicContact CG2-CB 4.13Å; T41-V277 HydrophobicContact CG2-CG1 3.76Å; I273-V277 HydrophobicContact CG2-CG2 4.04Å; I273-V277 VanDerWaalsContact O-CB 3.23Å; I273-V277 WeakPolarHBondContact O-CB 3.36Å; I273-V277 WeakPolarHBondContact O-CG2 3.37Å; I273-V277 PolarHBondContact O-N 3.49Å; V277-V279 PolarHBondContact O-N 2.76Å; V277-G280 PolarHBondContact O-N 3.32Å; V277-V281 HydrophobicContact CG1-CG2 3.99Å; V277-V281 WeakPolarHBondContact O-CB 3.16Å; V277-V281 VanDerWaalsContact O-CG2 3.22Å; V277-V281 WeakPolarHBondContact O-CG2 3.25Å; V277-V281 PolarHBondContact O-N 2.86Å
278S95.3Very high94.7Very high0 Ų039.7 Ų39.70%021%0.211CC..Hα-helixtrans-60.6-49.1-179.664.70000111.7I257 A274 T275 V282I257-S278 VanDerWaalsContact CD1-OG 3.25Å; I257-S278 WeakPolarHBondContact CD1-OG 3.48Å; A274-S278 WeakPolarHBondContact O-CB 3.26Å; A274-S278 PolarHBondContact O-N 2.96Å; A274-S278 PolarHBondContact O-OG 3.34Å; T275-S278 PolarHBondContact O-OG 2.89Å; T275-S278 VanDerWaalsContact O-OG 3.08Å; S278-V282 WeakPolarHBondContact O-CB 3.41Å; S278-V282 VanDerWaalsContact O-CG2 3.25Å; S278-V282 WeakPolarHBondContact O-CG2 3.37Å; S278-V282 PolarHBondContact O-N 3.45Å
279V96.3Very high95.1Very high0 Ų033.9 Ų33.90%019%0.185CC..Hα-helixtrans-68.2-38.9-179.5177.60000110.9M48 A80 F81 A84 F251 F254 T275 V277 T283M48-V279 HydrophobicContact CE-CG2 3.97Å; M48-V279 HydrophobicContact SD-CG2 3.99Å; A80-V279 HydrophobicContact CB-CG1 4.12Å; F81-V279 HydrophobicContact CB-CG1 4Å; F81-V279 HydrophobicContact CD2-CB 4.27Å; F81-V279 HydrophobicContact CD2-CG1 4.12Å; A84-V279 HydrophobicContact CB-CB 4.48Å; A84-V279 HydrophobicContact CB-CG2 3.82Å; F251-V279 HydrophobicContact CD1-CG1 4.45Å; F254-V279 HydrophobicContact CB-CG2 3.69Å; F254-V279 HydrophobicContact CD1-CG2 4.07Å; F254-V279 HydrophobicContact CG-CG2 3.93Å; T275-V279 WeakPolarHBondContact O-CG2 3.35Å; T275-V279 PolarHBondContact O-N 3.11Å; V277-V279 PolarHBondContact O-N 2.76Å; V279-T283 VanDerWaalsContact O-CB 3.3Å; V279-T283 WeakPolarHBondContact O-CB 3.32Å; V279-T283 PolarHBondContact O-N 2.8Å; V279-T283 PolarHBondContact O-OG1 3.45Å
280G96.6Very high95.3Very high33 Ų3325 Ų2534%0.3415%0.152SC..Hα-helixtrans-62.1-47.9176.500000113.1G276 V277 T283 L284G276-G280 PolarHBondContact O-N 3.25Å; V277-G280 PolarHBondContact O-N 3.32Å; G280-T283 PolarHBondContact O-N 3.02Å; G280-L284 PolarHBondContact O-N 3.43Å
281V95.8Very high95.5Very high58 Ų5826.2 Ų26.235%0.35216%0.157SC..Hα-helixtrans-62.5-46.9177.9170.30000111I45 V277 T283 L284 L285I45-V281 HydrophobicContact CD1-CB 4.16Å; I45-V281 HydrophobicContact CD1-CG1 3.97Å; V277-V281 HydrophobicContact CG1-CG2 3.99Å; V277-V281 WeakPolarHBondContact O-CB 3.16Å; V277-V281 VanDerWaalsContact O-CG2 3.22Å; V277-V281 WeakPolarHBondContact O-CG2 3.25Å; V277-V281 PolarHBondContact O-N 2.86Å; V281-T283 VanDerWaalsContact C-N 3.33Å; V281-T283 PolarHBondContact O-N 3.47Å; V281-L284 PolarHBondContact O-N 3.03Å; V281-L285 WeakPolarHBondContact O-CB 3.42Å; V281-L285 PolarHBondContact O-N 2.88Å
282V96.1Very high95.7Very high0 Ų026.2 Ų26.20%016%0.157CC..Hα-helixtrans-64.2-39.5179171.20000111.4I45 M48 F251 S278 L284 L285 F286I45-V282 HydrophobicContact CB-CG2 4.32Å; I45-V282 HydrophobicContact CG1-CG2 4.18Å; I45-V282 HydrophobicContact CG2-CG2 4.02Å; M48-V282 HydrophobicContact CB-CG1 4.03Å; M48-V282 HydrophobicContact CB-CG2 4.17Å; M48-V282 HydrophobicContact CE-CB 4.48Å; M48-V282 HydrophobicContact CE-CG2 4.03Å; F251-V282 HydrophobicContact CD1-CG1 4.09Å; F251-V282 HydrophobicContact CE1-CB 4.49Å; F251-V282 HydrophobicContact CE1-CG1 3.89Å; S278-V282 WeakPolarHBondContact O-CB 3.41Å; S278-V282 VanDerWaalsContact O-CG2 3.25Å; S278-V282 WeakPolarHBondContact O-CG2 3.37Å; S278-V282 PolarHBondContact O-N 3.45Å; V282-L284 PolarHBondContact O-N 3.46Å; V282-L285 PolarHBondContact O-N 3.5Å; V282-F286 HydrophobicContact CG1-CD1 4.15Å; V282-F286 HydrophobicContact CG1-CD2 3.84Å; V282-F286 HydrophobicContact CG1-CE1 3.72Å; V282-F286 HydrophobicContact CG1-CE2 3.36Å; V282-F286 HydrophobicContact CG1-CG 4.22Å; V282-F286 HydrophobicContact CG1-CZ 3.34Å; V282-F286 WeakPolarHBondContact O-CB 3.24Å; V282-F286 VanDerWaalsContact O-CG 3.3Å; V282-F286 WeakPolarHBondContact O-CG 3.32Å; V282-F286 PolarHBondContact O-N 3.03Å
283T96.5Very high95.7Very high19 Ų1925.1 Ų25.112%0.11715%0.15CC..Hα-helixtrans-60.1-48.4176.3-59.20000111.3F251 V279 G280 V281 L285 F286 L287F251-T283 WeakPolarHBondContact CE1-OG1 3.17Å; F251-T283 HydrophobicContact CZ-CG2 4.38Å; V279-T283 VanDerWaalsContact O-CB 3.3Å; V279-T283 WeakPolarHBondContact O-CB 3.32Å; V279-T283 PolarHBondContact O-N 2.8Å; V279-T283 PolarHBondContact O-OG1 3.45Å; G280-T283 PolarHBondContact O-N 3.02Å; V281-T283 VanDerWaalsContact C-N 3.33Å; V281-T283 PolarHBondContact O-N 3.47Å; T283-L285 VanDerWaalsContact C-N 3.35Å; T283-F286 PolarHBondContact O-N 3.02Å; T283-L287 WeakPolarHBondContact O-CB 3.38Å; T283-L287 PolarHBondContact O-N 3.19Å
284L96.8Very high95.6Very high105 Ų10522 Ų2255%0.5514%0.135SC..Hα-helixtrans-62.7-44.1178.3-177.365000111.2G280 V281 V282 L287 L288G280-L284 PolarHBondContact O-N 3.43Å; V281-L284 PolarHBondContact O-N 3.03Å; V282-L284 PolarHBondContact O-N 3.46Å; L284-L287 PolarHBondContact O-N 2.9Å; L284-L288 HydrophobicContact CD1-CD1 3.87Å; L284-L288 HydrophobicContact CD1-CG 4.08Å; L284-L288 HydrophobicContact CG-CD1 3.87Å; L284-L288 HydrophobicContact CG-CG 4.38Å; L284-L288 WeakPolarHBondContact O-CB 3.3Å; L284-L288 VanDerWaalsContact O-CG 3.29Å; L284-L288 WeakPolarHBondContact O-CG 3.33Å; L284-L288 PolarHBondContact O-N 3.03Å
285L95.8Very high95.5Very high15 Ų1524.2 Ų24.28%0.07915%0.146CC..Hα-helixtrans-59.7-49178.8-179.568.3000111.5I53 L203 I206 I207 V281 V282 T283 L288 A289I53-L285 HydrophobicContact CD1-CG 4.49Å; L203-L285 HydrophobicContact CD2-CD2 4.05Å; I206-L285 HydrophobicContact CG1-CD1 4.05Å; I206-L285 HydrophobicContact CG1-CD2 4.43Å; I206-L285 HydrophobicContact CG1-CG 4.46Å; I206-L285 HydrophobicContact CG2-CD1 3.77Å; I206-L285 HydrophobicContact CG2-CD2 3.81Å; I206-L285 HydrophobicContact CG2-CG 4.35Å; I207-L285 HydrophobicContact CG1-CD1 4.14Å; V281-L285 WeakPolarHBondContact O-CB 3.42Å; V281-L285 PolarHBondContact O-N 2.88Å; V282-L285 PolarHBondContact O-N 3.5Å; T283-L285 VanDerWaalsContact C-N 3.35Å; L285-L288 PolarHBondContact O-N 3.43Å; L285-A289 WeakPolarHBondContact O-CB 3.46Å; L285-A289 PolarHBondContact O-N 2.88Å
286F96.1Very high95.4Very high1 Ų124.2 Ų24.20%0.00415%0.146CC..Hα-helixtrans-66-40.4-178.9-69-2.8000112.4I53 Y73 A250 F251 V282 T283 S290I53-F286 HydrophobicContact CB-CD1 3.86Å; I53-F286 HydrophobicContact CB-CE1 3.56Å; I53-F286 HydrophobicContact CB-CZ 4.35Å; I53-F286 HydrophobicContact CD1-CD1 3.82Å; I53-F286 HydrophobicContact CD1-CE1 4.28Å; I53-F286 HydrophobicContact CG1-CD1 4.14Å; I53-F286 HydrophobicContact CG1-CE1 4.34Å; I53-F286 HydrophobicContact CG2-CE1 4.32Å; Y73-F286 HydrophobicContact CD1-CB 3.67Å; Y73-F286 AromaticContact CD1-CD2 3.64Å; Y73-F286 HydrophobicContact CD1-CD2 3.64Å; Y73-F286 HydrophobicContact CD1-CG 4.07Å; Y73-F286 HydrophobicContact CD2-CB 4.23Å; Y73-F286 HydrophobicContact CE1-CB 4.06Å; Y73-F286 AromaticContact CE1-CD2 3.6Å; Y73-F286 HydrophobicContact CE1-CD2 3.6Å; Y73-F286 HydrophobicContact CE1-CE2 4.31Å; Y73-F286 HydrophobicContact CE1-CG 4.07Å; Y73-F286 HydrophobicContact CG-CB 3.78Å; A250-F286 HydrophobicContact CB-CD2 4.03Å; A250-F286 HydrophobicContact CB-CE2 3.4Å; A250-F286 VanDerWaalsContact CB-CE2 3.4Å; A250-F286 HydrophobicContact CB-CZ 4.14Å; A250-F286 WeakPolarHBondContact O-CE2 3.44Å; F251-F286 HydrophobicContact CE1-CD2 4.07Å; F251-F286 HydrophobicContact CE1-CE2 4.33Å; F251-F286 HydrophobicContact CE2-CD2 4.03Å; F251-F286 HydrophobicContact CE2-CE2 4.5Å; F251-F286 AromaticContact CZ-CD2 3.71Å; F251-F286 HydrophobicContact CZ-CD2 3.71Å; F251-F286 HydrophobicContact CZ-CE2 4.31Å; V282-F286 HydrophobicContact CG1-CD1 4.15Å; V282-F286 HydrophobicContact CG1-CD2 3.84Å; V282-F286 HydrophobicContact CG1-CE1 3.72Å; V282-F286 HydrophobicContact CG1-CE2 3.36Å; V282-F286 HydrophobicContact CG1-CG 4.22Å; V282-F286 HydrophobicContact CG1-CZ 3.34Å; V282-F286 WeakPolarHBondContact O-CB 3.24Å; V282-F286 VanDerWaalsContact O-CG 3.3Å; V282-F286 WeakPolarHBondContact O-CG 3.32Å; V282-F286 PolarHBondContact O-N 3.03Å; T283-F286 PolarHBondContact O-N 3.02Å; F286-S290 VanDerWaalsContact O-CB 3.27Å; F286-S290 WeakPolarHBondContact O-CB 3.34Å; F286-S290 PolarHBondContact O-N 3.31Å; F286-S290 PolarHBondContact O-OG 3.14Å
287L96.1Very high95.3Very high32 Ų3223.4 Ų23.417%0.16814%0.137CC..Hα-helixtrans-59.8-52.8175.4-173.9162.3000110.6F70 L74 T283 L284 S290 L291F70-L287 HydrophobicContact CB-CG 4.29Å; F70-L287 HydrophobicContact CD2-CD2 4.45Å; F70-L287 HydrophobicContact CD2-CG 4.42Å; L74-L287 HydrophobicContact CB-CD1 4.09Å; L74-L287 HydrophobicContact CD1-CD1 4Å; L74-L287 HydrophobicContact CG-CD1 4.42Å; T283-L287 WeakPolarHBondContact O-CB 3.38Å; T283-L287 PolarHBondContact O-N 3.19Å; L284-L287 PolarHBondContact O-N 2.9Å; L287-S290 PolarHBondContact O-OG 3.49Å; L287-S290 VanDerWaalsContact O-OG 3.13Å; L287-L291 WeakPolarHBondContact O-CB 3.45Å; L287-L291 PolarHBondContact O-N 2.86Å; L287-L291 VanDerWaalsContact O-N 3.11Å
288L97.2Very high95.1Very high66 Ų6621.7 Ų21.735%0.34613%0.127SC..Hα-helixtrans-67.6-43.2-177.2-68.4179.1000112.2T210 F214 L284 L285 L291 A292T210-L288 HydrophobicContact CG2-CB 4.1Å; F214-L288 HydrophobicContact CE2-CB 4.26Å; F214-L288 HydrophobicContact CE2-CD2 4.4Å; F214-L288 WeakPolarHBondContact CE2-O 3.38Å; F214-L288 HydrophobicContact CZ-CD2 4.39Å; F214-L288 WeakPolarHBondContact CZ-O 3.41Å; L284-L288 HydrophobicContact CD1-CD1 3.87Å; L284-L288 HydrophobicContact CD1-CG 4.08Å; L284-L288 HydrophobicContact CG-CD1 3.87Å; L284-L288 HydrophobicContact CG-CG 4.38Å; L284-L288 WeakPolarHBondContact O-CB 3.3Å; L284-L288 VanDerWaalsContact O-CG 3.29Å; L284-L288 WeakPolarHBondContact O-CG 3.33Å; L284-L288 PolarHBondContact O-N 3.03Å; L285-L288 PolarHBondContact O-N 3.43Å; L288-L291 PolarHBondContact O-N 3.28Å; L288-A292 VanDerWaalsContact O-CB 3.27Å; L288-A292 WeakPolarHBondContact O-CB 3.19Å; L288-A292 PolarHBondContact O-N 3.46Å
289A96.2Very high94.9Very high0 Ų022.6 Ų22.60%013%0.13CC..Hα-helixtrans-68.9-39.5-17800000112.5I53 T210 L285 A292 L293 F308I53-A289 HydrophobicContact CD1-CB 3.4Å; I53-A289 VanDerWaalsContact CD1-CB 3.4Å; T210-A289 HydrophobicContact CG2-CB 4.47Å; T210-A289 WeakPolarHBondContact OG1-CB 3.28Å; L285-A289 WeakPolarHBondContact O-CB 3.46Å; L285-A289 PolarHBondContact O-N 2.88Å; A289-A292 PolarHBondContact O-N 3.04Å; A289-L293 VanDerWaalsContact O-CB 3.27Å; A289-L293 WeakPolarHBondContact O-CB 3.4Å; A289-L293 PolarHBondContact O-N 3.07Å; A289-F308 HydrophobicContact CB-CE1 3.97Å; A289-F308 HydrophobicContact CB-CZ 4.02Å
290S95.4Very high94.7Very high1 Ų127 Ų271%0.00715%0.147CC..Hα-helixtrans-68.4-36.9175.259.70000112.4F70 F286 L287 T294F70-S290 WeakPolarHBondContact CA-OG 3.21Å; F70-S290 WeakPolarHBondContact CB-OG 3.37Å; F286-S290 VanDerWaalsContact O-CB 3.27Å; F286-S290 WeakPolarHBondContact O-CB 3.34Å; F286-S290 PolarHBondContact O-N 3.31Å; F286-S290 PolarHBondContact O-OG 3.14Å; L287-S290 PolarHBondContact O-OG 3.49Å; L287-S290 VanDerWaalsContact O-OG 3.13Å; S290-T294 WeakPolarHBondContact O-CG2 2.9Å; S290-T294 PolarHBondContact O-N 3.39Å; S290-T294 VanDerWaalsContact O-N 3.16Å; S290-T294 PolarHBondContact O-OG1 3.42Å
291L95.1Very high94.4Very high37 Ų3729 Ų2919%0.19415%0.152CC..Hα-helixtrans-65.4-45.7172.3-179.860.3000111.6F70 F214 F224 L287 L288 L293 T294 L295F70-L291 HydrophobicContact CB-CB 4.08Å; F70-L291 HydrophobicContact CD1-CD1 3.98Å; F70-L291 HydrophobicContact CE1-CD1 4.21Å; F70-L291 HydrophobicContact CG-CB 4.36Å; F70-L291 HydrophobicContact CG-CD1 4.39Å; F214-L291 HydrophobicContact CE1-CD2 4.15Å; F214-L291 HydrophobicContact CE1-CG 4.03Å; F214-L291 HydrophobicContact CZ-CB 4.24Å; F214-L291 HydrophobicContact CZ-CD2 4.08Å; F214-L291 HydrophobicContact CZ-CG 4.08Å; F224-L291 HydrophobicContact CE1-CD1 4.32Å; F224-L291 HydrophobicContact CE2-CD1 3.72Å; F224-L291 HydrophobicContact CZ-CD1 3.47Å; F224-L291 VanDerWaalsContact CZ-CD1 3.47Å; L287-L291 WeakPolarHBondContact O-CB 3.45Å; L287-L291 PolarHBondContact O-N 2.86Å; L287-L291 VanDerWaalsContact O-N 3.11Å; L288-L291 PolarHBondContact O-N 3.28Å; L291-L293 VanDerWaalsContact C-N 3.35Å; L291-L293 PolarHBondContact O-N 3.46Å; L291-T294 PolarHBondContact O-N 3.47Å; L291-T294 PolarHBondContact O-OG1 3.02Å; L291-L295 HydrophobicContact CD1-CD1 4.22Å; L291-L295 HydrophobicContact CG-CD1 4.08Å; L291-L295 WeakPolarHBondContact O-CG 3.29Å; L291-L295 PolarHBondContact O-N 3.48Å
292A95.4Very high94.2Very high0 Ų026.3 Ų26.30%014%0.137CC..Hα-helixtrans-62-43.2178.300000111.6T210 M213 F214 L288 A289 T294 L295 F296T210-A292 HydrophobicContact CG2-CB 3.84Å; M213-A292 HydrophobicContact CB-CB 3.74Å; F214-A292 HydrophobicContact CD1-CB 4.29Å; F214-A292 HydrophobicContact CD2-CB 3.73Å; F214-A292 HydrophobicContact CE1-CB 4.17Å; F214-A292 HydrophobicContact CE2-CB 3.61Å; F214-A292 HydrophobicContact CG-CB 4.07Å; F214-A292 HydrophobicContact CZ-CB 3.82Å; L288-A292 VanDerWaalsContact O-CB 3.27Å; L288-A292 WeakPolarHBondContact O-CB 3.19Å; L288-A292 PolarHBondContact O-N 3.46Å; A289-A292 PolarHBondContact O-N 3.04Å; A292-T294 PolarHBondContact O-N 2.83Å; A292-L295 PolarHBondContact O-N 3.23Å; A292-F296 VanDerWaalsContact O-CB 3.23Å; A292-F296 WeakPolarHBondContact O-CB 3.33Å; A292-F296 PolarHBondContact O-N 3.19Å
293L94.7Very high93.9Very high0 Ų029.1 Ų29.10%015%0.152CC..Hα-helixtrans-61.5-44.4178.717961.4000112.1T57 I61 M213 A289 L291 L295 F296 V297 V302 A307 F308 A311T57-L293 HydrophobicContact CG2-CD2 4.14Å; I61-L293 HydrophobicContact CD1-CD2 3.59Å; I61-L293 HydrophobicContact CD1-CG 4.22Å; M213-L293 HydrophobicContact CE-CD1 3.8Å; M213-L293 HydrophobicContact SD-CB 4.4Å; M213-L293 HydrophobicContact SD-CD1 4.4Å; A289-L293 VanDerWaalsContact O-CB 3.27Å; A289-L293 WeakPolarHBondContact O-CB 3.4Å; A289-L293 PolarHBondContact O-N 3.07Å; L291-L293 VanDerWaalsContact C-N 3.35Å; L291-L293 PolarHBondContact O-N 3.46Å; L293-L295 VanDerWaalsContact C-N 3.31Å; L293-L295 PolarHBondContact O-N 2.87Å; L293-F296 PolarHBondContact O-N 3.14Å; L293-V297 HydrophobicContact CD1-CG2 3.99Å; L293-V297 WeakPolarHBondContact O-CG2 3.37Å; L293-V297 PolarHBondContact O-N 3.27Å; L293-V302 HydrophobicContact CD2-CG1 4.08Å; L293-V302 HydrophobicContact CG-CG2 4.46Å; L293-A307 HydrophobicContact CD2-CB 3.83Å; L293-F308 HydrophobicContact CB-CE1 4.18Å; L293-F308 HydrophobicContact CD2-CE1 4.25Å; L293-F308 HydrophobicContact CD2-CE2 4.47Å; L293-F308 HydrophobicContact CD2-CZ 4.19Å; L293-A311 HydrophobicContact CD1-CB 3.61Å
294T93.1Very high93.3Very high7 Ų734.3 Ų34.34%0.04317%0.169CC..Hα-helixtrans-72.1-22.3179.147.90000113.3I61 F224 S290 L291 A292 W299I61-T294 HydrophobicContact CD1-CG2 3.86Å; I61-T294 HydrophobicContact CG1-CG2 4.09Å; I61-T294 HydrophobicContact CG2-CG2 3.82Å; F224-T294 WeakPolarHBondContact CE2-OG1 3.49Å; S290-T294 WeakPolarHBondContact O-CG2 2.9Å; S290-T294 PolarHBondContact O-N 3.39Å; S290-T294 VanDerWaalsContact O-N 3.16Å; S290-T294 PolarHBondContact O-OG1 3.42Å; L291-T294 PolarHBondContact O-N 3.47Å; L291-T294 PolarHBondContact O-OG1 3.02Å; A292-T294 PolarHBondContact O-N 2.83Å; T294-W299 HydrophobicContact CG2-CB 4.26Å
295L92Very high92.6Very high46 Ų4634.2 Ų34.224%0.24117%0.166CC..Hα-helixtrans-79.1-31.5167.9-75.5163.3000112.9F214 N218 F224 L291 A292 L293F214-L295 HydrophobicContact CD1-CD1 3.83Å; F214-L295 HydrophobicContact CE1-CD1 3.59Å; N218-L295 PolarHBondContact N-O 3.16Å; F224-L295 HydrophobicContact CB-CD2 3.98Å; F224-L295 HydrophobicContact CD2-CD2 3.29Å; F224-L295 HydrophobicContact CD2-CG 3.57Å; F224-L295 HydrophobicContact CE2-CD2 4.02Å; F224-L295 HydrophobicContact CE2-CG 3.78Å; F224-L295 HydrophobicContact CG-CD2 3.92Å; L291-L295 HydrophobicContact CD1-CD1 4.22Å; L291-L295 HydrophobicContact CG-CD1 4.08Å; L291-L295 WeakPolarHBondContact O-CG 3.29Å; L291-L295 PolarHBondContact O-N 3.48Å; A292-L295 PolarHBondContact O-N 3.23Å; L293-L295 VanDerWaalsContact C-N 3.31Å; L293-L295 PolarHBondContact O-N 2.87Å
296F92.8Very high92.1Very high1 Ų134 Ų340%0.00417%0.166CC..Hα-helixtrans-80.9-35.1-174.2-173-109000112.9M213 R216 A292 L293 A311 F312 R315 Y317M213-F296 HydrophobicContact CB-CB 3.92Å; M213-F296 HydrophobicContact CB-CD2 4.14Å; M213-F296 HydrophobicContact CB-CG 4.08Å; M213-F296 HydrophobicContact CE-CD1 3.93Å; M213-F296 HydrophobicContact CE-CE1 4.38Å; M213-F296 HydrophobicContact CE-CG 4.49Å; M213-F296 HydrophobicContact CG-CB 3.84Å; M213-F296 HydrophobicContact CG-CD1 3.96Å; M213-F296 HydrophobicContact CG-CD2 3.97Å; M213-F296 HydrophobicContact CG-CE1 4.5Å; M213-F296 HydrophobicContact CG-CG 3.66Å; R216-F296 HydrophobicContact CB-CD2 4.39Å; R216-F296 HydrophobicContact CB-CE2 4.01Å; R216-F296 WeakPolarHBondContact O-CD2 3.38Å; A292-F296 VanDerWaalsContact O-CB 3.23Å; A292-F296 WeakPolarHBondContact O-CB 3.33Å; A292-F296 PolarHBondContact O-N 3.19Å; L293-F296 PolarHBondContact O-N 3.14Å; F296-A311 HydrophobicContact CD1-CB 4.05Å; F296-A311 HydrophobicContact CE1-CB 4.31Å; F296-A311 WeakPolarHBondContact CE1-O 3.44Å; F296-F312 AromaticContact CE1-CD1 3.92Å; F296-F312 HydrophobicContact CE1-CD1 3.92Å; F296-F312 HydrophobicContact CE1-CE1 4.12Å; F296-F312 HydrophobicContact CE1-CG 4.39Å; F296-F312 HydrophobicContact CE2-CE1 4.39Å; F296-F312 AromaticContact CZ-CD1 3.74Å; F296-F312 HydrophobicContact CZ-CD1 3.74Å; F296-F312 AromaticContact CZ-CE1 3.77Å; F296-F312 HydrophobicContact CZ-CE1 3.77Å; F296-R315 HydrophobicContact CD1-CG 4.37Å; F296-R315 HydrophobicContact CE1-CB 4.05Å; F296-R315 HydrophobicContact CE1-CG 3.66Å; F296-R315 HydrophobicContact CE2-CG 4.44Å; F296-R315 HydrophobicContact CZ-CB 3.84Å; F296-R315 HydrophobicContact CZ-CG 3.7Å; F296-R315 PolarHBondContact O-NE 3.28Å; F296-R315 VanDerWaalsContact O-NE 3.16Å; F296-R315 PolarHBondContact O-NH2 2.85Å; F296-Y317 HydrophobicContact CE2-CE2 4.44Å; F296-Y317 HydrophobicContact CZ-CD2 4.07Å; F296-Y317 HydrophobicContact CZ-CE2 4.13Å
297V92.2Very high91.9Very high5 Ų534 Ų343%0.0317%0.166CC..SBendtrans-137.4148175.7-73.40000110.7L293 W299 V302 A311 R315L293-V297 HydrophobicContact CD1-CG2 3.99Å; L293-V297 WeakPolarHBondContact O-CG2 3.37Å; L293-V297 PolarHBondContact O-N 3.27Å; V297-W299 PolarHBondContact O-N 3.22Å; V297-V302 HydrophobicContact CG2-CG2 3.85Å; V297-A311 HydrophobicContact CG1-CB 4.04Å; V297-A311 HydrophobicContact CG2-CB 3.81Å; V297-R315 HydrophobicContact CG1-CG 4.16Å
298P91.8Very high91.7Very high30 Ų3032.6 Ų32.620%0.19516%0.159CC..  trans-54.7128.4175.8-2332.2000111.4W300 T301P298-W300 HydrophobicContact CB-CD2 3.98Å; P298-W300 HydrophobicContact CB-CE3 4.21Å; P298-W300 HydrophobicContact CB-CH2 3.8Å; P298-W300 HydrophobicContact CB-CZ2 3.53Å; P298-W300 HydrophobicContact CB-CZ3 4.12Å; P298-W300 HydrophobicContact CG-CZ2 4.34Å; P298-W300 PolarHBondContact O-N 3.31Å; P298-T301 HydrophobicContact CB-CG2 4.34Å; P298-T301 PolarHBondContact O-N 2.95Å; P298-T301 PolarHBondContact O-OG1 3.44Å
299W91.2Very high91.4Very high19 Ų1929.8 Ų29.87%0.07215%0.145CC..G310 helixtrans-58.3-28.7-168.667.8-95.8000114.5I61 P67 H229 P234 Y235 T294 V297 T301 V302I61-W299 HydrophobicContact CG2-CB 3.82Å; P67-W299 HydrophobicContact CG-CB 4.17Å; P67-W299 HydrophobicContact CG-CD2 4.38Å; P67-W299 HydrophobicContact CG-CG 3.71Å; H229-W299 HydrophobicContact CB-CZ2 3.98Å; H229-W299 WeakPolarHBondContact O-CZ2 3.33Å; P234-W299 HydrophobicContact CB-CH2 3.74Å; P234-W299 HydrophobicContact CB-CZ2 3.62Å; P234-W299 HydrophobicContact CG-CH2 3.85Å; P234-W299 HydrophobicContact CG-CZ2 3.76Å; P234-W299 HydrophobicContact CG-CZ3 4.35Å; Y235-W299 HydrophobicContact CE2-CH2 4.27Å; Y235-W299 AromaticContact CE2-CZ3 3.95Å; Y235-W299 HydrophobicContact CE2-CZ3 3.95Å; T294-W299 HydrophobicContact CG2-CB 4.26Å; V297-W299 PolarHBondContact O-N 3.22Å; W299-T301 VanDerWaalsContact C-N 3.28Å; W299-T301 PolarHBondContact O-N 2.96Å; W299-V302 PolarHBondContact O-N 3.25Å
300W91.4Very high91Very high92 Ų9231 Ų3135%0.34815%0.154SC..G310 helixtrans-75.8-13.617757.990000113.9P226 H229 P298P226-W300 HydrophobicContact CG-CH2 3.67Å; P226-W300 HydrophobicContact CG-CZ3 3.67Å; H229-W300 HydrophobicContact CB-CE3 4.01Å; H229-W300 HydrophobicContact CB-CZ3 3.81Å; H229-W300 AromaticContact CD2-CD2 3.57Å; H229-W300 AromaticContact CD2-CE2 3.82Å; H229-W300 AromaticContact CD2-CE3 3.51Å; H229-W300 AromaticContact CD2-CH2 3.96Å; H229-W300 AromaticContact CD2-CZ3 3.72Å; H229-W300 AromaticContact CE1-CH2 3.77Å; H229-W300 AromaticContact CE1-CZ2 3.73Å; H229-W300 AromaticContact CG-CE3 3.74Å; H229-W300 AromaticContact CG-CH2 3.83Å; H229-W300 AromaticContact CG-CZ3 3.52Å; H229-W300 AromaticContact ND1-CH2 3.7Å; H229-W300 AromaticContact ND1-CZ3 3.87Å; H229-W300 AromaticContact NE2-CD2 3.88Å; H229-W300 AromaticContact NE2-CE2 3.61Å; H229-W300 AromaticContact NE2-CH2 3.94Å; H229-W300 AromaticContact NE2-CZ2 3.64Å; P298-W300 HydrophobicContact CB-CD2 3.98Å; P298-W300 HydrophobicContact CB-CE3 4.21Å; P298-W300 HydrophobicContact CB-CH2 3.8Å; P298-W300 HydrophobicContact CB-CZ2 3.53Å; P298-W300 HydrophobicContact CB-CZ3 4.12Å; P298-W300 HydrophobicContact CG-CZ2 4.34Å; P298-W300 PolarHBondContact O-N 3.31Å
301T90.8Very high90.9Very high74 Ų7431.2 Ų31.245%0.45416%0.156SC..G310 helixtrans-97.3-3.9177.264.50000113.3P298 W299 D303P298-T301 HydrophobicContact CB-CG2 4.34Å; P298-T301 PolarHBondContact O-N 2.95Å; P298-T301 PolarHBondContact O-OG1 3.44Å; W299-T301 VanDerWaalsContact C-N 3.28Å; W299-T301 PolarHBondContact O-N 2.96Å; T301-D303 PolarHBondContact O-N 3.4Å
302V91.7Very high90.8Very high3 Ų329.6 Ų29.62%0.01815%0.148CC..  trans-63.5125.2-178.81730000110.1I61 R62 L293 V297 W299 A307I61-V302 HydrophobicContact CB-CG1 4.44Å; I61-V302 HydrophobicContact CD1-CG1 4.38Å; I61-V302 HydrophobicContact CG2-CB 4.2Å; I61-V302 HydrophobicContact CG2-CG1 4.44Å; I61-V302 HydrophobicContact CG2-CG2 4.02Å; R62-V302 VanDerWaalsContact CD-O 3.28Å; R62-V302 WeakPolarHBondContact CD-O 3.05Å; L293-V302 HydrophobicContact CD2-CG1 4.08Å; L293-V302 HydrophobicContact CG-CG2 4.46Å; V297-V302 HydrophobicContact CG2-CG2 3.85Å; W299-V302 PolarHBondContact O-N 3.25Å; V302-A307 HydrophobicContact CG1-CB 3.94Å
303D89.1Confident90.4Very high59 Ų5934.4 Ų34.432%0.31617%0.17SC..  trans-64.7145.8177.8-174.3-99.3000112.2G58 T301 Q305 A306 A310G58-D303 VanDerWaalsContact CA-O 3.26Å; G58-D303 WeakPolarHBondContact CA-O 3.49Å; T301-D303 PolarHBondContact O-N 3.4Å; D303-Q305 PolarHBondContact OD1-N 3.33Å; D303-A306 PolarHBondContact OD1-N 2.92Å; D303-A310 HydrophobicContact CB-CB 3.54Å
304R85.5Confident90.1Very high128 Ų12839.1 Ų39.148%0.48320%0.198SC..SBendtrans-72.2-39.4-176.2-66.4-175.1178.472.52.2113.7T59 R62T59-R304 PolarHBondContact OG1-O 3.32Å; R62-R304 VanDerWaalsContact NE-CZ 3.28Å
305Q81.1Confident90Very high102 Ų10241.9 Ų41.948%0.47721%0.208SC..SBendtrans-103-41.4-165.9-67.8178-9.400111.6D303D303-Q305 PolarHBondContact OD1-N 3.33Å
306A85.8Confident89.8Confident10 Ų1046.4 Ų46.48%0.08323%0.233CC..  trans-126.453.3-17400000111.3A141 D303 F308 T309 A310A141-A306 HydrophobicContact CB-CB 3.8Å; D303-A306 PolarHBondContact OD1-N 2.92Å; A306-F308 VanDerWaalsContact C-N 3.34Å; A306-F308 PolarHBondContact O-N 2.87Å; A306-T309 PolarHBondContact O-N 3.4Å; A306-A310 WeakPolarHBondContact O-CB 3.35Å; A306-A310 PolarHBondContact O-N 3.35Å
307A90.8Very high89.6Confident2 Ų249.1 Ų49.12%0.01724%0.243CC..Hα-helixtrans-50.6-47-168.200000114.3L293 V302 A311L293-A307 HydrophobicContact CD2-CB 3.83Å; V302-A307 HydrophobicContact CG1-CB 3.94Å; A307-A311 WeakPolarHBondContact O-CB 3.49Å; A307-A311 PolarHBondContact O-N 2.96Å
308F91.8Very high89.4Confident3 Ų355.5 Ų55.51%0.01327%0.273CS..Hα-helixtrans-75-47.6-178.1-63.6-88.1000112.4I53 Y54 T57 I206 M213 A289 L293 A306 A311 F312I53-F308 HydrophobicContact CD1-CE2 4.22Å; I53-F308 HydrophobicContact CD1-CZ 3.83Å; I53-F308 HydrophobicContact CG1-CE2 3.55Å; I53-F308 HydrophobicContact CG1-CZ 3.6Å; Y54-F308 HydrophobicContact CD1-CD2 4.22Å; Y54-F308 HydrophobicContact CE1-CD2 4.39Å; T57-F308 HydrophobicContact CG2-CE2 4.31Å; T57-F308 HydrophobicContact CG2-CZ 4.26Å; I206-F308 HydrophobicContact CD1-CD1 4.18Å; I206-F308 HydrophobicContact CD1-CE1 4.14Å; I206-F308 HydrophobicContact CD1-CG 4.43Å; I206-F308 HydrophobicContact CD1-CZ 4.34Å; M213-F308 HydrophobicContact CE-CB 4.47Å; M213-F308 HydrophobicContact CE-CD1 3.92Å; M213-F308 HydrophobicContact SD-CD1 4.01Å; M213-F308 HydrophobicContact SD-CE1 4.4Å; A289-F308 HydrophobicContact CB-CE1 3.97Å; A289-F308 HydrophobicContact CB-CZ 4.02Å; L293-F308 HydrophobicContact CB-CE1 4.18Å; L293-F308 HydrophobicContact CD2-CE1 4.25Å; L293-F308 HydrophobicContact CD2-CE2 4.47Å; L293-F308 HydrophobicContact CD2-CZ 4.19Å; A306-F308 VanDerWaalsContact C-N 3.34Å; A306-F308 PolarHBondContact O-N 2.87Å; F308-A311 PolarHBondContact O-N 3.27Å; F308-F312 WeakPolarHBondContact O-CD2 3.3Å; F308-F312 PolarHBondContact O-N 3.02Å
309T90.8Very high89.3Confident7 Ų760.7 Ų60.74%0.04329%0.289CS..Hα-helixtrans-62.9-46.5-179.4-600000111.7M142 A306 A311 F312 H313 T321 T324 G325M142-T309 HydrophobicContact CG-CG2 4.5Å; A306-T309 PolarHBondContact O-N 3.4Å; T309-A311 VanDerWaalsContact C-N 3.34Å; T309-A311 PolarHBondContact O-N 3.19Å; T309-F312 PolarHBondContact O-N 2.79Å; T309-H313 PolarHBondContact O-N 3.29Å; T309-H313 VanDerWaalsContact O-N 3.12Å; T309-T321 HydrophobicContact CG2-CG2 3.61Å; T309-T321 WeakPolarHBondContact CG2-O 3.41Å; T309-T324 WeakPolarHBondContact CA-OG1 3.34Å; T309-T324 PolarHBondContact OG1-OG1 3.09Å; T309-G325 WeakPolarHBondContact OG1-CA 3.47Å; T309-G325 PolarHBondContact OG1-N 2.99Å
310A89.4Confident89.3Confident25 Ų2560 Ų6021%0.20729%0.287CS..Hα-helixtrans-64.6-38.1177.400000111.7D303 A306 F312 H313 V314D303-A310 HydrophobicContact CB-CB 3.54Å; A306-A310 WeakPolarHBondContact O-CB 3.35Å; A306-A310 PolarHBondContact O-N 3.35Å; A310-F312 VanDerWaalsContact C-N 3.34Å; A310-F312 PolarHBondContact O-N 2.76Å; A310-H313 WeakPolarHBondContact O-CB 3.47Å; A310-H313 PolarHBondContact O-N 3.03Å; A310-H313 VanDerWaalsContact O-N 3.14Å; A310-V314 WeakPolarHBondContact O-CG2 3.3Å; A310-V314 PolarHBondContact O-N 3.39Å
311A92Very high89.3Confident6 Ų656.3 Ų56.35%0.0528%0.275CS..Hα-helixtrans-60.7-42177.800000112.4M213 L293 F296 V297 A307 F308 T309 R315M213-A311 HydrophobicContact CE-CB 4.04Å; L293-A311 HydrophobicContact CD1-CB 3.61Å; F296-A311 HydrophobicContact CD1-CB 4.05Å; F296-A311 HydrophobicContact CE1-CB 4.31Å; F296-A311 WeakPolarHBondContact CE1-O 3.44Å; V297-A311 HydrophobicContact CG1-CB 4.04Å; V297-A311 HydrophobicContact CG2-CB 3.81Å; A307-A311 WeakPolarHBondContact O-CB 3.49Å; A307-A311 PolarHBondContact O-N 2.96Å; F308-A311 PolarHBondContact O-N 3.27Å; T309-A311 VanDerWaalsContact C-N 3.34Å; T309-A311 PolarHBondContact O-N 3.19Å; A311-R315 PolarHBondContact O-N 3.14Å
312F92.5Very high89.2Confident2 Ų259.6 Ų59.61%0.00928%0.279CS..Hα-helixtrans-67-36.6173.9-79.2-66.1000112.9A209 V212 M213 F296 F308 T309 A310 R315 N316 Y317 A320 T324A209-F312 HydrophobicContact CB-CE2 4.03Å; A209-F312 HydrophobicContact CB-CZ 4.4Å; V212-F312 HydrophobicContact CB-CE1 4.46Å; V212-F312 HydrophobicContact CB-CZ 4.33Å; V212-F312 HydrophobicContact CG1-CE1 3.79Å; V212-F312 HydrophobicContact CG1-CZ 4.16Å; M213-F312 HydrophobicContact CE-CD2 4Å; M213-F312 HydrophobicContact CE-CE2 3.54Å; M213-F312 HydrophobicContact CE-CZ 3.98Å; M213-F312 HydrophobicContact CG-CE1 4.46Å; M213-F312 HydrophobicContact CG-CE2 4.3Å; M213-F312 HydrophobicContact CG-CZ 3.81Å; M213-F312 HydrophobicContact SD-CE2 4.44Å; F296-F312 AromaticContact CE1-CD1 3.92Å; F296-F312 HydrophobicContact CE1-CD1 3.92Å; F296-F312 HydrophobicContact CE1-CE1 4.12Å; F296-F312 HydrophobicContact CE1-CG 4.39Å; F296-F312 HydrophobicContact CE2-CE1 4.39Å; F296-F312 AromaticContact CZ-CD1 3.74Å; F296-F312 HydrophobicContact CZ-CD1 3.74Å; F296-F312 AromaticContact CZ-CE1 3.77Å; F296-F312 HydrophobicContact CZ-CE1 3.77Å; F308-F312 WeakPolarHBondContact O-CD2 3.3Å; F308-F312 PolarHBondContact O-N 3.02Å; T309-F312 PolarHBondContact O-N 2.79Å; A310-F312 VanDerWaalsContact C-N 3.34Å; A310-F312 PolarHBondContact O-N 2.76Å; F312-R315 CarbonylContact O-C 3.58Å; F312-R315 PolarHBondContact O-N 3.15Å; F312-N316 PolarHBondContact O-N 3.34Å; F312-Y317 HydrophobicContact CD1-CD2 4.27Å; F312-Y317 HydrophobicContact CD1-CG 4.35Å; F312-Y317 PolarHBondContact O-N 2.66Å; F312-A320 HydrophobicContact CB-CB 4.12Å; F312-A320 HydrophobicContact CD1-CB 3.5Å; F312-A320 VanDerWaalsContact CD1-CB 3.5Å; F312-A320 HydrophobicContact CD2-CB 4.17Å; F312-A320 HydrophobicContact CE1-CB 3.87Å; F312-A320 HydrophobicContact CE2-CB 4.49Å; F312-A320 HydrophobicContact CG-CB 3.66Å; F312-A320 HydrophobicContact CZ-CB 4.36Å; F312-T324 HydrophobicContact CD2-CG2 3.71Å; F312-T324 HydrophobicContact CE2-CG2 3.6Å
313H88.9Confident89.3Confident102 Ų10263 Ų6347%0.47230%0.297SS..Hα-helixtrans-64.4-45.9177.5-176.7-84.1000111.5T309 A310 R315 N316 T321T309-H313 PolarHBondContact O-N 3.29Å; T309-H313 VanDerWaalsContact O-N 3.12Å; A310-H313 WeakPolarHBondContact O-CB 3.47Å; A310-H313 PolarHBondContact O-N 3.03Å; A310-H313 VanDerWaalsContact O-N 3.14Å; H313-R315 PolarHBondContact O-N 3.29Å; H313-N316 PolarHBondContact O-N 2.65Å; H313-T321 WeakPolarHBondContact CA-OG1 3.16Å; H313-T321 HydrophobicContact CB-CG2 3.99Å; H313-T321 PolarHBondContact N-OG1 3.23Å; H313-T321 VanDerWaalsContact N-OG1 3.09Å
314V88.4Confident89.4Confident98 Ų9860.5 Ų60.559%0.59428%0.284SS*.Hα-helixtrans-60.7-30.1177171.60000112A310 N316A310-V314 WeakPolarHBondContact O-CG2 3.3Å; A310-V314 PolarHBondContact O-N 3.39Å; V314-N316 VanDerWaalsContact C-N 3.34Å
315R89.2Confident89.7Confident66 Ų6654.4 Ų54.425%0.24926%0.261CS..THydrogen-bonded Turntrans-89.58.3176.1-70.9-69-152.6125.624.3113.9P217 N218 F296 V297 A311 F312 H313 Y317P217-R315 PolarHBondContact O-NH2 3.35Å; N218-R315 VanDerWaalsContact CB-NH2 3.28Å; F296-R315 HydrophobicContact CD1-CG 4.37Å; F296-R315 HydrophobicContact CE1-CB 4.05Å; F296-R315 HydrophobicContact CE1-CG 3.66Å; F296-R315 HydrophobicContact CE2-CG 4.44Å; F296-R315 HydrophobicContact CZ-CB 3.84Å; F296-R315 HydrophobicContact CZ-CG 3.7Å; F296-R315 PolarHBondContact O-NE 3.28Å; F296-R315 VanDerWaalsContact O-NE 3.16Å; F296-R315 PolarHBondContact O-NH2 2.85Å; V297-R315 HydrophobicContact CG1-CG 4.16Å; A311-R315 PolarHBondContact O-N 3.14Å; F312-R315 CarbonylContact O-C 3.58Å; F312-R315 PolarHBondContact O-N 3.15Å; H313-R315 PolarHBondContact O-N 3.29Å; R315-Y317 VanDerWaalsContact C-N 3.28Å; R315-Y317 HydrophobicContact CB-CD2 3.66Å; R315-Y317 HydrophobicContact CB-CE2 3.92Å; R315-Y317 WeakPolarHBondContact O-CD2 3.48Å; R315-Y317 PolarHBondContact O-N 2.89Å
316N88.4Confident90.3Very high141 Ų14153.2 Ų53.275%0.75426%0.26SS*.THydrogen-bonded Turntrans59.428.5-179.8-58-45.9000115F312 H313 V314 E318F312-N316 PolarHBondContact O-N 3.34Å; H313-N316 PolarHBondContact O-N 2.65Å; V314-N316 VanDerWaalsContact C-N 3.34Å; N316-E318 PolarHBondContact O-N 3.3Å
317Y88.9Confident90.6Very high58 Ų5852.7 Ų52.723%0.22726%0.256CS..  trans-93.772.1171.7-69-80.4000110.6R216 F296 F312 R315 W319 A320 T321R216-Y317 PolarHBondContact NH1-OH 2.82Å; F296-Y317 HydrophobicContact CE2-CE2 4.44Å; F296-Y317 HydrophobicContact CZ-CD2 4.07Å; F296-Y317 HydrophobicContact CZ-CE2 4.13Å; F312-Y317 HydrophobicContact CD1-CD2 4.27Å; F312-Y317 HydrophobicContact CD1-CG 4.35Å; F312-Y317 PolarHBondContact O-N 2.66Å; R315-Y317 VanDerWaalsContact C-N 3.28Å; R315-Y317 HydrophobicContact CB-CD2 3.66Å; R315-Y317 HydrophobicContact CB-CE2 3.92Å; R315-Y317 WeakPolarHBondContact O-CD2 3.48Å; R315-Y317 PolarHBondContact O-N 2.89Å; Y317-W319 VanDerWaalsContact C-N 3.32Å; Y317-W319 AromaticContact CD1-NE1 3.95Å; Y317-W319 PolarHBondContact O-N 3.39Å; Y317-A320 PolarHBondContact O-N 2.99Å; Y317-T321 PolarHBondContact O-N 3.04Å; Y317-T321 PolarHBondContact O-OG1 3.49Å
318E87.6Confident90.7Very high138 Ų13852.9 Ų52.965%0.64526%0.257SS*.Hα-helixtrans-55.2-43.7-173.4-65-169164.900113.4N316 A320 T321 Y322N316-E318 PolarHBondContact O-N 3.3Å; E318-A320 VanDerWaalsContact C-N 3.26Å; E318-A320 PolarHBondContact O-N 3.32Å; E318-T321 WeakPolarHBondContact O-CB 3.5Å; E318-T321 PolarHBondContact O-N 3.47Å; E318-Y322 WeakPolarHBondContact O-CD2 3.28Å; E318-Y322 PolarHBondContact O-N 3.35Å
319W90.3Very high90.8Very high140 Ų14054.1 Ų54.153%0.5326%0.264SS..Hα-helixtrans-59.2-39.2178.167.5-92.5000111.9Y317 I323Y317-W319 VanDerWaalsContact C-N 3.32Å; Y317-W319 AromaticContact CD1-NE1 3.95Å; Y317-W319 PolarHBondContact O-N 3.39Å; W319-I323 HydrophobicContact CE3-CD1 3.7Å; W319-I323 HydrophobicContact CZ3-CD1 4.03Å; W319-I323 VanDerWaalsContact O-CG1 3.31Å; W319-I323 WeakPolarHBondContact O-CG1 3.24Å; W319-I323 PolarHBondContact O-N 3.48Å; W319-I323 VanDerWaalsContact O-N 3.17Å
320A91.7Very high90.9Very high4 Ų455.9 Ų55.93%0.03327%0.273CS..Hα-helixtrans-75.1-32.3179.900000111.7F312 Y317 E318 I323 T324F312-A320 HydrophobicContact CB-CB 4.12Å; F312-A320 HydrophobicContact CD1-CB 3.5Å; F312-A320 VanDerWaalsContact CD1-CB 3.5Å; F312-A320 HydrophobicContact CD2-CB 4.17Å; F312-A320 HydrophobicContact CE1-CB 3.87Å; F312-A320 HydrophobicContact CE2-CB 4.49Å; F312-A320 HydrophobicContact CG-CB 3.66Å; F312-A320 HydrophobicContact CZ-CB 4.36Å; Y317-A320 PolarHBondContact O-N 2.99Å; E318-A320 VanDerWaalsContact C-N 3.26Å; E318-A320 PolarHBondContact O-N 3.32Å; A320-I323 PolarHBondContact O-N 3.02Å; A320-T324 WeakPolarHBondContact O-CB 3.24Å; A320-T324 WeakPolarHBondContact O-CG2 3.48Å; A320-T324 PolarHBondContact O-N 2.94Å; A320-T324 PolarHBondContact O-OG1 3.13Å
321T89.8Confident91.1Very high15 Ų1554.7 Ų54.79%0.09226%0.263CS..Hα-helixtrans-56.4-51.2171.7-590000110.8T309 H313 Y317 E318 T324 G325T309-T321 HydrophobicContact CG2-CG2 3.61Å; T309-T321 WeakPolarHBondContact CG2-O 3.41Å; H313-T321 WeakPolarHBondContact CA-OG1 3.16Å; H313-T321 HydrophobicContact CB-CG2 3.99Å; H313-T321 PolarHBondContact N-OG1 3.23Å; H313-T321 VanDerWaalsContact N-OG1 3.09Å; Y317-T321 PolarHBondContact O-N 3.04Å; Y317-T321 PolarHBondContact O-OG1 3.49Å; E318-T321 WeakPolarHBondContact O-CB 3.5Å; E318-T321 PolarHBondContact O-N 3.47Å; T321-T324 PolarHBondContact O-OG1 2.8Å; T321-T324 VanDerWaalsContact O-OG1 3.11Å; T321-G325 PolarHBondContact O-N 3.18Å
322Y90.2Very high91.2Very high142 Ų14254.4 Ų54.456%0.55726%0.261SS*.Hα-helixtrans-67.4-42.4179.8-66.8-68.7000112.8M142 E318 T324 G325 V326M142-Y322 HydrophobicContact CE-CD1 4.29Å; E318-Y322 WeakPolarHBondContact O-CD2 3.28Å; E318-Y322 PolarHBondContact O-N 3.35Å; Y322-T324 PolarHBondContact O-N 3.43Å; Y322-G325 PolarHBondContact O-N 3.22Å; Y322-V326 WeakPolarHBondContact O-CG2 3.23Å; Y322-V326 PolarHBondContact O-N 3.49Å
323I92.7Very high91.2Very high74 Ų7455.1 Ų55.138%0.37927%0.266SS..Hα-helixtrans-61.6-47.1178.8-69.4177.7000110.9V205 W319 A320 V326 G327V205-I323 HydrophobicContact CG1-CG2 3.97Å; V205-I323 WeakPolarHBondContact CG1-O 3.33Å; V205-I323 HydrophobicContact CG2-CG2 4.14Å; W319-I323 HydrophobicContact CE3-CD1 3.7Å; W319-I323 HydrophobicContact CZ3-CD1 4.03Å; W319-I323 VanDerWaalsContact O-CG1 3.31Å; W319-I323 WeakPolarHBondContact O-CG1 3.24Å; W319-I323 PolarHBondContact O-N 3.48Å; W319-I323 VanDerWaalsContact O-N 3.17Å; A320-I323 PolarHBondContact O-N 3.02Å; I323-V326 PolarHBondContact O-N 3.45Å; I323-G327 PolarHBondContact O-N 3.43Å
324T91.9Very high91.4Very high7 Ų750.2 Ų50.24%0.04324%0.243CC..Hα-helixtrans-68.5-34.8178.453.20000112.8V205 A209 T309 F312 A320 T321 Y322 G327 S328V205-T324 HydrophobicContact CG1-CG2 4.47Å; A209-T324 HydrophobicContact CB-CG2 3.69Å; T309-T324 WeakPolarHBondContact CA-OG1 3.34Å; T309-T324 PolarHBondContact OG1-OG1 3.09Å; F312-T324 HydrophobicContact CD2-CG2 3.71Å; F312-T324 HydrophobicContact CE2-CG2 3.6Å; A320-T324 WeakPolarHBondContact O-CB 3.24Å; A320-T324 WeakPolarHBondContact O-CG2 3.48Å; A320-T324 PolarHBondContact O-N 2.94Å; A320-T324 PolarHBondContact O-OG1 3.13Å; T321-T324 PolarHBondContact O-OG1 2.8Å; T321-T324 VanDerWaalsContact O-OG1 3.11Å; Y322-T324 PolarHBondContact O-N 3.43Å; T324-G327 PolarHBondContact O-N 3.2Å; T324-S328 WeakPolarHBondContact O-CB 3.37Å; T324-S328 PolarHBondContact O-N 3.28Å; T324-S328 PolarHBondContact O-OG 3.5Å
325G92Very high91.6Very high0 Ų045.6 Ų45.60%022%0.215CC..Hα-helixtrans-58.8-52.5171.600000111.6T309 T321 Y322 G327 S328 L329T309-G325 WeakPolarHBondContact OG1-CA 3.47Å; T309-G325 PolarHBondContact OG1-N 2.99Å; T321-G325 PolarHBondContact O-N 3.18Å; Y322-G325 PolarHBondContact O-N 3.22Å; G325-G327 VanDerWaalsContact C-N 3.33Å; G325-G327 PolarHBondContact O-N 2.91Å; G325-S328 WeakPolarHBondContact O-CB 3.48Å; G325-S328 PolarHBondContact O-N 3.39Å; G325-S328 VanDerWaalsContact O-N 3.15Å; G325-L329 WeakPolarHBondContact O-CG 3.27Å; G325-L329 PolarHBondContact O-N 3.45Å
326V92.6Very high91.7Very high77 Ų7742.4 Ų42.447%0.46720%0.203SC..Hα-helixtrans-59.8-42.4175.21740000111.5Y322 I323 S328 L329 L330Y322-V326 WeakPolarHBondContact O-CG2 3.23Å; Y322-V326 PolarHBondContact O-N 3.49Å; I323-V326 PolarHBondContact O-N 3.45Å; V326-S328 VanDerWaalsContact C-N 3.31Å; V326-S328 PolarHBondContact O-N 3.08Å; V326-L329 PolarHBondContact O-N 3.35Å; V326-L330 HydrophobicContact CG1-CD1 4.12Å; V326-L330 HydrophobicContact CG1-CG 4.36Å; V326-L330 WeakPolarHBondContact O-CG 3.37Å; V326-L330 PolarHBondContact O-N 3.49Å
327G92.9Very high91.8Very high0 Ų036.3 Ų36.30%017%0.17CC..Hα-helixtrans-59.1-41.1175.200000113.1N202 I323 T324 G325 L330 G331N202-G327 PolarHBondContact OD1-O 3.04Å; I323-G327 PolarHBondContact O-N 3.43Å; T324-G327 PolarHBondContact O-N 3.2Å; G325-G327 VanDerWaalsContact C-N 3.33Å; G325-G327 PolarHBondContact O-N 2.91Å; G327-L330 PolarHBondContact O-N 3.06Å; G327-G331 PolarHBondContact O-N 3.08Å
328S92.7Very high91.9Very high5 Ų533.6 Ų33.64%0.03516%0.159CC..Hα-helixtrans-63.8-45.5176.6-55.40000110.8Y54 T324 G325 V326 L330 G331 L332Y54-S328 WeakPolarHBondContact CD1-OG 3.47Å; Y54-S328 WeakPolarHBondContact CE1-OG 3.39Å; T324-S328 WeakPolarHBondContact O-CB 3.37Å; T324-S328 PolarHBondContact O-N 3.28Å; T324-S328 PolarHBondContact O-OG 3.5Å; G325-S328 WeakPolarHBondContact O-CB 3.48Å; G325-S328 PolarHBondContact O-N 3.39Å; G325-S328 VanDerWaalsContact O-N 3.15Å; V326-S328 VanDerWaalsContact C-N 3.31Å; V326-S328 PolarHBondContact O-N 3.08Å; S328-L330 PolarHBondContact O-N 3.2Å; S328-G331 PolarHBondContact O-N 3.46Å; S328-L332 WeakPolarHBondContact O-CB 3.41Å; S328-L332 WeakPolarHBondContact O-CD1 3.32Å; S328-L332 VanDerWaalsContact O-CG 3.25Å; S328-L332 WeakPolarHBondContact O-CG 3.3Å; S328-L332 PolarHBondContact O-N 3.32Å
329L93.4Very high92.1Very high30 Ų3027 Ų2716%0.15713%0.129CC..Hα-helixtrans-61.5-42.7175.2-62.9177.3000112.1W135 T138 V139 M142 G325 V326 S333W135-L329 HydrophobicContact CD2-CD2 3.88Å; W135-L329 HydrophobicContact CE3-CD2 4.49Å; W135-L329 HydrophobicContact CG-CD2 4.1Å; W135-L329 HydrophobicContact CZ2-CD2 4.19Å; W135-L329 PolarHBondContact NE1-O 2.92Å; T138-L329 HydrophobicContact CG2-CD2 3.73Å; T138-L329 HydrophobicContact CG2-CG 4.12Å; V139-L329 HydrophobicContact CG2-CD1 4.1Å; V139-L329 HydrophobicContact CG2-CD2 3.52Å; V139-L329 HydrophobicContact CG2-CG 4.47Å; M142-L329 HydrophobicContact SD-CD1 4.06Å; G325-L329 WeakPolarHBondContact O-CG 3.27Å; G325-L329 PolarHBondContact O-N 3.45Å; V326-L329 PolarHBondContact O-N 3.35Å; L329-S333 VanDerWaalsContact O-CB 3.31Å; L329-S333 WeakPolarHBondContact O-CB 3.37Å; L329-S333 PolarHBondContact O-N 3.28Å; L329-S333 PolarHBondContact O-OG 3.4Å
330L94Very high92.2Very high44 Ų4420.6 Ų20.623%0.2310%0.104CC..Hα-helixtrans-62.3-47.2175-69.9173.4000110.8I198 L201 N202 V326 G327 S328 L332 S333 A334I198-L330 HydrophobicContact CG2-CB 3.94Å; I198-L330 HydrophobicContact CG2-CD2 4.08Å; I198-L330 WeakPolarHBondContact CG2-O 3.24Å; L201-L330 HydrophobicContact CB-CD1 3.84Å; L201-L330 HydrophobicContact CD1-CD1 4.36Å; N202-L330 HydrophobicContact CB-CB 4.33Å; V326-L330 HydrophobicContact CG1-CD1 4.12Å; V326-L330 HydrophobicContact CG1-CG 4.36Å; V326-L330 WeakPolarHBondContact O-CG 3.37Å; V326-L330 PolarHBondContact O-N 3.49Å; G327-L330 PolarHBondContact O-N 3.06Å; S328-L330 PolarHBondContact O-N 3.2Å; L330-L332 PolarHBondContact O-N 3.47Å; L330-S333 WeakPolarHBondContact O-CB 3.23Å; L330-S333 PolarHBondContact O-N 2.81Å; L330-A334 PolarHBondContact O-N 3.44Å
331G93.7Very high92Very high0 Ų020.9 Ų20.90%011%0.105CC..Hα-helixtrans-60.6-47.8179.100000113.2G50 N202 G327 S328 S333 A334 S335G50-G331 VanDerWaalsContact CA-C 3.48Å; G50-G331 VanDerWaalsContact CA-O 3.28Å; G50-G331 WeakPolarHBondContact CA-O 3.37Å; N202-G331 WeakPolarHBondContact ND2-CA 3.49Å; G327-G331 PolarHBondContact O-N 3.08Å; S328-G331 PolarHBondContact O-N 3.46Å; G331-S333 VanDerWaalsContact C-N 3.28Å; G331-S333 PolarHBondContact O-N 3.27Å; G331-A334 PolarHBondContact O-N 3.25Å; G331-S335 PolarHBondContact O-N 3.45Å; G331-S335 VanDerWaalsContact O-N 3.11Å
332L93.4Very high92Very high0 Ų020.2 Ų20.20%010%0.1CC..Hα-helixtrans-63-36.2175.7-67.6165.6000111.4G50 Y54 V55 V131 W135 T138 S328 L330 S335 L336G50-L332 WeakPolarHBondContact O-CD2 3.35Å; Y54-L332 HydrophobicContact CD2-CG 4.45Å; V55-L332 HydrophobicContact CG2-CD2 3.63Å; V131-L332 HydrophobicContact CG1-CB 4.06Å; V131-L332 HydrophobicContact CG1-CD2 3.8Å; V131-L332 WeakPolarHBondContact CG1-O 3.43Å; W135-L332 HydrophobicContact CB-CB 4.17Å; W135-L332 HydrophobicContact CB-CD1 4.36Å; W135-L332 HydrophobicContact CG-CB 4.37Å; T138-L332 WeakPolarHBondContact OG1-CD1 3.31Å; S328-L332 WeakPolarHBondContact O-CB 3.41Å; S328-L332 WeakPolarHBondContact O-CD1 3.32Å; S328-L332 VanDerWaalsContact O-CG 3.25Å; S328-L332 WeakPolarHBondContact O-CG 3.3Å; S328-L332 PolarHBondContact O-N 3.32Å; L330-L332 PolarHBondContact O-N 3.47Å; L332-S335 PolarHBondContact O-N 3.43Å; L332-L336 WeakPolarHBondContact O-CG 3.39Å; L332-L336 PolarHBondContact O-N 3.06Å
333S92.5Very high92.1Very high16 Ų1613.5 Ų13.511%0.1127%0.074CC..Hα-helixtrans-65.7-41.5174.6-54.70000112.5W135 L329 L330 G331 S335 L336 F337W135-S333 PolarHBondContact NE1-OG 2.76Å; L329-S333 VanDerWaalsContact O-CB 3.31Å; L329-S333 WeakPolarHBondContact O-CB 3.37Å; L329-S333 PolarHBondContact O-N 3.28Å; L329-S333 PolarHBondContact O-OG 3.4Å; L330-S333 WeakPolarHBondContact O-CB 3.23Å; L330-S333 PolarHBondContact O-N 2.81Å; G331-S333 VanDerWaalsContact C-N 3.28Å; G331-S333 PolarHBondContact O-N 3.27Å; S333-S335 VanDerWaalsContact C-N 3.3Å; S333-S335 PolarHBondContact O-N 2.84Å; S333-L336 PolarHBondContact O-N 2.78Å; S333-F337 WeakPolarHBondContact O-CB 3.13Å; S333-F337 WeakPolarHBondContact O-CD2 3.42Å; S333-F337 PolarHBondContact O-N 3.31Å
334A92.8Very high92.1Very high0 Ų010 Ų100%06%0.057CC..Hα-helixtrans-61.7-40.7176.200000111.8N195 I198 L330 G331 F337 T338N195-A334 PolarHBondContact OD1-O 2.98Å; I198-A334 HydrophobicContact CG2-CB 3.86Å; L330-A334 PolarHBondContact O-N 3.44Å; G331-A334 PolarHBondContact O-N 3.25Å; A334-F337 PolarHBondContact O-N 3.42Å; A334-T338 WeakPolarHBondContact O-CB 3.45Å; A334-T338 PolarHBondContact O-N 3.38Å; A334-T338 PolarHBondContact O-OG1 3.01Å
335S92.8Very high91.9Very high0 Ų010.2 Ų10.20%06%0.056CC..Hα-helixtrans-65.7-45.5176.5-1780000112G46 N47 G331 L332 S333 F337 T338 S339G46-S335 PolarHBondContact O-N 2.88Å; N47-S335 WeakPolarHBondContact O-CB 3.35Å; N47-S335 PolarHBondContact O-OG 2.99Å; N47-S335 PolarHBondContact OD1-O 3.31Å; G331-S335 PolarHBondContact O-N 3.45Å; G331-S335 VanDerWaalsContact O-N 3.11Å; L332-S335 PolarHBondContact O-N 3.43Å; S333-S335 VanDerWaalsContact C-N 3.3Å; S333-S335 PolarHBondContact O-N 2.84Å; S335-F337 PolarHBondContact O-N 3.5Å; S335-T338 PolarHBondContact O-N 3.1Å; S335-S339 PolarHBondContact O-N 3.01Å; S335-S339 PolarHBondContact O-OG 3.48Å
336L92.3Very high92Very high0 Ų010.2 Ų10.20%06%0.056CC..Hα-helixtrans-56.1-50172.2-77.8166.7000112.6V128 V131 A132 L176 L180 L332 S333 T338 S339 M340V128-L336 HydrophobicContact CB-CD2 4.43Å; V128-L336 HydrophobicContact CG1-CD2 3.96Å; V128-L336 WeakPolarHBondContact O-CD2 3.4Å; V131-L336 HydrophobicContact CB-CD2 3.92Å; V131-L336 HydrophobicContact CB-CG 3.98Å; V131-L336 HydrophobicContact CG1-CD1 4.29Å; V131-L336 HydrophobicContact CG1-CD2 4.16Å; V131-L336 HydrophobicContact CG1-CG 3.64Å; A132-L336 HydrophobicContact CB-CD1 4.39Å; A132-L336 HydrophobicContact CB-CD2 3.95Å; L176-L336 HydrophobicContact CD2-CD1 3.43Å; L176-L336 VanDerWaalsContact CD2-CD1 3.43Å; L176-L336 HydrophobicContact CG-CD1 4.14Å; L180-L336 HydrophobicContact CD1-CB 3.69Å; L180-L336 HydrophobicContact CD1-CD1 4.06Å; L180-L336 HydrophobicContact CD1-CG 4.49Å; L332-L336 WeakPolarHBondContact O-CG 3.39Å; L332-L336 PolarHBondContact O-N 3.06Å; S333-L336 PolarHBondContact O-N 2.78Å; L336-T338 VanDerWaalsContact C-N 3.29Å; L336-T338 PolarHBondContact O-N 3.44Å; L336-S339 PolarHBondContact O-N 3.24Å; L336-M340 WeakPolarHBondContact O-CB 3.3Å; L336-M340 VanDerWaalsContact O-CG 3.28Å; L336-M340 WeakPolarHBondContact O-CG 3.31Å; L336-M340 PolarHBondContact O-N 2.85Å
337F89.6Confident92Very high12 Ų126.5 Ų6.55%0.0533%0.034CC..Hα-helixtrans-56.9-44.9178.7-97.6-66.2000111.6L180 V183 L184 I198 S333 A334 S335 Y341L180-F337 HydrophobicContact CB-CE1 4.32Å; L180-F337 HydrophobicContact CB-CZ 4.32Å; L180-F337 HydrophobicContact CD1-CD2 4.1Å; L180-F337 HydrophobicContact CD1-CE2 4.17Å; L180-F337 HydrophobicContact CD2-CD2 4.25Å; L180-F337 HydrophobicContact CD2-CE1 4.39Å; L180-F337 HydrophobicContact CD2-CE2 3.48Å; L180-F337 VanDerWaalsContact CD2-CE2 3.48Å; L180-F337 HydrophobicContact CD2-CZ 3.58Å; L180-F337 HydrophobicContact CG-CE2 4.28Å; L180-F337 HydrophobicContact CG-CZ 4.36Å; V183-F337 HydrophobicContact CB-CE1 4.03Å; V183-F337 HydrophobicContact CB-CZ 4.07Å; V183-F337 HydrophobicContact CG1-CE1 3.81Å; V183-F337 HydrophobicContact CG1-CZ 3.82Å; L184-F337 HydrophobicContact CD2-CD1 3.88Å; L184-F337 HydrophobicContact CD2-CE1 4.26Å; L184-F337 HydrophobicContact CG-CD1 4.07Å; L184-F337 HydrophobicContact CG-CE1 4.19Å; I198-F337 HydrophobicContact CD1-CD2 4.18Å; I198-F337 HydrophobicContact CD1-CE2 4.06Å; S333-F337 WeakPolarHBondContact O-CB 3.13Å; S333-F337 WeakPolarHBondContact O-CD2 3.42Å; S333-F337 PolarHBondContact O-N 3.31Å; A334-F337 PolarHBondContact O-N 3.42Å; S335-F337 PolarHBondContact O-N 3.5Å; F337-Y341 WeakPolarHBondContact O-CB 3.44Å; F337-Y341 PolarHBondContact O-N 3.08Å
338T90.5Very high91.9Very high1 Ų18.5 Ų8.51%0.0064%0.042CC..Hα-helixtrans-69.8-42.8-176.8-56.20000112L43 N47 N195 A256 A334 S335 L336 Y341 A342L43-T338 HydrophobicContact CD1-CG2 3.8Å; L43-T338 HydrophobicContact CG-CG2 3.75Å; N47-T338 HydrophobicContact CB-CG2 3.63Å; N195-T338 PolarHBondContact OD1-OG1 2.64Å; A256-T338 HydrophobicContact CB-CG2 3.92Å; A334-T338 WeakPolarHBondContact O-CB 3.45Å; A334-T338 PolarHBondContact O-N 3.38Å; A334-T338 PolarHBondContact O-OG1 3.01Å; S335-T338 PolarHBondContact O-N 3.1Å; L336-T338 VanDerWaalsContact C-N 3.29Å; L336-T338 PolarHBondContact O-N 3.44Å; T338-Y341 WeakPolarHBondContact O-CB 3.43Å; T338-Y341 PolarHBondContact O-N 3.26Å; T338-A342 PolarHBondContact O-N 3.18Å
339S92.4Very high91.7Very high1 Ų18.5 Ų8.51%0.0074%0.042CC..Hα-helixtrans-65.8-42.1176-69.20000112.3N47 S127 S335 L336 Y341 A342 M343N47-S339 PolarHBondContact OD1-OG 3.16Å; S127-S339 PolarHBondContact OG-OG 2.7Å; S335-S339 PolarHBondContact O-N 3.01Å; S335-S339 PolarHBondContact O-OG 3.48Å; L336-S339 PolarHBondContact O-N 3.24Å; S339-Y341 PolarHBondContact O-N 3.27Å; S339-A342 PolarHBondContact O-N 2.87Å; S339-M343 WeakPolarHBondContact O-CB 3.48Å; S339-M343 PolarHBondContact O-N 3.25Å
340M91.5Very high91.7Very high4 Ų47 Ų72%0.023%0.034CC..Hα-helixtrans-67.6-25.2174.4-69.4-172.875.100112.9V128 I177 L180 L184 L336 P344 L374V128-M340 HydrophobicContact CB-CG 4.33Å; V128-M340 HydrophobicContact CG1-CG 3.8Å; V128-M340 HydrophobicContact CG1-SD 4.18Å; V128-M340 HydrophobicContact CG2-CB 4.39Å; V128-M340 HydrophobicContact CG2-CG 3.46Å; V128-M340 VanDerWaalsContact CG2-CG 3.46Å; I177-M340 HydrophobicContact CG2-CE 3.88Å; I177-M340 HydrophobicContact CG2-SD 4.12Å; I177-M340 WeakPolarHBondContact O-CE 3.42Å; L180-M340 HydrophobicContact CB-SD 4.08Å; L184-M340 HydrophobicContact CD1-CB 3.34Å; L184-M340 HydrophobicContact CD1-CE 4.42Å; L184-M340 HydrophobicContact CD1-CG 4.49Å; L336-M340 WeakPolarHBondContact O-CB 3.3Å; L336-M340 VanDerWaalsContact O-CG 3.28Å; L336-M340 WeakPolarHBondContact O-CG 3.31Å; L336-M340 PolarHBondContact O-N 2.85Å; M340-P344 WeakPolarHBondContact O-CD 3.43Å; M340-P344 WeakPolarHBondContact O-CG 3.4Å; M340-L374 HydrophobicContact CE-CD1 4.03Å
341Y88.2Confident91.6Very high11 Ų115.2 Ų5.24%0.0433%0.026CC..Hα-helixtrans-74.3-41.9173.5-180-90.4000112.5L184 P188 S260 E263 F337 T338 S339 R345L184-Y341 HydrophobicContact CD2-CD2 4.28Å; P188-Y341 HydrophobicContact CB-CE2 4.02Å; S260-Y341 WeakPolarHBondContact OG-CE1 3.41Å; E263-Y341 PolarHBondContact OE2-OH 3.25Å; F337-Y341 WeakPolarHBondContact O-CB 3.44Å; F337-Y341 PolarHBondContact O-N 3.08Å; T338-Y341 WeakPolarHBondContact O-CB 3.43Å; T338-Y341 PolarHBondContact O-N 3.26Å; S339-Y341 PolarHBondContact O-N 3.27Å; Y341-R345 VanDerWaalsContact CD2-NH1 3.27Å; Y341-R345 VanDerWaalsContact CE1-NH1 3.33Å; Y341-R345 VanDerWaalsContact CE2-CZ 3.48Å; Y341-R345 VanDerWaalsContact CE2-NH2 3.27Å; Y341-R345 VanDerWaalsContact CZ-NH1 3.26Å; Y341-R345 PolarHBondContact O-NH1 3.37Å; Y341-R345 PolarHBondContact OH-NH2 3.24Å
342A90.4Very high91.2Very high0 Ų07.2 Ų7.20%04%0.04CC..Hα-helixtrans-74.6-42.2-176.800000112.6Y124 A256 V259 T338 S339 R345 V346Y124-A342 HydrophobicContact CD1-CB 4.11Å; Y124-A342 HydrophobicContact CE1-CB 3.6Å; Y124-A342 HydrophobicContact CE2-CB 4.06Å; A256-A342 HydrophobicContact CB-CB 4.09Å; V259-A342 HydrophobicContact CB-CB 4.41Å; V259-A342 HydrophobicContact CG1-CB 4.33Å; V259-A342 HydrophobicContact CG2-CB 4.29Å; T338-A342 PolarHBondContact O-N 3.18Å; S339-A342 PolarHBondContact O-N 2.87Å; A342-R345 WeakPolarHBondContact O-CB 3.25Å; A342-R345 PolarHBondContact O-N 3.15Å; A342-R345 VanDerWaalsContact O-N 3.14Å; A342-V346 PolarHBondContact O-N 3.39Å
343M92.1Very high90.9Very high1 Ų17.5 Ų7.51%0.0054%0.041CC..Hα-helixtrans-47.8-58.4-177.6-178.7-163.1-64.500115Y124 V125 V128 S339 R345 V346 V347 F377Y124-M343 VanDerWaalsContact C-CE 3.48Å; Y124-M343 HydrophobicContact CD2-CB 4.37Å; Y124-M343 HydrophobicContact CG-CB 4.14Å; Y124-M343 WeakPolarHBondContact O-CE 3.42Å; V125-M343 HydrophobicContact CB-CE 4.25Å; V125-M343 HydrophobicContact CG2-CE 3.65Å; V125-M343 HydrophobicContact CG2-SD 3.97Å; V128-M343 HydrophobicContact CB-CE 4.44Å; V128-M343 HydrophobicContact CG2-CE 3.86Å; S339-M343 WeakPolarHBondContact O-CB 3.48Å; S339-M343 PolarHBondContact O-N 3.25Å; M343-R345 PolarHBondContact O-N 2.9Å; M343-V346 PolarHBondContact O-N 3.06Å; M343-V347 PolarHBondContact O-N 2.94Å; M343-F377 HydrophobicContact CG-CB 4.28Å; M343-F377 HydrophobicContact SD-CB 3.3Å; M343-F377 WeakPolarHBondContact SD-CB 3.43Å; M343-F377 HydrophobicContact SD-CG 4.36Å
344P91.8Very high90.7Very high2 Ų27.2 Ų7.21%0.0134%0.04CC..Hα-helixtrans-65.4-23.6-175.726.7-36.3000112.8M340 Y348 P370 A373 L374M340-P344 WeakPolarHBondContact O-CD 3.43Å; M340-P344 WeakPolarHBondContact O-CG 3.4Å; P344-Y348 VanDerWaalsContact O-CB 3.29Å; P344-Y348 WeakPolarHBondContact O-CB 2.98Å; P344-Y348 PolarHBondContact O-N 3.41Å; P344-P370 HydrophobicContact CB-CB 4.02Å; P344-P370 HydrophobicContact CB-CG 4.04Å; P344-A373 HydrophobicContact CB-CB 4.06Å; P344-L374 HydrophobicContact CB-CB 4.14Å; P344-L374 HydrophobicContact CG-CB 4.36Å; P344-L374 HydrophobicContact CG-CD1 4.45Å
345R89.4Confident90.5Very high10 Ų107.2 Ų7.24%0.0384%0.04CC..Hα-helixtrans-73.9-36.1177.7-72.9177.3171.372.44112.8V259 E263 Y341 A342 M343 Y348 A349V259-R345 HydrophobicContact CG1-CB 3.59Å; V259-R345 HydrophobicContact CG1-CG 4.42Å; E263-R345 IonicContact OE1-CZ 2.93Å; E263-R345 IonicContact OE1-NE 2.73Å; E263-R345 PolarHBondContact OE1-NE 3.49Å; E263-R345 VanDerWaalsContact OE1-NE 3.12Å; E263-R345 IonicContact OE1-NH2 2.87Å; E263-R345 PolarHBondContact OE1-NH2 3.29Å; E263-R345 IonicContact OE2-NE 2.76Å; E263-R345 IonicContact OE2-NH2 3.93Å; Y341-R345 VanDerWaalsContact CD2-NH1 3.27Å; Y341-R345 VanDerWaalsContact CE1-NH1 3.33Å; Y341-R345 VanDerWaalsContact CE2-CZ 3.48Å; Y341-R345 VanDerWaalsContact CE2-NH2 3.27Å; Y341-R345 VanDerWaalsContact CZ-NH1 3.26Å; Y341-R345 PolarHBondContact O-NH1 3.37Å; Y341-R345 PolarHBondContact OH-NH2 3.24Å; A342-R345 WeakPolarHBondContact O-CB 3.25Å; A342-R345 PolarHBondContact O-N 3.15Å; A342-R345 VanDerWaalsContact O-N 3.14Å; M343-R345 PolarHBondContact O-N 2.9Å; R345-Y348 PolarHBondContact O-N 3.14Å; R345-A349 WeakPolarHBondContact O-CB 3.43Å; R345-A349 PolarHBondContact O-N 2.84Å
346V92.1Very high90.5Very high0 Ų07.3 Ų7.30%04%0.041CC..Hα-helixtrans-64.4-45.4172178.10000110M120 I121 Y124 V259 A342 M343 Y348 A349 M350M120-V346 HydrophobicContact CB-CG1 4.15Å; M120-V346 HydrophobicContact CE-CG2 3.94Å; M120-V346 HydrophobicContact SD-CG1 4.39Å; I121-V346 HydrophobicContact CG1-CG1 4.28Å; Y124-V346 HydrophobicContact CD2-CG2 4.43Å; Y124-V346 HydrophobicContact CE2-CG2 3.87Å; V259-V346 HydrophobicContact CG1-CG2 4.45Å; V259-V346 HydrophobicContact CG2-CG2 4.21Å; A342-V346 PolarHBondContact O-N 3.39Å; M343-V346 PolarHBondContact O-N 3.06Å; V346-Y348 VanDerWaalsContact C-N 3.34Å; V346-Y348 PolarHBondContact O-N 3.43Å; V346-A349 PolarHBondContact O-N 3.06Å; V346-M350 HydrophobicContact CG1-SD 4.27Å; V346-M350 WeakPolarHBondContact O-CG 3.17Å; V346-M350 PolarHBondContact O-N 3.05Å
347V94Very high90.4Very high0 Ų08.7 Ų8.70%05%0.05CC..Hα-helixtrans-60.1-45.3175.7-179.60000111I121 M343 M350 A351 L356 L360 A373 F377I121-V347 HydrophobicContact CD1-CG2 3.77Å; I121-V347 HydrophobicContact CG1-CG2 3.76Å; I121-V347 HydrophobicContact CG2-CG2 4.43Å; M343-V347 PolarHBondContact O-N 2.94Å; V347-M350 PolarHBondContact O-N 2.96Å; V347-A351 VanDerWaalsContact O-CB 3.31Å; V347-A351 WeakPolarHBondContact O-CB 3.49Å; V347-A351 PolarHBondContact O-N 3.29Å; V347-L356 HydrophobicContact CG1-CD1 4.06Å; V347-L360 HydrophobicContact CG1-CB 3.86Å; V347-A373 HydrophobicContact CB-CB 3.77Å; V347-A373 HydrophobicContact CG1-CB 3.59Å; V347-A373 HydrophobicContact CG2-CB 4.23Å; V347-F377 HydrophobicContact CB-CE2 4.45Å; V347-F377 HydrophobicContact CG1-CE2 4.02Å; V347-F377 HydrophobicContact CG2-CD2 3.78Å; V347-F377 HydrophobicContact CG2-CE2 3.55Å; V347-F377 HydrophobicContact CG2-CZ 4.42Å
348Y90.5Very high90.3Very high42 Ų4215.6 Ų15.617%0.1658%0.083CC..Hα-helixtrans-58.1-47.7175.3169.2-100.4000111.8P344 R345 V346 M350 A351 S352 G361 L363 P370P344-Y348 VanDerWaalsContact O-CB 3.29Å; P344-Y348 WeakPolarHBondContact O-CB 2.98Å; P344-Y348 PolarHBondContact O-N 3.41Å; R345-Y348 PolarHBondContact O-N 3.14Å; V346-Y348 VanDerWaalsContact C-N 3.34Å; V346-Y348 PolarHBondContact O-N 3.43Å; Y348-M350 VanDerWaalsContact C-N 3.33Å; Y348-M350 PolarHBondContact O-N 2.78Å; Y348-A351 PolarHBondContact O-N 2.9Å; Y348-S352 VanDerWaalsContact O-CB 3.23Å; Y348-S352 WeakPolarHBondContact O-CB 3.21Å; Y348-S352 PolarHBondContact O-N 2.84Å; Y348-S352 PolarHBondContact O-OG 3.49Å; Y348-G361 WeakPolarHBondContact CD2-O 3.48Å; Y348-L363 HydrophobicContact CD2-CD1 4.33Å; Y348-L363 HydrophobicContact CD2-CD2 3.75Å; Y348-L363 HydrophobicContact CD2-CG 3.95Å; Y348-L363 HydrophobicContact CE2-CD1 3.54Å; Y348-L363 HydrophobicContact CE2-CD2 3.82Å; Y348-L363 HydrophobicContact CE2-CG 3.59Å; Y348-L363 HydrophobicContact CG-CD2 4.36Å; Y348-P370 HydrophobicContact CG-CG 4.3Å
349A89.3Confident90.4Very high4 Ų421.5 Ų21.53%0.03311%0.108CC..Hα-helixtrans-59-44.7177.900000111.6Y101 R345 V346 S352 D353Y101-A349 HydrophobicContact CD1-CB 4.08Å; Y101-A349 HydrophobicContact CE1-CB 4.09Å; R345-A349 WeakPolarHBondContact O-CB 3.43Å; R345-A349 PolarHBondContact O-N 2.84Å; V346-A349 PolarHBondContact O-N 3.06Å; A349-S352 WeakPolarHBondContact CA-OG 3.12Å; A349-S352 PolarHBondContact O-N 2.92Å; A349-S352 PolarHBondContact O-OG 3.17Å; A349-D353 PolarHBondContact O-N 3.42Å
350M92.4Very high90.3Very high0 Ų022 Ų220%011%0.111CC..Hα-helixtrans-67-41.3177.5-67.1178.974.600113.3Y101 F114 G117 I121 V346 V347 Y348 D353 G354 L355 L356Y101-M350 HydrophobicContact CD1-CG 4.06Å; Y101-M350 HydrophobicContact CD2-CG 3.76Å; Y101-M350 HydrophobicContact CD2-SD 4.46Å; Y101-M350 HydrophobicContact CE1-CG 3.99Å; Y101-M350 HydrophobicContact CE2-CG 3.7Å; Y101-M350 HydrophobicContact CG-CG 3.95Å; F114-M350 HydrophobicContact CD2-CE 3.7Å; F114-M350 HydrophobicContact CE2-CE 3.91Å; F114-M350 HydrophobicContact CG-CE 4.46Å; G117-M350 VanDerWaalsContact CA-SD 3.55Å; I121-M350 HydrophobicContact CD1-CE 4.5Å; I121-M350 HydrophobicContact CD1-SD 3.63Å; I121-M350 HydrophobicContact CG1-SD 4.38Å; V346-M350 HydrophobicContact CG1-SD 4.27Å; V346-M350 WeakPolarHBondContact O-CG 3.17Å; V346-M350 PolarHBondContact O-N 3.05Å; V347-M350 PolarHBondContact O-N 2.96Å; Y348-M350 VanDerWaalsContact C-N 3.33Å; Y348-M350 PolarHBondContact O-N 2.78Å; M350-D353 PolarHBondContact O-N 3.07Å; M350-G354 PolarHBondContact O-N 3.28Å; M350-L355 PolarHBondContact O-N 3.23Å; M350-L355 VanDerWaalsContact O-N 3.07Å; M350-L356 HydrophobicContact CB-CD1 3.77Å; M350-L356 HydrophobicContact CB-CG 4.03Å; M350-L356 HydrophobicContact CE-CD1 4.3Å; M350-L356 HydrophobicContact CE-CG 4.34Å; M350-L356 HydrophobicContact SD-CD1 4.19Å
351A91.9Very high90.1Very high6 Ų622.4 Ų22.45%0.0512%0.117CC..Hα-helixtrans-68.1-38.117700000111.4V347 Y348 D353 G354 L356 L360V347-A351 VanDerWaalsContact O-CB 3.31Å; V347-A351 WeakPolarHBondContact O-CB 3.49Å; V347-A351 PolarHBondContact O-N 3.29Å; Y348-A351 PolarHBondContact O-N 2.9Å; A351-D353 PolarHBondContact O-N 3.38Å; A351-G354 PolarHBondContact O-N 3.45Å; A351-L356 HydrophobicContact CB-CB 4.2Å; A351-L360 HydrophobicContact CB-CB 4.38Å
352S86.1Confident90.2Very high42 Ų4227.6 Ų27.629%0.29414%0.137SC..Hα-helixtrans-65.1-23.4176.174.90000113.2Y348 A349 I601Y348-S352 VanDerWaalsContact O-CB 3.23Å; Y348-S352 WeakPolarHBondContact O-CB 3.21Å; Y348-S352 PolarHBondContact O-N 2.84Å; Y348-S352 PolarHBondContact O-OG 3.49Å; A349-S352 WeakPolarHBondContact CA-OG 3.12Å; A349-S352 PolarHBondContact O-N 2.92Å; A349-S352 PolarHBondContact O-OG 3.17Å; S352-I601 WeakPolarHBondContact O-CD1 3.24Å
353D86.7Confident90Very high6 Ų629.1 Ų29.13%0.03215%0.145CC..THydrogen-bonded Turntrans-90.8-0.2173-70.5-38000112.4R20 Y101 Y105 A349 M350 A351 L355 S600 I601R20-D353 IonicContact CZ-OD1 3.13Å; R20-D353 IonicContact CZ-OD2 3.6Å; R20-D353 IonicContact NE-OD1 3.61Å; R20-D353 IonicContact NH1-OD1 3.69Å; R20-D353 PolarHBondContact NH1-OD1 3.42Å; R20-D353 IonicContact NH1-OD2 3.5Å; R20-D353 PolarHBondContact NH1-OD2 3.27Å; R20-D353 IonicContact NH2-OD1 3.83Å; Y101-D353 VanDerWaalsContact CE1-OD2 3.29Å; Y101-D353 WeakPolarHBondContact CE1-OD2 3.44Å; Y101-D353 VanDerWaalsContact OH-CB 3.24Å; Y101-D353 WeakPolarHBondContact OH-CB 3.28Å; Y101-D353 PolarHBondContact OH-OD2 2.91Å; Y105-D353 HydrophobicContact CE1-CB 4.12Å; A349-D353 PolarHBondContact O-N 3.42Å; M350-D353 PolarHBondContact O-N 3.07Å; A351-D353 PolarHBondContact O-N 3.38Å; D353-L355 HydrophobicContact CB-CG 4.49Å; D353-S600 WeakPolarHBondContact O-CA 3.46Å; D353-I601 PolarHBondContact O-N 3.3Å
354G87.2Confident89.6Confident9 Ų931.6 Ų31.69%0.09316%0.158CC..THydrogen-bonded Turntrans80.68.917900000115.1M350 A351 H599M350-G354 PolarHBondContact O-N 3.28Å; A351-G354 PolarHBondContact O-N 3.45Å; G354-H599 CarbonylContact O-C 3.57Å
355L89.3Confident89.1Confident0 Ų035.8 Ų35.80%019%0.185CC..SBendtrans-79.7-24.5-179.8-63.1-175000113.5Y101 Y105 E110 F114 M350 D353 Y592 G596Y101-L355 HydrophobicContact CE2-CD1 3.67Å; Y101-L355 VanDerWaalsContact OH-CD1 3.3Å; Y101-L355 WeakPolarHBondContact OH-CD1 3.46Å; Y105-L355 HydrophobicContact CD1-CD1 4.44Å; Y105-L355 HydrophobicContact CE1-CD1 3.94Å; E110-L355 HydrophobicContact CG-CD1 4.37Å; E110-L355 HydrophobicContact CG-CD2 3.68Å; F114-L355 HydrophobicContact CB-CD1 4.29Å; F114-L355 HydrophobicContact CD2-CB 4.12Å; F114-L355 HydrophobicContact CD2-CD1 4.32Å; M350-L355 PolarHBondContact O-N 3.23Å; M350-L355 VanDerWaalsContact O-N 3.07Å; D353-L355 HydrophobicContact CB-CG 4.49Å; L355-Y592 HydrophobicContact CD2-CD2 4.49Å; L355-Y592 HydrophobicContact CD2-CE2 4.06Å; L355-G596 WeakPolarHBondContact O-CA 3.29Å
356L92.9Very high88.7Confident2 Ų240 Ų401%0.0122%0.216CC..SBendtrans-117.3156.4171.3-66.7179.4000109.5F114 W118 I121 V347 M350 A351 E358 L360 I591 Y595F114-L356 HydrophobicContact CE2-CD2 4.16Å; W118-L356 HydrophobicContact CE3-CD2 4.36Å; W118-L356 HydrophobicContact CZ3-CD2 4.14Å; I121-L356 HydrophobicContact CD1-CD1 3.97Å; V347-L356 HydrophobicContact CG1-CD1 4.06Å; M350-L356 HydrophobicContact CB-CD1 3.77Å; M350-L356 HydrophobicContact CB-CG 4.03Å; M350-L356 HydrophobicContact CE-CD1 4.3Å; M350-L356 HydrophobicContact CE-CG 4.34Å; M350-L356 HydrophobicContact SD-CD1 4.19Å; A351-L356 HydrophobicContact CB-CB 4.2Å; L356-E358 PolarHBondContact O-N 2.92Å; L356-L360 HydrophobicContact CB-CD1 4.14Å; L356-L360 HydrophobicContact CD1-CD1 4.42Å; L356-I591 HydrophobicContact CD2-CG2 4.2Å; L356-Y595 WeakPolarHBondContact O-CE1 3.34Å
357P90.6Very high88.1Confident30 Ų3041.1 Ų41.120%0.19522%0.223CC..  trans-50135.1174.7-29.735.7000113F359 L360 Y595P357-F359 HydrophobicContact CB-CD1 3.5Å; P357-F359 HydrophobicContact CB-CE1 3.25Å; P357-F359 HydrophobicContact CB-CZ 4.1Å; P357-F359 HydrophobicContact CG-CE1 4.01Å; P357-F359 PolarHBondContact O-N 3.46Å; P357-F359 VanDerWaalsContact O-N 3.12Å; P357-L360 WeakPolarHBondContact O-CB 3.44Å; P357-L360 PolarHBondContact O-N 2.85Å; P357-Y595 HydrophobicContact CG-CD1 4.34Å; P357-Y595 HydrophobicContact CG-CE1 4.37Å; P357-Y595 HydrophobicContact CG-CG 4.5Å
358E87.7Confident87.5Confident157 Ų15744.8 Ų44.873%0.73424%0.24SC*.G310 helixtrans-57.6-32.9-171.5-169.7178.7175.300113.2L356 L360 G361L356-E358 PolarHBondContact O-N 2.92Å; E358-L360 PolarHBondContact O-N 3.47Å; E358-L360 VanDerWaalsContact O-N 3.13Å; E358-G361 WeakPolarHBondContact O-CA 3.23Å; E358-G361 PolarHBondContact O-N 3.43Å
359F91Very high87.2Confident124 Ų12443.1 Ų43.154%0.54423%0.234SC..G310 helixtrans-60.6-25.1178.475.1-99.4000113.5P357 G361 Y362 V372P357-F359 HydrophobicContact CB-CD1 3.5Å; P357-F359 HydrophobicContact CB-CE1 3.25Å; P357-F359 HydrophobicContact CB-CZ 4.1Å; P357-F359 HydrophobicContact CG-CE1 4.01Å; P357-F359 PolarHBondContact O-N 3.46Å; P357-F359 VanDerWaalsContact O-N 3.12Å; F359-G361 VanDerWaalsContact C-N 3.28Å; F359-Y362 WeakPolarHBondContact O-CB 3.36Å; F359-Y362 PolarHBondContact O-N 3.49Å; F359-V372 HydrophobicContact CD2-CG1 3.91Å; F359-V372 HydrophobicContact CE2-CG1 4.21Å
360L91.4Very high87.3Confident11 Ų1143 Ų436%0.05823%0.233CC..G310 helixtrans-72.3-24.4175.3-67.9174.2000112.2V347 A351 L356 P357 E358 Y362 V372 L376V347-L360 HydrophobicContact CG1-CB 3.86Å; A351-L360 HydrophobicContact CB-CB 4.38Å; L356-L360 HydrophobicContact CB-CD1 4.14Å; L356-L360 HydrophobicContact CD1-CD1 4.42Å; P357-L360 WeakPolarHBondContact O-CB 3.44Å; P357-L360 PolarHBondContact O-N 2.85Å; E358-L360 PolarHBondContact O-N 3.47Å; E358-L360 VanDerWaalsContact O-N 3.13Å; L360-Y362 VanDerWaalsContact C-N 3.33Å; L360-V372 HydrophobicContact CD2-CG1 4.32Å; L360-L376 HydrophobicContact CD2-CD2 3.73Å
361G88Confident87.2Confident14 Ų1444.1 Ų44.114%0.14424%0.24CC..G310 helixtrans-87.24.1175.300000114.1Y348 E358 F359 L363Y348-G361 WeakPolarHBondContact CD2-O 3.48Å; E358-G361 WeakPolarHBondContact O-CA 3.23Å; E358-G361 PolarHBondContact O-N 3.43Å; F359-G361 VanDerWaalsContact C-N 3.28Å; G361-L363 PolarHBondContact O-N 3.14Å
362Y88.8Confident87.3Confident120 Ų12046.2 Ų46.247%0.47125%0.252SS..PPolyproline II helixtrans-64.9118.1-178.1178.8-97.7000112F359 L360 P370 V371F359-Y362 WeakPolarHBondContact O-CB 3.36Å; F359-Y362 PolarHBondContact O-N 3.49Å; L360-Y362 VanDerWaalsContact C-N 3.33Å; Y362-P370 WeakPolarHBondContact O-CA 3.29Å; Y362-V371 HydrophobicContact CD1-CG2 3.81Å; Y362-V371 HydrophobicContact CE1-CG2 4.09Å
363L86.5Confident87.6Confident31 Ų3144.2 Ų44.216%0.16224%0.238CC..BIsolated β-bridgetrans-90.5130.2174.8-64.3176.7000110.5Y348 G361 P365 P370Y348-L363 HydrophobicContact CD2-CD1 4.33Å; Y348-L363 HydrophobicContact CD2-CD2 3.75Å; Y348-L363 HydrophobicContact CD2-CG 3.95Å; Y348-L363 HydrophobicContact CE2-CD1 3.54Å; Y348-L363 HydrophobicContact CE2-CD2 3.82Å; Y348-L363 HydrophobicContact CE2-CG 3.59Å; Y348-L363 HydrophobicContact CG-CD2 4.36Å; G361-L363 PolarHBondContact O-N 3.14Å; L363-P365 WeakPolarHBondContact O-CD 3.19Å; L363-P370 HydrophobicContact CD2-CB 4.22Å; L363-P370 HydrophobicContact CD2-CG 3.69Å
364L84.7Confident88Confident53 Ų5344.1 Ų44.128%0.27724%0.238SC..PPolyproline II helixtrans-67.8122.8172.4-172.567.3000109.7S366 T367 Q368 V369 V371L364-S366 WeakPolarHBondContact CD2-OG 3.35Å; L364-S366 PolarHBondContact O-N 3.42Å; L364-S366 VanDerWaalsContact O-N 3.11Å; L364-T367 HydrophobicContact CD2-CG2 4.36Å; L364-T367 PolarHBondContact O-N 3.33Å; L364-Q368 WeakPolarHBondContact O-CA 3.37Å; L364-Q368 PolarHBondContact O-N 2.83Å; L364-V369 PolarHBondContact N-O 3.48Å; L364-V371 HydrophobicContact CB-CG1 3.88Å; L364-V371 HydrophobicContact CB-CG2 4.08Å; L364-V371 HydrophobicContact CD2-CG1 4.13Å; L364-V371 HydrophobicContact CG-CG1 4.5Å
365P80.8Confident88.3Confident90 Ų9046 Ų4658%0.58425%0.25SC*.THydrogen-bonded Turntrans-57.6-34-173.2-28.635.8000114.4L363 Q368L363-P365 WeakPolarHBondContact O-CD 3.19Å; P365-Q368 PolarHBondContact O-NE2 3.41Å
366S81Confident88.6Confident98 Ų9850.3 Ų50.369%0.68527%0.272SS*.THydrogen-bonded Turntrans-75.2-34.9-177.6590000114L364L364-S366 WeakPolarHBondContact CD2-OG 3.35Å; L364-S366 PolarHBondContact O-N 3.42Å; L364-S366 VanDerWaalsContact O-N 3.11Å
367T78.7Confident88.8Confident25 Ų2551 Ų5115%0.15328%0.275CS..THydrogen-bonded Turntrans-118.5-11.7-170.964.20000113.9F185 P188 L364 V369F185-T367 WeakPolarHBondContact O-CB 3.39Å; F185-T367 WeakPolarHBondContact O-CG2 3.38Å; F185-T367 PolarHBondContact O-OG1 3.42Å; P188-T367 VanDerWaalsContact CD-O 3.29Å; P188-T367 WeakPolarHBondContact CD-O 3.37Å; L364-T367 HydrophobicContact CD2-CG2 4.36Å; L364-T367 PolarHBondContact O-N 3.33Å; T367-V369 PolarHBondContact O-N 3.06Å
368Q81.3Confident89.1Confident76 Ų7649.9 Ų49.936%0.35527%0.269SS..  trans57.130.7-176.4-56.3-64.6-41.100112.7L364 P365L364-Q368 WeakPolarHBondContact O-CA 3.37Å; L364-Q368 PolarHBondContact O-N 2.83Å; P365-Q368 PolarHBondContact O-NE2 3.41Å
369V85.7Confident89.5Confident7 Ų747.2 Ų47.24%0.04226%0.259CS..  trans-100.8135.7177.3179.20000109.6L364 T367 V371 L374L364-V369 PolarHBondContact N-O 3.48Å; T367-V369 PolarHBondContact O-N 3.06Å; V369-V371 VanDerWaalsContact C-N 3.3Å; V369-V371 PolarHBondContact O-N 3.13Å; V369-L374 HydrophobicContact CG1-CD2 4.14Å
370P89.8Confident89.7Confident3 Ų344.4 Ų44.42%0.01925%0.246CC..BIsolated β-bridgetrans-70.883172.6-10.524.7000111.2P344 Y348 Y362 L363 V372 A373 L374P344-P370 HydrophobicContact CB-CB 4.02Å; P344-P370 HydrophobicContact CB-CG 4.04Å; Y348-P370 HydrophobicContact CG-CG 4.3Å; Y362-P370 WeakPolarHBondContact O-CA 3.29Å; L363-P370 HydrophobicContact CD2-CB 4.22Å; L363-P370 HydrophobicContact CD2-CG 3.69Å; P370-V372 PolarHBondContact O-N 3.41Å; P370-A373 HydrophobicContact CB-CB 4.23Å; P370-A373 PolarHBondContact O-N 3.24Å; P370-L374 WeakPolarHBondContact O-CB 3.31Å; P370-L374 PolarHBondContact O-N 2.82Å
371V91.1Very high89.9Confident22 Ų2243.9 Ų43.913%0.13324%0.243CC..Hα-helixtrans-65.1-38.4-169.2-84.20000113.2F185 Y362 L364 V369 S375F185-V371 HydrophobicContact CD1-CG1 3.64Å; F185-V371 HydrophobicContact CE1-CB 4.11Å; F185-V371 HydrophobicContact CE1-CG1 3.7Å; Y362-V371 HydrophobicContact CD1-CG2 3.81Å; Y362-V371 HydrophobicContact CE1-CG2 4.09Å; L364-V371 HydrophobicContact CB-CG1 3.88Å; L364-V371 HydrophobicContact CB-CG2 4.08Å; L364-V371 HydrophobicContact CD2-CG1 4.13Å; L364-V371 HydrophobicContact CG-CG1 4.5Å; V369-V371 VanDerWaalsContact C-N 3.3Å; V369-V371 PolarHBondContact O-N 3.13Å; V371-S375 WeakPolarHBondContact O-CB 3.39Å; V371-S375 PolarHBondContact O-N 3.01Å; V371-S375 PolarHBondContact O-OG 3.38Å
372V93.4Very high90.3Very high51 Ų5143.7 Ų43.731%0.30924%0.241SC..Hα-helixtrans-70.6-44.5-178.1-173.50000110.8F359 L360 P370 S375 L376F359-V372 HydrophobicContact CD2-CG1 3.91Å; F359-V372 HydrophobicContact CE2-CG1 4.21Å; L360-V372 HydrophobicContact CD2-CG1 4.32Å; P370-V372 PolarHBondContact O-N 3.41Å; V372-S375 PolarHBondContact O-N 3.45Å; V372-L376 WeakPolarHBondContact O-CB 3.26Å; V372-L376 PolarHBondContact O-N 3.28Å
373A94Very high90.6Very high0 Ų041.9 Ų41.90%024%0.238CC..Hα-helixtrans-60.2-47.617500000111.7P344 V347 P370 S375 L376 F377P344-A373 HydrophobicContact CB-CB 4.06Å; V347-A373 HydrophobicContact CB-CB 3.77Å; V347-A373 HydrophobicContact CG1-CB 3.59Å; V347-A373 HydrophobicContact CG2-CB 4.23Å; P370-A373 HydrophobicContact CB-CB 4.23Å; P370-A373 PolarHBondContact O-N 3.24Å; A373-S375 VanDerWaalsContact C-N 3.32Å; A373-S375 PolarHBondContact O-N 3.46Å; A373-L376 PolarHBondContact O-N 3.23Å; A373-F377 WeakPolarHBondContact O-CD2 3.19Å; A373-F377 PolarHBondContact O-N 3.09Å
374L93.8Very high90.9Very high4 Ų441.3 Ų41.32%0.02124%0.235CC..Hα-helixtrans-61-41.4178.5179.556.7000111.7L184 F185 M340 P344 V369 P370 G378L184-L374 HydrophobicContact CB-CD2 3.85Å; L184-L374 HydrophobicContact CD1-CD1 4.31Å; L184-L374 HydrophobicContact CD1-CD2 4.49Å; F185-L374 HydrophobicContact CD1-CD2 3.73Å; F185-L374 HydrophobicContact CE1-CB 4.18Å; F185-L374 HydrophobicContact CE1-CD2 3.54Å; F185-L374 HydrophobicContact CE1-CG 3.98Å; F185-L374 HydrophobicContact CZ-CD2 4.35Å; F185-L374 HydrophobicContact CZ-CG 4.5Å; M340-L374 HydrophobicContact CE-CD1 4.03Å; P344-L374 HydrophobicContact CB-CB 4.14Å; P344-L374 HydrophobicContact CG-CB 4.36Å; P344-L374 HydrophobicContact CG-CD1 4.45Å; V369-L374 HydrophobicContact CG1-CD2 4.14Å; P370-L374 WeakPolarHBondContact O-CB 3.31Å; P370-L374 PolarHBondContact O-N 2.82Å; L374-G378 VanDerWaalsContact O-CA 3.26Å; L374-G378 WeakPolarHBondContact O-CA 3.49Å; L374-G378 PolarHBondContact O-N 3.45Å
375S94.6Very high91.4Very high49 Ų4938.8 Ų38.834%0.34322%0.222SC..Hα-helixtrans-67.9-50.4178.8-55.60000111.6F185 V371 V372 A373 I379F185-S375 WeakPolarHBondContact CZ-OG 3.3Å; V371-S375 WeakPolarHBondContact O-CB 3.39Å; V371-S375 PolarHBondContact O-N 3.01Å; V371-S375 PolarHBondContact O-OG 3.38Å; V372-S375 PolarHBondContact O-N 3.45Å; A373-S375 VanDerWaalsContact C-N 3.32Å; A373-S375 PolarHBondContact O-N 3.46Å; S375-I379 WeakPolarHBondContact O-CB 3.22Å; S375-I379 WeakPolarHBondContact O-CD1 3.49Å; S375-I379 WeakPolarHBondContact O-CG1 3.3Å; S375-I379 PolarHBondContact O-N 3.14Å
376L95.8Very high91.9Very high90 Ų9036.6 Ų36.647%0.47121%0.205SC..Hα-helixtrans-63.1-53.4-175.7-179.767.3000111.7L360 V372 A373 F380L360-L376 HydrophobicContact CD2-CD2 3.73Å; V372-L376 WeakPolarHBondContact O-CB 3.26Å; V372-L376 PolarHBondContact O-N 3.28Å; A373-L376 PolarHBondContact O-N 3.23Å; L376-F380 PolarHBondContact O-N 3.17Å
377F96Very high92.4Very high15 Ų1534.7 Ų34.77%0.06619%0.187CC..Hα-helixtrans-78.9-25.6-177.1-67.2-70.6000112.5I121 V125 M343 V347 A373 F380 A381I121-F377 HydrophobicContact CG2-CD1 3.66Å; I121-F377 HydrophobicContact CG2-CD2 4.38Å; I121-F377 HydrophobicContact CG2-CE1 3.37Å; I121-F377 HydrophobicContact CG2-CE2 4.14Å; I121-F377 HydrophobicContact CG2-CG 4.17Å; I121-F377 HydrophobicContact CG2-CZ 3.64Å; V125-F377 HydrophobicContact CG2-CB 3.88Å; V125-F377 HydrophobicContact CG2-CD1 4.03Å; V125-F377 HydrophobicContact CG2-CG 4.36Å; M343-F377 HydrophobicContact CG-CB 4.28Å; M343-F377 HydrophobicContact SD-CB 3.3Å; M343-F377 WeakPolarHBondContact SD-CB 3.43Å; M343-F377 HydrophobicContact SD-CG 4.36Å; V347-F377 HydrophobicContact CB-CE2 4.45Å; V347-F377 HydrophobicContact CG1-CE2 4.02Å; V347-F377 HydrophobicContact CG2-CD2 3.78Å; V347-F377 HydrophobicContact CG2-CE2 3.55Å; V347-F377 HydrophobicContact CG2-CZ 4.42Å; A373-F377 WeakPolarHBondContact O-CD2 3.19Å; A373-F377 PolarHBondContact O-N 3.09Å; F377-F380 PolarHBondContact O-N 2.87Å; F377-A381 WeakPolarHBondContact O-CB 3.27Å; F377-A381 PolarHBondContact O-N 3.11Å
378G96.2Very high92.7Very high7 Ų733.6 Ų33.67%0.07218%0.181CC..Hα-helixtrans-66.8-42.4169.500000112.7L374 F380 A381 A382L374-G378 VanDerWaalsContact O-CA 3.26Å; L374-G378 WeakPolarHBondContact O-CA 3.49Å; L374-G378 PolarHBondContact O-N 3.45Å; G378-F380 VanDerWaalsContact C-N 3.34Å; G378-A381 PolarHBondContact O-N 2.93Å; G378-A382 WeakPolarHBondContact O-CB 3.25Å; G378-A382 PolarHBondContact O-N 3.4Å
379I96.2Very high92.8Very high101 Ų10131.9 Ų31.952%0.51817%0.174SC..Hα-helixtrans-63.8-42.4172.2-70.9165.3000110.2S375 A381 A382 I383S375-I379 WeakPolarHBondContact O-CB 3.22Å; S375-I379 WeakPolarHBondContact O-CD1 3.49Å; S375-I379 WeakPolarHBondContact O-CG1 3.3Å; S375-I379 PolarHBondContact O-N 3.14Å; I379-A381 VanDerWaalsContact C-N 3.34Å; I379-A381 PolarHBondContact O-N 2.88Å; I379-A382 PolarHBondContact O-N 3.34Å; I379-I383 HydrophobicContact CG2-CD1 3.94Å; I379-I383 HydrophobicContact CG2-CG1 4.46Å; I379-I383 WeakPolarHBondContact O-CG1 3.49Å; I379-I383 PolarHBondContact O-N 3.06Å
380F95.7Very high92.3Very high65 Ų6532.9 Ų32.929%0.28518%0.179SC..Hα-helixtrans-60.7-44176.3-176.7-143000111.7V125 L376 F377 G378 A382 I383 L384 W584V125-F380 HydrophobicContact CG1-CD1 3.66Å; V125-F380 HydrophobicContact CG1-CE1 3.95Å; V125-F380 HydrophobicContact CG1-CG 4.31Å; V125-F380 HydrophobicContact CG2-CD1 4.31Å; L376-F380 PolarHBondContact O-N 3.17Å; F377-F380 PolarHBondContact O-N 2.87Å; G378-F380 VanDerWaalsContact C-N 3.34Å; F380-A382 PolarHBondContact O-N 3.24Å; F380-I383 PolarHBondContact O-N 2.83Å; F380-L384 HydrophobicContact CD2-CD1 4.44Å; F380-L384 HydrophobicContact CD2-CG 4.21Å; F380-L384 HydrophobicContact CE1-CD1 4.22Å; F380-L384 HydrophobicContact CE2-CD1 4.03Å; F380-L384 HydrophobicContact CE2-CD2 3.96Å; F380-L384 HydrophobicContact CE2-CG 3.9Å; F380-L384 HydrophobicContact CZ-CD1 3.91Å; F380-L384 HydrophobicContact CZ-CD2 4.34Å; F380-L384 HydrophobicContact CZ-CG 4.28Å; F380-L384 WeakPolarHBondContact O-CG 3.11Å; F380-L384 PolarHBondContact O-N 3.41Å; F380-W584 AromaticContact CE1-CH2 3.94Å; F380-W584 HydrophobicContact CE1-CH2 3.94Å; F380-W584 AromaticContact CE1-CZ3 3.9Å; F380-W584 HydrophobicContact CE1-CZ3 3.9Å; F380-W584 HydrophobicContact CZ-CZ3 4.23Å
381A96Very high91.5Very high0 Ų036.8 Ų36.80%020%0.196CC..Hα-helixtrans-60.7-42.9173.400000112V125 V128 S129 I177 F377 G378 I379 I383 L384 T385V125-A381 HydrophobicContact CG1-CB 4.12Å; V128-A381 HydrophobicContact CB-CB 4.08Å; V128-A381 HydrophobicContact CG1-CB 3.78Å; S129-A381 WeakPolarHBondContact OG-CA 3.27Å; S129-A381 PolarHBondContact OG-O 3.11Å; I177-A381 HydrophobicContact CD1-CB 4.34Å; F377-A381 WeakPolarHBondContact O-CB 3.27Å; F377-A381 PolarHBondContact O-N 3.11Å; G378-A381 PolarHBondContact O-N 2.93Å; I379-A381 VanDerWaalsContact C-N 3.34Å; I379-A381 PolarHBondContact O-N 2.88Å; A381-I383 VanDerWaalsContact C-N 3.33Å; A381-I383 PolarHBondContact O-N 3.12Å; A381-L384 PolarHBondContact O-N 3.43Å; A381-T385 PolarHBondContact O-N 3.39Å; A381-T385 PolarHBondContact O-OG1 3.27Å
382A96.6Very high90.9Very high10 Ų1036.8 Ų36.88%0.08320%0.195CC..Hα-helixtrans-62.2-38.1176.700000112.7A174 I177 G378 I379 F380 T385 L386A174-A382 HydrophobicContact CB-CB 4.25Å; I177-A382 HydrophobicContact CB-CB 4.4Å; I177-A382 HydrophobicContact CD1-CB 4.44Å; I177-A382 HydrophobicContact CG2-CB 4.29Å; G378-A382 WeakPolarHBondContact O-CB 3.25Å; G378-A382 PolarHBondContact O-N 3.4Å; I379-A382 PolarHBondContact O-N 3.34Å; F380-A382 PolarHBondContact O-N 3.24Å; A382-T385 PolarHBondContact O-N 3.18Å; A382-L386 WeakPolarHBondContact O-CB 3.23Å; A382-L386 PolarHBondContact O-N 3.48Å
383I95.3Very high90.2Very high83 Ų8334.6 Ų34.643%0.42618%0.182SC..Hα-helixtrans-65.2-43.9174.1-67.5166.3000110.6I379 F380 A381 L386 L387I379-I383 HydrophobicContact CG2-CD1 3.94Å; I379-I383 HydrophobicContact CG2-CG1 4.46Å; I379-I383 WeakPolarHBondContact O-CG1 3.49Å; I379-I383 PolarHBondContact O-N 3.06Å; F380-I383 PolarHBondContact O-N 2.83Å; A381-I383 VanDerWaalsContact C-N 3.33Å; A381-I383 PolarHBondContact O-N 3.12Å; I383-L386 WeakPolarHBondContact O-CB 3.31Å; I383-L386 PolarHBondContact O-N 3.47Å; I383-L387 HydrophobicContact CG2-CD1 3.89Å; I383-L387 WeakPolarHBondContact O-CG 3.34Å; I383-L387 PolarHBondContact O-N 3.28Å
384L93.1Very high89.2Confident19 Ų1935 Ų3510%0.09919%0.185CC..Hα-helixtrans-65.5-39.6176.6-67179.3000111.7V125 L126 S129 F380 A381 L386 L387 C388 L393V125-L384 HydrophobicContact CG1-CD1 3.64Å; L126-L384 HydrophobicContact CD2-CD1 4.16Å; S129-L384 WeakPolarHBondContact OG-CB 3.41Å; F380-L384 HydrophobicContact CD2-CD1 4.44Å; F380-L384 HydrophobicContact CD2-CG 4.21Å; F380-L384 HydrophobicContact CE1-CD1 4.22Å; F380-L384 HydrophobicContact CE2-CD1 4.03Å; F380-L384 HydrophobicContact CE2-CD2 3.96Å; F380-L384 HydrophobicContact CE2-CG 3.9Å; F380-L384 HydrophobicContact CZ-CD1 3.91Å; F380-L384 HydrophobicContact CZ-CD2 4.34Å; F380-L384 HydrophobicContact CZ-CG 4.28Å; F380-L384 WeakPolarHBondContact O-CG 3.11Å; F380-L384 PolarHBondContact O-N 3.41Å; A381-L384 PolarHBondContact O-N 3.43Å; L384-L386 VanDerWaalsContact C-N 3.3Å; L384-L386 PolarHBondContact O-N 3.07Å; L384-L387 PolarHBondContact O-N 3.44Å; L384-C388 VanDerWaalsContact CD2-SG 3.6Å; L384-C388 WeakPolarHBondContact O-CA 3.3Å; L384-C388 WeakPolarHBondContact O-CB 3.27Å; L384-C388 PolarHBondContact O-N 3.19Å; L384-C388 PolarHBondContact O-SG 3.03Å; L384-L393 HydrophobicContact CB-CD2 4.49Å
385T93.6Very high88.4Confident0 Ų037.7 Ų37.70%020%0.199CC..Hα-helixtrans-60.9-40.3172.1-65.10000111.8S129 A132 R133 G173 I177 A381 A382S129-T385 WeakPolarHBondContact CA-OG1 3.5Å; S129-T385 PolarHBondContact O-OG1 2.93Å; S129-T385 VanDerWaalsContact O-OG1 3.13Å; A132-T385 HydrophobicContact CB-CG2 3.8Å; R133-T385 HydrophobicContact CG-CG2 3.8Å; R133-T385 PolarHBondContact NH1-O 3.28Å; G173-T385 VanDerWaalsContact C-CG2 3.5Å; I177-T385 HydrophobicContact CD1-CG2 4.37Å; I177-T385 WeakPolarHBondContact CD1-OG1 3.38Å; A381-T385 PolarHBondContact O-N 3.39Å; A381-T385 PolarHBondContact O-OG1 3.27Å; A382-T385 PolarHBondContact O-N 3.18Å
386L92.4Very high87.7Confident44 Ų4436.6 Ų36.623%0.2319%0.189CC..Hα-helixtrans-63.6-44.1178-172.469.3000111P169 D170 F171 A382 I383 L384P169-L386 VanDerWaalsContact CA-O 3.31Å; P169-L386 WeakPolarHBondContact CA-O 3.16Å; P169-L386 HydrophobicContact CB-CD1 3.83Å; P169-L386 HydrophobicContact CB-CG 4.27Å; D170-L386 PolarHBondContact N-O 3.08Å; F171-L386 HydrophobicContact CD1-CD1 3.72Å; F171-L386 HydrophobicContact CD2-CD1 4.4Å; F171-L386 HydrophobicContact CE1-CD1 3.79Å; F171-L386 HydrophobicContact CE2-CD1 4.44Å; F171-L386 HydrophobicContact CG-CD1 4.05Å; F171-L386 HydrophobicContact CZ-CD1 4.16Å; A382-L386 WeakPolarHBondContact O-CB 3.23Å; A382-L386 PolarHBondContact O-N 3.48Å; I383-L386 WeakPolarHBondContact O-CB 3.31Å; I383-L386 PolarHBondContact O-N 3.47Å; L384-L386 VanDerWaalsContact C-N 3.3Å; L384-L386 PolarHBondContact O-N 3.07Å
387L90.4Very high87.1Confident58 Ų5832.5 Ų32.530%0.30417%0.167SC..Hα-helixtrans-97.3-40.1-167.7-60178.4000114.6F158 L165 G166 I383 L384F158-L387 HydrophobicContact CZ-CD2 3.93Å; L165-L387 CarbonylContact C-O 3.37Å; L165-L387 VanDerWaalsContact CA-O 3.3Å; L165-L387 WeakPolarHBondContact CA-O 3.19Å; L165-L387 HydrophobicContact CD2-CB 4.14Å; G166-L387 PolarHBondContact N-O 3.4Å; I383-L387 HydrophobicContact CG2-CD1 3.89Å; I383-L387 WeakPolarHBondContact O-CG 3.34Å; I383-L387 PolarHBondContact O-N 3.28Å; L384-L387 PolarHBondContact O-N 3.44Å
388C86Confident86.5Confident2 Ų232.2 Ų32.21%0.01417%0.167CC..BIsolated β-bridgetrans-98.7141.6-160.3-55.30000114.4R133 F164 L384 L393R133-C388 WeakPolarHBondContact CD-O 3.26Å; R133-C388 PolarHBondContact NE-O 2.95Å; R133-C388 VanDerWaalsContact NH1-C 3.31Å; R133-C388 PolarHBondContact NH1-O 3.29Å; F164-C388 VanDerWaalsContact CE1-SG 3.54Å; F164-C388 WeakPolarHBondContact CZ-SG 3.43Å; F164-C388 VanDerWaalsContact O-CA 3.31Å; F164-C388 WeakPolarHBondContact O-CA 3.28Å; L384-C388 VanDerWaalsContact CD2-SG 3.6Å; L384-C388 WeakPolarHBondContact O-CA 3.3Å; L384-C388 WeakPolarHBondContact O-CB 3.27Å; L384-C388 PolarHBondContact O-N 3.19Å; L384-C388 PolarHBondContact O-SG 3.03Å; C388-L393 HydrophobicContact CB-CD1 4.13Å; C388-L393 HydrophobicContact CB-CD2 3.96Å; C388-L393 HydrophobicContact CB-CG 4.02Å
389D83.7Confident86Confident40 Ų4031.9 Ų31.921%0.21416%0.164CC..  trans-64.9148.8176-176.155.8000114.4F164 H391 L393F164-D389 PolarHBondContact O-N 3.14Å; D389-H391 WeakPolarHBondContact OD2-CB 2.92Å; D389-H391 IonicContact OD2-CD2 2.93Å; D389-H391 IonicContact OD2-CG 3.04Å; D389-H391 PolarHBondContact OD2-N 3.45Å; D389-L393 VanDerWaalsContact O-CG 3.24Å; D389-L393 WeakPolarHBondContact O-CG 3.36Å; D389-L393 PolarHBondContact O-N 2.96Å; D389-L393 VanDerWaalsContact O-N 3.16Å
390I75.4Confident85.4Confident28 Ų2827.2 Ų27.214%0.14414%0.141CC..Hα-helixtrans-65.2-39.3-177.8-166169000113.4V55 S130 R133 L393 A394V55-I390 HydrophobicContact CG1-CD1 3.49Å; V55-I390 VanDerWaalsContact CG1-CD1 3.49Å; V55-I390 HydrophobicContact CG1-CG1 4.15Å; S130-I390 WeakPolarHBondContact O-CD1 3.44Å; R133-I390 HydrophobicContact CB-CB 4.21Å; R133-I390 HydrophobicContact CB-CD1 4.11Å; R133-I390 HydrophobicContact CB-CG1 4.27Å; I390-L393 PolarHBondContact O-N 3.27Å; I390-A394 PolarHBondContact O-N 3.28Å
391H73.4Confident85.1Confident85 Ų8524.1 Ų24.139%0.39413%0.127SC..Hα-helixtrans-70.4-39.7-176.6-66.1-65.4000111D389 A394 D395D389-H391 WeakPolarHBondContact OD2-CB 2.92Å; D389-H391 IonicContact OD2-CD2 2.93Å; D389-H391 IonicContact OD2-CG 3.04Å; D389-H391 PolarHBondContact OD2-N 3.45Å; H391-A394 PolarHBondContact O-N 3.43Å; H391-D395 PolarHBondContact O-N 2.85Å
392L76.9Confident84.9Confident21 Ų2124.3 Ų24.311%0.1113%0.128CC..Hα-helixtrans-66-39175.2-71.8-170.6000113.3E163 F164 A394 F396E163-L392 HydrophobicContact CB-CD1 4.43Å; E163-L392 HydrophobicContact CG-CD1 4.11Å; E163-L392 HydrophobicContact CG-CD2 4.18Å; E163-L392 WeakPolarHBondContact O-CD1 3.38Å; F164-L392 VanDerWaalsContact CA-CD1 3.46Å; L392-A394 VanDerWaalsContact C-N 3.26Å; L392-A394 PolarHBondContact O-N 2.87Å; L392-F396 WeakPolarHBondContact O-CB 3.25Å; L392-F396 PolarHBondContact O-N 2.9Å
393L78.9Confident84.7Confident6 Ų625.2 Ų25.23%0.03113%0.131CC..Hα-helixtrans-61.5-39.8174-69.5168.8000110.5L126 L384 C388 D389 I390 F396 L397L126-L393 HydrophobicContact CD2-CD2 3.5Å; L384-L393 HydrophobicContact CB-CD2 4.49Å; C388-L393 HydrophobicContact CB-CD1 4.13Å; C388-L393 HydrophobicContact CB-CD2 3.96Å; C388-L393 HydrophobicContact CB-CG 4.02Å; D389-L393 VanDerWaalsContact O-CG 3.24Å; D389-L393 WeakPolarHBondContact O-CG 3.36Å; D389-L393 PolarHBondContact O-N 2.96Å; D389-L393 VanDerWaalsContact O-N 3.16Å; I390-L393 PolarHBondContact O-N 3.27Å; L393-F396 PolarHBondContact O-N 3.11Å; L393-L397 WeakPolarHBondContact O-CB 3.24Å; L393-L397 PolarHBondContact O-N 3.23Å
394A73.2Confident84.5Confident7 Ų721.3 Ų21.36%0.05811%0.111CC..Hα-helixtrans-69.1-43.7-179.100000113.7Y249 I390 H391 L392 F396 L397 S398Y249-A394 HydrophobicContact CD2-CB 3.85Å; Y249-A394 VanDerWaalsContact CE2-CA 3.48Å; Y249-A394 HydrophobicContact CE2-CB 3.48Å; Y249-A394 VanDerWaalsContact CE2-CB 3.48Å; I390-A394 PolarHBondContact O-N 3.28Å; H391-A394 PolarHBondContact O-N 3.43Å; L392-A394 VanDerWaalsContact C-N 3.26Å; L392-A394 PolarHBondContact O-N 2.87Å; A394-F396 VanDerWaalsContact C-N 3.3Å; A394-F396 PolarHBondContact O-N 3.3Å; A394-L397 PolarHBondContact O-N 2.73Å; A394-S398 PolarHBondContact O-N 3.15Å; A394-S398 PolarHBondContact O-OG 2.8Å
395D76.8Confident84.6Confident61 Ų6120.4 Ų20.433%0.32611%0.107SC..Hα-helixtrans-64.3-39.1174.6-76.8-10.2000111H391 S398 T577H391-D395 PolarHBondContact O-N 2.85Å; D395-S398 PolarHBondContact O-N 3.01Å; D395-T577 VanDerWaalsContact O-CG2 3.27Å; D395-T577 WeakPolarHBondContact O-CG2 3.35Å
396F80.1Confident84.7Confident27 Ų2720.8 Ų20.812%0.11811%0.109CC..Hα-helixtrans-70.4-34178.2-168-156.3000113.2L122 L126 L392 L393 A394 S398 I399 R580 F581 W584L122-F396 HydrophobicContact CD1-CE1 4.18Å; L122-F396 HydrophobicContact CD1-CZ 4.39Å; L122-F396 HydrophobicContact CD2-CE1 4Å; L122-F396 HydrophobicContact CD2-CE2 3.84Å; L122-F396 HydrophobicContact CD2-CZ 3.45Å; L122-F396 VanDerWaalsContact CD2-CZ 3.45Å; L122-F396 HydrophobicContact CG-CZ 4.44Å; L126-F396 HydrophobicContact CD1-CB 3.97Å; L126-F396 HydrophobicContact CD1-CD1 3.45Å; L126-F396 VanDerWaalsContact CD1-CD1 3.45Å; L126-F396 HydrophobicContact CD1-CD2 4.25Å; L126-F396 HydrophobicContact CD1-CE1 3.94Å; L126-F396 HydrophobicContact CD1-CG 3.62Å; L126-F396 HydrophobicContact CD2-CD1 3.68Å; L126-F396 HydrophobicContact CD2-CE1 4.2Å; L126-F396 HydrophobicContact CG-CD1 4.22Å; L392-F396 WeakPolarHBondContact O-CB 3.25Å; L392-F396 PolarHBondContact O-N 2.9Å; L393-F396 PolarHBondContact O-N 3.11Å; A394-F396 VanDerWaalsContact C-N 3.3Å; A394-F396 PolarHBondContact O-N 3.3Å; F396-S398 VanDerWaalsContact C-N 3.33Å; F396-S398 PolarHBondContact O-N 3.37Å; F396-I399 HydrophobicContact CD2-CG2 4.21Å; F396-I399 WeakPolarHBondContact O-CG2 3.3Å; F396-R580 HydrophobicContact CD2-CB 4.1Å; F396-R580 HydrophobicContact CE1-CB 4.21Å; F396-R580 HydrophobicContact CE2-CB 3.73Å; F396-R580 HydrophobicContact CZ-CB 3.78Å; F396-F581 HydrophobicContact CE2-CB 3.95Å; F396-F581 HydrophobicContact CE2-CD2 4.49Å; F396-W584 HydrophobicContact CZ-CB 4.48Å
397L83.5Confident84.9Confident3 Ų319.7 Ų19.72%0.01610%0.103CC..Hα-helixtrans-60.5-43.5173.5-179.669.1000111.9E123 L126 Y249 I252 L393 A394 I399 G400 T401E123-L397 HydrophobicContact CB-CD1 4.04Å; E123-L397 HydrophobicContact CG-CD1 3.39Å; E123-L397 HydrophobicContact CG-CG 4.37Å; E123-L397 WeakPolarHBondContact O-CD1 3.34Å; L126-L397 HydrophobicContact CB-CB 4.26Å; L126-L397 HydrophobicContact CB-CD1 3.96Å; Y249-L397 HydrophobicContact CD2-CD2 3.86Å; Y249-L397 HydrophobicContact CE2-CB 4.06Å; Y249-L397 HydrophobicContact CE2-CD2 3.21Å; Y249-L397 HydrophobicContact CE2-CG 4.14Å; I252-L397 HydrophobicContact CD1-CD2 4.25Å; I252-L397 HydrophobicContact CD1-CG 4.3Å; I252-L397 HydrophobicContact CG2-CD2 4.21Å; L393-L397 WeakPolarHBondContact O-CB 3.24Å; L393-L397 PolarHBondContact O-N 3.23Å; A394-L397 PolarHBondContact O-N 2.73Å; L397-I399 VanDerWaalsContact C-N 3.34Å; L397-I399 PolarHBondContact O-N 3.46Å; L397-G400 PolarHBondContact O-N 2.95Å; L397-T401 PolarHBondContact O-N 3.42Å; L397-T401 PolarHBondContact O-OG1 2.61Å
398S83.4Confident85.1Confident10 Ų1017 Ų177%0.079%0.089CC..Hα-helixtrans-62.9-38.1-169.3-61.80000112.5A394 D395 F396 L402A394-S398 PolarHBondContact O-N 3.15Å; A394-S398 PolarHBondContact O-OG 2.8Å; D395-S398 PolarHBondContact O-N 3.01Å; F396-S398 VanDerWaalsContact C-N 3.33Å; F396-S398 PolarHBondContact O-N 3.37Å; S398-L402 WeakPolarHBondContact O-CB 3.46Å; S398-L402 WeakPolarHBondContact O-CD1 3.31Å; S398-L402 WeakPolarHBondContact O-CG 3.33Å; S398-L402 PolarHBondContact O-N 3.44Å
399I86.2Confident85.6Confident0 Ų016.9 Ų16.90%09%0.088CC..Hα-helixtrans-66.8-43.3-178.4-170.6148.3000113.2F396 L397 T401 L402 I403 L573 T577 W578 F581F396-I399 HydrophobicContact CD2-CG2 4.21Å; F396-I399 WeakPolarHBondContact O-CG2 3.3Å; L397-I399 VanDerWaalsContact C-N 3.34Å; L397-I399 PolarHBondContact O-N 3.46Å; I399-T401 PolarHBondContact O-N 3Å; I399-L402 PolarHBondContact O-N 3.33Å; I399-I403 HydrophobicContact CG1-CD1 3.96Å; I399-I403 WeakPolarHBondContact O-CG1 3.29Å; I399-I403 PolarHBondContact O-N 2.79Å; I399-I403 VanDerWaalsContact O-N 3.1Å; I399-L573 HydrophobicContact CB-CD1 3.64Å; I399-L573 HydrophobicContact CD1-CD1 4.2Å; I399-L573 HydrophobicContact CG1-CD1 4.23Å; I399-T577 HydrophobicContact CB-CG2 4.14Å; I399-T577 HydrophobicContact CG2-CG2 3.76Å; I399-W578 HydrophobicContact CD1-CD2 3.38Å; I399-W578 VanDerWaalsContact CD1-CE2 3.41Å; I399-W578 HydrophobicContact CD1-CE3 3.6Å; I399-W578 HydrophobicContact CD1-CG 3.93Å; I399-W578 HydrophobicContact CD1-CH2 3.88Å; I399-W578 HydrophobicContact CD1-CZ2 3.69Å; I399-W578 HydrophobicContact CD1-CZ3 3.84Å; I399-F581 HydrophobicContact CG1-CG 4.41Å; I399-F581 HydrophobicContact CG2-CB 3.92Å; I399-F581 HydrophobicContact CG2-CD2 3.91Å; I399-F581 HydrophobicContact CG2-CG 4.02Å
400G83.4Confident86.2Confident3 Ų316.3 Ų16.33%0.0319%0.085CC..Hα-helixtrans-62.4-45.9179.600000111.4L397 I403 A404L397-G400 PolarHBondContact O-N 2.95Å; G400-I403 PolarHBondContact O-N 3.41Å; G400-A404 PolarHBondContact O-N 3.19Å; G400-A404 VanDerWaalsContact O-N 3.08Å
401T89.5Confident87Confident0 Ų015 Ų150%08%0.078CC..Hα-helixtrans-60.9-48.1178.4-45.30000111.7E123 I252 L397 I399 I403 A404 Y405E123-T401 WeakPolarHBondContact CG-OG1 3.21Å; E123-T401 PolarHBondContact OE1-OG1 2.93Å; E123-T401 WeakPolarHBondContact OE2-CA 3.43Å; I252-T401 HydrophobicContact CB-CG2 4.45Å; I252-T401 HydrophobicContact CD1-CG2 4.15Å; I252-T401 HydrophobicContact CG1-CG2 3.99Å; I252-T401 HydrophobicContact CG2-CG2 3.84Å; L397-T401 PolarHBondContact O-N 3.42Å; L397-T401 PolarHBondContact O-OG1 2.61Å; I399-T401 PolarHBondContact O-N 3Å; T401-I403 VanDerWaalsContact C-N 3.32Å; T401-I403 PolarHBondContact O-N 2.7Å; T401-A404 WeakPolarHBondContact O-CB 3.23Å; T401-A404 PolarHBondContact O-N 2.65Å; T401-Y405 HydrophobicContact CG2-CD1 4.05Å; T401-Y405 HydrophobicContact CG2-CD2 4.21Å; T401-Y405 HydrophobicContact CG2-CE1 3.55Å; T401-Y405 HydrophobicContact CG2-CE2 3.69Å; T401-Y405 HydrophobicContact CG2-CG 4.39Å; T401-Y405 VanDerWaalsContact O-CD1 3.3Å; T401-Y405 WeakPolarHBondContact O-CD1 3.37Å; T401-Y405 PolarHBondContact O-N 3.4Å
402L91.4Very high88Confident3 Ų311 Ų112%0.0166%0.059CC..Hα-helixtrans-64.6-36.8-177.7-72.2168.9000111.9F248 S398 I399 Y405 T406 N566 L569 M570F248-L402 HydrophobicContact CD1-CD2 3.92Å; F248-L402 HydrophobicContact CE1-CD2 3.41Å; F248-L402 VanDerWaalsContact CE1-CD2 3.41Å; F248-L402 HydrophobicContact CE1-CG 4.25Å; F248-L402 HydrophobicContact CZ-CD2 3.96Å; S398-L402 WeakPolarHBondContact O-CB 3.46Å; S398-L402 WeakPolarHBondContact O-CD1 3.31Å; S398-L402 WeakPolarHBondContact O-CG 3.33Å; S398-L402 PolarHBondContact O-N 3.44Å; I399-L402 PolarHBondContact O-N 3.33Å; L402-Y405 PolarHBondContact O-N 3.04Å; L402-T406 WeakPolarHBondContact O-CB 3.25Å; L402-T406 PolarHBondContact O-N 3.09Å; L402-T406 PolarHBondContact O-OG1 2.87Å; L402-T406 VanDerWaalsContact O-OG1 3.06Å; L402-N566 HydrophobicContact CD2-CB 4.13Å; L402-L569 HydrophobicContact CD1-CB 3.62Å; L402-L569 HydrophobicContact CD2-CB 4.06Å; L402-L569 HydrophobicContact CD2-CD1 3.83Å; L402-M570 HydrophobicContact CB-CE 3.85Å; L402-M570 HydrophobicContact CB-CG 3.63Å; L402-M570 HydrophobicContact CB-SD 4.18Å; L402-M570 HydrophobicContact CD1-CG 3.78Å; L402-M570 HydrophobicContact CG-CG 4.34Å; L402-M570 WeakPolarHBondContact O-CE 3.4Å
403I91.3Very high88.8Confident30 Ų3010 Ų1015%0.1545%0.054CC..Hα-helixtrans-64.1-46.2173.8-71168.7000110.4I399 G400 T401 Y405 T406 I407 M570 F581I399-I403 HydrophobicContact CG1-CD1 3.96Å; I399-I403 WeakPolarHBondContact O-CG1 3.29Å; I399-I403 PolarHBondContact O-N 2.79Å; I399-I403 VanDerWaalsContact O-N 3.1Å; G400-I403 PolarHBondContact O-N 3.41Å; T401-I403 VanDerWaalsContact C-N 3.32Å; T401-I403 PolarHBondContact O-N 2.7Å; I403-Y405 VanDerWaalsContact C-N 3.31Å; I403-Y405 PolarHBondContact O-N 3.15Å; I403-T406 PolarHBondContact O-N 3.39Å; I403-I407 HydrophobicContact CG2-CD1 3.86Å; I403-I407 WeakPolarHBondContact O-CG1 3.23Å; I403-I407 PolarHBondContact O-N 3.19Å; I403-M570 HydrophobicContact CG1-CE 4.38Å; I403-M570 HydrophobicContact CG1-SD 3.76Å; I403-F581 HydrophobicContact CD1-CD1 4.01Å; I403-F581 HydrophobicContact CD1-CE1 3.29Å; I403-F581 HydrophobicContact CD1-CE2 4.27Å; I403-F581 HydrophobicContact CD1-CZ 3.45Å; I403-F581 VanDerWaalsContact CD1-CZ 3.45Å
404A93Very high89.3Confident1 Ų110.9 Ų10.91%0.0086%0.059CC..Hα-helixtrans-59.7-42.6176.300000111.5A100 V116 G400 T401 I407 V408A100-A404 HydrophobicContact CB-CB 4.48Å; V116-A404 HydrophobicContact CG1-CB 4.24Å; G400-A404 PolarHBondContact O-N 3.19Å; G400-A404 VanDerWaalsContact O-N 3.08Å; T401-A404 WeakPolarHBondContact O-CB 3.23Å; T401-A404 PolarHBondContact O-N 2.65Å; A404-I407 PolarHBondContact O-N 3.4Å; A404-V408 WeakPolarHBondContact O-CB 3.32Å; A404-V408 WeakPolarHBondContact O-CG2 3.39Å; A404-V408 PolarHBondContact O-N 3.02Å
405Y95.1Very high89.9Confident0 Ų011.1 Ų11.10%06%0.059CC..Hα-helixtrans-64.9-44179-72.48000111.7N83 Y87 F248 F254 D255 T401 L402 I403 I407 V408 S409 N566N83-Y405 HydrophobicContact CB-CD2 4.12Å; Y87-Y405 AromaticContact CE2-CD1 3.41Å; Y87-Y405 HydrophobicContact CE2-CD1 3.41Å; Y87-Y405 VanDerWaalsContact CE2-CD1 3.41Å; Y87-Y405 AromaticContact CE2-CE1 3.7Å; Y87-Y405 HydrophobicContact CE2-CE1 3.7Å; Y87-Y405 HydrophobicContact CE2-CG 4.14Å; Y87-Y405 AromaticContact CZ-CD1 3.68Å; Y87-Y405 AromaticContact CZ-CE1 3.78Å; Y87-Y405 VanDerWaalsContact OH-CD1 3.23Å; Y87-Y405 WeakPolarHBondContact OH-CD1 3.33Å; Y87-Y405 WeakPolarHBondContact OH-CE1 3.22Å; F248-Y405 HydrophobicContact CE1-CD2 4.21Å; F248-Y405 HydrophobicContact CE1-CE2 4.06Å; F248-Y405 AromaticContact CZ-CD2 3.8Å; F248-Y405 HydrophobicContact CZ-CD2 3.8Å; F248-Y405 AromaticContact CZ-CE2 3.76Å; F248-Y405 HydrophobicContact CZ-CE2 3.76Å; F254-Y405 HydrophobicContact CE1-CE1 4.48Å; F254-Y405 AromaticContact CE1-CE2 3.56Å; F254-Y405 HydrophobicContact CE1-CE2 3.56Å; F254-Y405 AromaticContact CE1-CZ 3.51Å; F254-Y405 VanDerWaalsContact CE1-OH 3.24Å; F254-Y405 WeakPolarHBondContact CE1-OH 3.45Å; F254-Y405 HydrophobicContact CZ-CD2 4.3Å; F254-Y405 AromaticContact CZ-CE1 3.97Å; F254-Y405 HydrophobicContact CZ-CE1 3.97Å; F254-Y405 AromaticContact CZ-CE2 3.61Å; F254-Y405 HydrophobicContact CZ-CE2 3.61Å; F254-Y405 AromaticContact CZ-CZ 3.4Å; F254-Y405 VanDerWaalsContact CZ-CZ 3.4Å; F254-Y405 WeakPolarHBondContact CZ-OH 3.48Å; D255-Y405 HydrophobicContact CB-CE1 4.19Å; D255-Y405 PolarHBondContact OD1-OH 2.79Å; T401-Y405 HydrophobicContact CG2-CD1 4.05Å; T401-Y405 HydrophobicContact CG2-CD2 4.21Å; T401-Y405 HydrophobicContact CG2-CE1 3.55Å; T401-Y405 HydrophobicContact CG2-CE2 3.69Å; T401-Y405 HydrophobicContact CG2-CG 4.39Å; T401-Y405 VanDerWaalsContact O-CD1 3.3Å; T401-Y405 WeakPolarHBondContact O-CD1 3.37Å; T401-Y405 PolarHBondContact O-N 3.4Å; L402-Y405 PolarHBondContact O-N 3.04Å; I403-Y405 VanDerWaalsContact C-N 3.31Å; I403-Y405 PolarHBondContact O-N 3.15Å; Y405-I407 PolarHBondContact O-N 2.95Å; Y405-V408 PolarHBondContact O-N 3Å; Y405-S409 PolarHBondContact O-N 3.34Å; Y405-S409 PolarHBondContact O-OG 3.42Å; Y405-N566 WeakPolarHBondContact CB-ND2 3.19Å
406T95.8Very high90.5Very high7 Ų78.9 Ų8.94%0.0435%0.046CC..Hα-helixtrans-57.6-47.4174.1-69.70000111.8L402 I403 S409 M410 V563 N566 F567 M570L402-T406 WeakPolarHBondContact O-CB 3.25Å; L402-T406 PolarHBondContact O-N 3.09Å; L402-T406 PolarHBondContact O-OG1 2.87Å; L402-T406 VanDerWaalsContact O-OG1 3.06Å; I403-T406 PolarHBondContact O-N 3.39Å; T406-S409 PolarHBondContact O-N 2.92Å; T406-M410 HydrophobicContact CG2-SD 4.21Å; T406-M410 VanDerWaalsContact O-CG 3.31Å; T406-M410 WeakPolarHBondContact O-CG 3.31Å; T406-M410 PolarHBondContact O-N 3.47Å; T406-V563 HydrophobicContact CG2-CB 4.49Å; T406-V563 HydrophobicContact CG2-CG1 4.07Å; T406-V563 HydrophobicContact CG2-CG2 4.17Å; T406-N566 PolarHBondContact N-ND2 2.65Å; T406-N566 WeakPolarHBondContact OG1-CB 3.38Å; T406-N566 PolarHBondContact OG1-ND2 3.03Å; T406-F567 HydrophobicContact CG2-CE1 4.22Å; T406-F567 HydrophobicContact CG2-CZ 3.99Å; T406-M570 VanDerWaalsContact OG1-CE 3.23Å; T406-M570 WeakPolarHBondContact OG1-CE 3.41Å
407I95.4Very high90.8Very high22 Ų227.7 Ų7.711%0.1134%0.041CC..Hα-helixtrans-67.2-38.7179.7-66.6168.6000110.9T104 V116 I403 A404 Y405 M410 N411T104-I407 HydrophobicContact CG2-CG2 3.69Å; V116-I407 HydrophobicContact CG2-CB 4.1Å; V116-I407 HydrophobicContact CG2-CD1 3.44Å; V116-I407 VanDerWaalsContact CG2-CD1 3.44Å; V116-I407 HydrophobicContact CG2-CG1 4.36Å; V116-I407 HydrophobicContact CG2-CG2 3.87Å; I403-I407 HydrophobicContact CG2-CD1 3.86Å; I403-I407 WeakPolarHBondContact O-CG1 3.23Å; I403-I407 PolarHBondContact O-N 3.19Å; A404-I407 PolarHBondContact O-N 3.4Å; Y405-I407 PolarHBondContact O-N 2.95Å; I407-M410 CarbonylContact O-C 3.41Å; I407-M410 WeakPolarHBondContact O-CB 3.38Å; I407-M410 PolarHBondContact O-N 2.86Å; I407-N411 PolarHBondContact O-N 3.13Å; I407-N411 PolarHBondContact O-ND2 3.42Å; I407-N411 PolarHBondContact O-OD1 3.07Å
408V95.4Very high90.5Very high0 Ų08.7 Ų8.70%05%0.048CC..Hα-helixtrans-63-43.2175.1163.90000112C86 Y87 L90 A100 Y103 A404 Y405 M410 N411 V412C86-V408 HydrophobicContact CB-CG1 4.31Å; Y87-V408 HydrophobicContact CD1-CG1 4.45Å; Y87-V408 HydrophobicContact CD2-CB 4.42Å; Y87-V408 HydrophobicContact CD2-CG1 3.65Å; Y87-V408 HydrophobicContact CE1-CG1 4.39Å; Y87-V408 HydrophobicContact CE1-CG2 4.15Å; Y87-V408 HydrophobicContact CE2-CB 3.87Å; Y87-V408 HydrophobicContact CE2-CG1 3.61Å; Y87-V408 HydrophobicContact CE2-CG2 4.08Å; Y87-V408 HydrophobicContact CG-CG1 4.1Å; L90-V408 HydrophobicContact CD1-CG1 3.86Å; A100-V408 HydrophobicContact CB-CG2 3.45Å; A100-V408 VanDerWaalsContact CB-CG2 3.45Å; Y103-V408 HydrophobicContact CD2-CG2 4.35Å; A404-V408 WeakPolarHBondContact O-CB 3.32Å; A404-V408 WeakPolarHBondContact O-CG2 3.39Å; A404-V408 PolarHBondContact O-N 3.02Å; Y405-V408 PolarHBondContact O-N 3Å; V408-M410 VanDerWaalsContact C-N 3.29Å; V408-M410 PolarHBondContact O-N 3.28Å; V408-N411 WeakPolarHBondContact O-CB 3.32Å; V408-N411 PolarHBondContact O-N 3.38Å; V408-N411 VanDerWaalsContact O-N 3.15Å; V408-V412 PolarHBondContact O-N 3.44Å
409S96.3Very high89.3Confident1 Ų113 Ų131%0.0077%0.067CC..Hα-helixtrans-60.5-40.6172.9-61.90000111.6Y405 T406 V412 C413 P559 C562Y405-S409 PolarHBondContact O-N 3.34Å; Y405-S409 PolarHBondContact O-OG 3.42Å; T406-S409 PolarHBondContact O-N 2.92Å; S409-V412 PolarHBondContact O-N 3.09Å; S409-C413 PolarHBondContact O-N 2.87Å; S409-P559 WeakPolarHBondContact O-CB 3.26Å; S409-C562 WeakPolarHBondContact OG-CB 3.4Å
410M95.5Very high87.6Confident28 Ų2814.6 Ų14.614%0.1388%0.077CC..Hα-helixtrans-63.2-41.5173.2-68.2170.665.400112.1T406 I407 V408 V412 C413 I414 L492 L493 T496 V563T406-M410 HydrophobicContact CG2-SD 4.21Å; T406-M410 VanDerWaalsContact O-CG 3.31Å; T406-M410 WeakPolarHBondContact O-CG 3.31Å; T406-M410 PolarHBondContact O-N 3.47Å; I407-M410 CarbonylContact O-C 3.41Å; I407-M410 WeakPolarHBondContact O-CB 3.38Å; I407-M410 PolarHBondContact O-N 2.86Å; V408-M410 VanDerWaalsContact C-N 3.29Å; V408-M410 PolarHBondContact O-N 3.28Å; M410-V412 VanDerWaalsContact C-N 3.3Å; M410-V412 PolarHBondContact O-N 3.29Å; M410-C413 WeakPolarHBondContact O-CB 3.31Å; M410-C413 PolarHBondContact O-N 3.42Å; M410-C413 VanDerWaalsContact O-N 3.07Å; M410-I414 WeakPolarHBondContact O-CG1 3.34Å; M410-I414 PolarHBondContact O-N 2.87Å; M410-L492 HydrophobicContact CB-CD2 4.09Å; M410-L492 HydrophobicContact CG-CD1 4.45Å; M410-L492 HydrophobicContact CG-CD2 4.38Å; M410-L492 HydrophobicContact CG-CG 4.47Å; M410-L493 HydrophobicContact CE-CD2 3.99Å; M410-T496 HydrophobicContact CE-CG2 3.93Å; M410-T496 HydrophobicContact CG-CG2 4.15Å; M410-T496 HydrophobicContact SD-CG2 3.73Å; M410-V563 HydrophobicContact CG-CG2 4.04Å
411N93.2Very high86Confident0 Ų020.2 Ų20.20%010%0.103CC..Hα-helixtrans-61.4-36.7178.4-67-27.4000112L90 T104 A107 S108 I407 V408 C413 I414 L415L90-N411 HydrophobicContact CD1-CB 3.87Å; T104-N411 VanDerWaalsContact CA-ND2 3.26Å; T104-N411 WeakPolarHBondContact CA-ND2 3.38Å; T104-N411 PolarHBondContact N-ND2 3.46Å; T104-N411 PolarHBondContact OG1-ND2 3.45Å; A107-N411 HydrophobicContact CB-CB 3.68Å; S108-N411 PolarHBondContact OG-OD1 2.99Å; I407-N411 PolarHBondContact O-N 3.13Å; I407-N411 PolarHBondContact O-ND2 3.42Å; I407-N411 PolarHBondContact O-OD1 3.07Å; V408-N411 WeakPolarHBondContact O-CB 3.32Å; V408-N411 PolarHBondContact O-N 3.38Å; V408-N411 VanDerWaalsContact O-N 3.15Å; N411-C413 VanDerWaalsContact C-N 3.33Å; N411-C413 PolarHBondContact O-N 2.76Å; N411-I414 PolarHBondContact O-N 3.26Å; N411-L415 WeakPolarHBondContact O-CB 3.47Å; N411-L415 WeakPolarHBondContact O-CG 3.4Å; N411-L415 PolarHBondContact O-N 2.88Å
412V93.6Very high83.6Confident0 Ų022.2 Ų22.20%011%0.113CC..Hα-helixtrans-57.9-46.5172.2171.50000110.9C86 L90 V408 S409 M410 R416 V555 P559C86-V412 HydrophobicContact CB-CG2 3.86Å; L90-V412 HydrophobicContact CD1-CG2 3.96Å; L90-V412 HydrophobicContact CD2-CG2 3.86Å; L90-V412 HydrophobicContact CG-CG2 3.72Å; V408-V412 PolarHBondContact O-N 3.44Å; S409-V412 PolarHBondContact O-N 3.09Å; M410-V412 VanDerWaalsContact C-N 3.3Å; M410-V412 PolarHBondContact O-N 3.29Å; V412-R416 WeakPolarHBondContact O-CB 3.4Å; V412-R416 WeakPolarHBondContact O-CG 3.44Å; V412-R416 PolarHBondContact O-N 3.18Å; V412-V555 HydrophobicContact CG1-CG2 4.3Å; V412-P559 HydrophobicContact CB-CG 4.39Å; V412-P559 HydrophobicContact CG1-CG 3.97Å
413C92.9Very high80.8Confident2 Ų228.8 Ų28.81%0.01414%0.139CC..Hα-helixtrans-63.6-48175.9-72.80000111.5S409 M410 N411 L415 R416 Y417 L492 P559S409-C413 PolarHBondContact O-N 2.87Å; M410-C413 WeakPolarHBondContact O-CB 3.31Å; M410-C413 PolarHBondContact O-N 3.42Å; M410-C413 VanDerWaalsContact O-N 3.07Å; N411-C413 VanDerWaalsContact C-N 3.33Å; N411-C413 PolarHBondContact O-N 2.76Å; C413-L415 VanDerWaalsContact C-N 3.35Å; C413-L415 PolarHBondContact O-N 2.79Å; C413-R416 PolarHBondContact O-N 3.42Å; C413-R416 VanDerWaalsContact O-N 3.12Å; C413-Y417 HydrophobicContact CB-CD2 4.41Å; C413-Y417 VanDerWaalsContact O-CD2 3.22Å; C413-Y417 WeakPolarHBondContact O-CD2 3.29Å; C413-Y417 PolarHBondContact O-N 2.99Å; C413-L492 HydrophobicContact CB-CD1 4.08Å; C413-L492 HydrophobicContact CB-CD2 3.7Å; C413-L492 HydrophobicContact CB-CG 4.5Å; C413-P559 VanDerWaalsContact SG-CB 3.55Å
414I90.4Very high78.2Confident24 Ų2429.7 Ų29.712%0.12315%0.147CC..Hα-helixtrans-58-47.4-179-66.7165.4000110.6A107 S108 M410 N411 R416 Y417 C418 L492A107-I414 HydrophobicContact CB-CG2 4.34Å; A107-I414 WeakPolarHBondContact O-CG2 3.34Å; S108-I414 WeakPolarHBondContact OG-CD1 3.35Å; M410-I414 WeakPolarHBondContact O-CG1 3.34Å; M410-I414 PolarHBondContact O-N 2.87Å; N411-I414 PolarHBondContact O-N 3.26Å; I414-R416 VanDerWaalsContact C-N 3.26Å; I414-R416 PolarHBondContact O-N 3.34Å; I414-Y417 PolarHBondContact O-N 3.37Å; I414-C418 WeakPolarHBondContact O-CB 3.38Å; I414-C418 PolarHBondContact O-N 3.01Å; I414-L492 HydrophobicContact CD1-CD2 4.42Å; I414-L492 HydrophobicContact CG1-CD2 3.86Å
415L86.3Confident75.6Confident12 Ų1231.7 Ų31.76%0.06317%0.168CC..Hα-helixtrans-70.1-19.5-179.7-67.7173.1000114L90 I94 V106 A107 N411 C413 P420L90-L415 HydrophobicContact CD2-CD1 3.59Å; I94-L415 HydrophobicContact CD1-CD1 4.29Å; V106-L415 HydrophobicContact CG1-CD2 4.18Å; A107-L415 HydrophobicContact CB-CD1 4.08Å; A107-L415 HydrophobicContact CB-CD2 3.92Å; A107-L415 HydrophobicContact CB-CG 3.74Å; N411-L415 WeakPolarHBondContact O-CB 3.47Å; N411-L415 WeakPolarHBondContact O-CG 3.4Å; N411-L415 PolarHBondContact O-N 2.88Å; C413-L415 VanDerWaalsContact C-N 3.35Å; C413-L415 PolarHBondContact O-N 2.79Å; L415-P420 HydrophobicContact CD2-CB 4.5Å; L415-P420 HydrophobicContact CD2-CG 3.95Å
416R88.8Confident72.5Confident13 Ų1337.9 Ų37.95%0.04920%0.197CC..Hα-helixtrans-87.3-31174.2-79.4-179.8173.4-122.415113.3E89 V412 C413 I414 Q543 N544 K551 V552E89-R416 IonicContact OE1-CZ 2.76Å; E89-R416 IonicContact OE1-NE 3.18Å; E89-R416 PolarHBondContact OE1-NE 2.91Å; E89-R416 IonicContact OE1-NH2 2.68Å; E89-R416 PolarHBondContact OE1-NH2 2.89Å; E89-R416 IonicContact OE2-CZ 3.35Å; E89-R416 IonicContact OE2-NE 3.53Å; E89-R416 PolarHBondContact OE2-NE 3.27Å; E89-R416 IonicContact OE2-NH2 3.81Å; E89-R416 PolarHBondContact OE2-NH2 3.18Å; V412-R416 WeakPolarHBondContact O-CB 3.4Å; V412-R416 WeakPolarHBondContact O-CG 3.44Å; V412-R416 PolarHBondContact O-N 3.18Å; C413-R416 PolarHBondContact O-N 3.42Å; C413-R416 VanDerWaalsContact O-N 3.12Å; I414-R416 VanDerWaalsContact C-N 3.26Å; I414-R416 PolarHBondContact O-N 3.34Å; R416-Q543 CarbonylContact O-C 3.59Å; R416-Q543 WeakPolarHBondContact O-CA 3.18Å; R416-N544 WeakPolarHBondContact O-CB 3.47Å; R416-N544 PolarHBondContact O-N 3.26Å; R416-K551 VanDerWaalsContact NH2-CB 3.27Å; R416-V552 VanDerWaalsContact NH2-N 3.18Å; R416-V552 PolarHBondContact NH2-O 3.28Å
417Y86.7Confident69.4Low3 Ų344.1 Ų44.11%0.01222%0.22CC..Hα-helixtrans-102.4-13.8-176.4-71.8-69.2000114.1C413 I414 G467 G485 P488 M538 H541 Q543 V555 P556C413-Y417 HydrophobicContact CB-CD2 4.41Å; C413-Y417 VanDerWaalsContact O-CD2 3.22Å; C413-Y417 WeakPolarHBondContact O-CD2 3.29Å; C413-Y417 PolarHBondContact O-N 2.99Å; I414-Y417 PolarHBondContact O-N 3.37Å; Y417-G467 WeakPolarHBondContact O-CA 3.45Å; Y417-G485 VanDerWaalsContact O-CA 3.23Å; Y417-G485 WeakPolarHBondContact O-CA 3.4Å; Y417-P488 HydrophobicContact CD1-CB 3.93Å; Y417-P488 HydrophobicContact CD1-CG 4.12Å; Y417-P488 HydrophobicContact CD2-CB 4.33Å; Y417-P488 HydrophobicContact CG-CB 3.78Å; Y417-P488 HydrophobicContact CG-CG 4.11Å; Y417-M538 WeakPolarHBondContact CE1-O 3.48Å; Y417-M538 HydrophobicContact CE2-CB 4.3Å; Y417-M538 VanDerWaalsContact CZ-O 3.23Å; Y417-M538 PolarHBondContact OH-O 3.22Å; Y417-H541 HydrophobicContact CD1-CB 4.06Å; Y417-H541 HydrophobicContact CE1-CB 4.03Å; Y417-Q543 HydrophobicContact CD1-CG 4.17Å; Y417-Q543 HydrophobicContact CE1-CG 3.48Å; Y417-Q543 VanDerWaalsContact CE1-CG 3.48Å; Y417-Q543 HydrophobicContact CE2-CG 4.36Å; Y417-Q543 PolarHBondContact OH-NE2 2.94Å; Y417-V555 HydrophobicContact CE2-CG1 4.21Å; Y417-P556 HydrophobicContact CE2-CB 4.23Å; Y417-P556 WeakPolarHBondContact OH-CD 3.23Å
418C76.2Confident66.5Low24 Ų2448.2 Ų48.216%0.16224%0.242CC..SBendtrans-118.4144173.1-75.50000110.8I414 P420 G485 I489I414-C418 WeakPolarHBondContact O-CB 3.38Å; I414-C418 PolarHBondContact O-N 3.01Å; C418-P420 WeakPolarHBondContact O-CD 3.2Å; C418-G485 VanDerWaalsContact SG-CA 3.6Å; C418-I489 HydrophobicContact CB-CD1 4.45Å; C418-I489 WeakPolarHBondContact SG-CD1 3.35Å
419Q59.6Low63.8Low100 Ų10054.3 Ų54.347%0.46727%0.27SS..  trans-70.3115.4163.8-67.2-178.8-27.100107.7P463 I466Q419-P463 PolarHBondContact NE2-O 3.34Å; Q419-I466 HydrophobicContact CG-CB 4.14Å; Q419-I466 HydrophobicContact CG-CD1 4.21Å; Q419-I466 HydrophobicContact CG-CG2 4.29Å
420P50.8Low61Low34 Ų3458.6 Ų58.622%0.22129%0.293CS..  trans-66.1135.6148.918.7-6.8000105.3L415 C418 L422L415-P420 HydrophobicContact CD2-CB 4.5Å; L415-P420 HydrophobicContact CD2-CG 3.95Å; C418-P420 WeakPolarHBondContact O-CD 3.2Å; P420-L422 HydrophobicContact CB-CB 4.05Å; P420-L422 HydrophobicContact CB-CD1 3.84Å; P420-L422 HydrophobicContact CG-CB 4.29Å; P420-L422 HydrophobicContact CG-CD1 4.5Å; P420-L422 PolarHBondContact O-N 3.41Å
421Q48.2Very low58.3Low121 Ų12163.4 Ų63.457%0.56532%0.315SS*.SBendtrans-64.531.1169.2-64.9163-2100111.7Y423Q421-Y423 PolarHBondContact O-N 2.92Å
422L40.3Very low55.9Low41 Ų4166 Ų6622%0.21533%0.333CS..THydrogen-bonded Turntrans-68.9-12.7-177.4-125.484000112.5F22 V106 P420F22-L422 HydrophobicContact CB-CD2 4.44Å; V106-L422 HydrophobicContact CG1-CD1 4.11Å; P420-L422 HydrophobicContact CB-CB 4.05Å; P420-L422 HydrophobicContact CB-CD1 3.84Å; P420-L422 HydrophobicContact CG-CB 4.29Å; P420-L422 HydrophobicContact CG-CD1 4.5Å; P420-L422 PolarHBondContact O-N 3.41Å
423Y31.8Very low53.1Low142 Ų14271.9 Ų71.956%0.55736%0.36SS*.THydrogen-bonded Turntrans-121.8-3.7-173.9-70-79000114.3Q421 G425Q421-Y423 PolarHBondContact O-N 2.92Å; Y423-G425 PolarHBondContact O-N 3.37Å
424S37.8Very low50.7Low48 Ų4879.5 Ų79.534%0.33640%0.395SS..Hα-helixtrans-73.4-10.8-17264.20000114.5Q426 N428S424-Q426 VanDerWaalsContact C-N 3.28Å; S424-Q426 PolarHBondContact O-N 2.87Å; S424-N428 PolarHBondContact O-N 3.43Å
425G36.7Very low48.4Very low43 Ų4386.5 Ų86.544%0.44343%0.428SS..Hα-helixtrans-57.7-41176.800000112.5Y423Y423-G425 PolarHBondContact O-N 3.37Å
426Q30.7Very low46Very low131 Ų13191.9 Ų91.961%0.61246%0.457SS*.Hα-helixtrans-86.9-21.9-174.2-156.6160.519.500114S424 L430S424-Q426 VanDerWaalsContact C-N 3.28Å; S424-Q426 PolarHBondContact O-N 2.87Å; Q426-L430 WeakPolarHBondContact O-CG 3.45Å; Q426-L430 PolarHBondContact O-N 3.44Å
427W30.6Very low43.3Very low138 Ų13896.1 Ų96.152%0.52348%0.48SS..Hα-helixtrans-82.4-34.7-177.7-64.2105.4000113.1E429 L430 E431W427-E429 PolarHBondContact O-N 3.22Å; W427-L430 HydrophobicContact CE3-CD1 3.89Å; W427-L430 HydrophobicContact CZ3-CD1 3.96Å; W427-L430 PolarHBondContact O-N 3.49Å; W427-L430 VanDerWaalsContact O-N 3.17Å; W427-E431 PolarHBondContact O-N 3.04Å
428N34.8Very low40.7Very low107 Ų107102.9 Ų102.957%0.57252%0.516SS*.Hα-helixtrans-63.9-32.8174.4-71.72.1000111.1S424 S432S424-N428 PolarHBondContact O-N 3.43Å; N428-S432 VanDerWaalsContact O-CB 3.26Å; N428-S432 WeakPolarHBondContact O-CB 3.29Å; N428-S432 PolarHBondContact O-N 3.47Å; N428-S432 PolarHBondContact O-OG 3.18Å
429E39.2Very low38.4Very low128 Ų128109.7 Ų109.760%0.59854%0.543SS*.Hα-helixtrans-69.3-41.5173.1-74.1-176.2165.800111.8W427 S432 H433W427-E429 PolarHBondContact O-N 3.22Å; E429-S432 WeakPolarHBondContact CA-OG 2.9Å; E429-S432 PolarHBondContact O-N 3.04Å; E429-S432 PolarHBondContact O-OG 2.91Å; E429-H433 WeakPolarHBondContact O-CB 3.49Å; E429-H433 PolarHBondContact O-CD2 3.17Å; E429-H433 PolarHBondContact O-N 3.17Å
430L36.2Very low37.2Very low91 Ų91110.7 Ų110.748%0.47656%0.559SS.*Hα-helixtrans-67.9-41.7178.2-73.7168000113.1Q426 W427 S432 H433 E434Q426-L430 WeakPolarHBondContact O-CG 3.45Å; Q426-L430 PolarHBondContact O-N 3.44Å; W427-L430 HydrophobicContact CE3-CD1 3.89Å; W427-L430 HydrophobicContact CZ3-CD1 3.96Å; W427-L430 PolarHBondContact O-N 3.49Å; W427-L430 VanDerWaalsContact O-N 3.17Å; L430-S432 VanDerWaalsContact C-N 3.34Å; L430-H433 PolarHBondContact O-N 3.05Å; L430-E434 PolarHBondContact O-N 2.96Å
431E39.1Very low36.3Very low130 Ų130115.3 Ų115.361%0.60759%0.586SS**Hα-helixtrans-64.6-39.3172.9-89.8175.5162.400111.3W427 H433 E434 E435W427-E431 PolarHBondContact O-N 3.04Å; E431-H433 VanDerWaalsContact C-N 3.26Å; E431-H433 PolarHBondContact O-N 2.99Å; E431-E434 PolarHBondContact O-N 3.37Å; E431-E435 PolarHBondContact O-N 3.38Å; E431-E435 VanDerWaalsContact O-N 3.11Å
432S42.7Very low35.6Very low53 Ų53117.1 Ų117.137%0.37160%0.6SS.*Hα-helixtrans-67.9-26.8174.8770000113.1N428 E429 L430 N436N428-S432 VanDerWaalsContact O-CB 3.26Å; N428-S432 WeakPolarHBondContact O-CB 3.29Å; N428-S432 PolarHBondContact O-N 3.47Å; N428-S432 PolarHBondContact O-OG 3.18Å; E429-S432 WeakPolarHBondContact CA-OG 2.9Å; E429-S432 PolarHBondContact O-N 3.04Å; E429-S432 PolarHBondContact O-OG 2.91Å; L430-S432 VanDerWaalsContact C-N 3.34Å; S432-N436 WeakPolarHBondContact O-CB 3.38Å; S432-N436 PolarHBondContact O-N 3.2Å; S432-N436 PolarHBondContact O-ND2 3.15Å
433H35.8Very low35.3Very low124 Ų124124.6 Ų124.657%0.57463%0.633SS**Hα-helixtrans-77.4-36.4174.5-97.1-72.3000111.8E429 L430 E431 N436 L437E429-H433 WeakPolarHBondContact O-CB 3.49Å; E429-H433 PolarHBondContact O-CD2 3.17Å; E429-H433 PolarHBondContact O-N 3.17Å; L430-H433 PolarHBondContact O-N 3.05Å; E431-H433 VanDerWaalsContact C-N 3.26Å; E431-H433 PolarHBondContact O-N 2.99Å; H433-N436 PolarHBondContact O-N 3.05Å; H433-L437 WeakPolarHBondContact O-CD1 3.48Å; H433-L437 PolarHBondContact O-N 2.99Å
434E41.9Very low35.2Very low162 Ų162129.5 Ų129.576%0.75765%0.651SS**Hα-helixtrans-69.6-37.7176.7-111.8178.9173.500112.7L430 E431 N436L430-E434 PolarHBondContact O-N 2.96Å; E431-E434 PolarHBondContact O-N 3.37Å; E434-N436 VanDerWaalsContact C-N 3.3Å; E434-N436 PolarHBondContact O-N 3.42Å
435E42.4Very low34.8Very low171 Ų171134.7 Ų134.780%0.79967%0.674SS**Hα-helixtrans-71.2-22.7175.7-76.9-168.2160.500113.5E431E431-E435 PolarHBondContact O-N 3.38Å; E431-E435 VanDerWaalsContact O-N 3.11Å
436N36Very low34.5Very low126 Ų126139.5 Ų139.567%0.67469%0.69SS**Hα-helixtrans-94.3-3.2-179.4-75.6-48.5000114.7S432 H433 E434 N438S432-N436 WeakPolarHBondContact O-CB 3.38Å; S432-N436 PolarHBondContact O-N 3.2Å; S432-N436 PolarHBondContact O-ND2 3.15Å; H433-N436 PolarHBondContact O-N 3.05Å; E434-N436 VanDerWaalsContact C-N 3.3Å; E434-N436 PolarHBondContact O-N 3.42Å; N436-N438 PolarHBondContact O-N 3.4Å
437L32.5Very low34.4Very low102 Ų102141.1 Ų141.153%0.53470%0.703SS.*  trans-78.676166.7-95.9112.2000110H433 F439H433-L437 WeakPolarHBondContact O-CD1 3.48Å; H433-L437 PolarHBondContact O-N 2.99Å; L437-F439 HydrophobicContact CB-CD2 4.48Å; L437-F439 HydrophobicContact CB-CE2 4.16Å; L437-F439 HydrophobicContact CD2-CE1 4.31Å; L437-F439 HydrophobicContact CD2-CE2 4.47Å; L437-F439 HydrophobicContact CD2-CZ 4.09Å; L437-F439 VanDerWaalsContact O-CD2 3.3Å; L437-F439 WeakPolarHBondContact O-CD2 3.48Å; L437-F439 PolarHBondContact O-N 3.21Å
438N31.8Very low34.4Very low145 Ų145143 Ų14378%0.77572%0.717SS**  trans-61.488.5156.3-80.6-32.5000108N436 P440N436-N438 PolarHBondContact O-N 3.4Å; N438-P440 VanDerWaalsContact O-CD 3.26Å; N438-P440 WeakPolarHBondContact O-CD 3.43Å; N438-P440 VanDerWaalsContact O-N 3.14Å
439F28.4Very low34.1Very low166 Ų166146.7 Ų146.773%0.72873%0.728SS**  trans-55.2117.7172-77.1-84.8000108.7L437 T441L437-F439 HydrophobicContact CB-CD2 4.48Å; L437-F439 HydrophobicContact CB-CE2 4.16Å; L437-F439 HydrophobicContact CD2-CE1 4.31Å; L437-F439 HydrophobicContact CD2-CE2 4.47Å; L437-F439 HydrophobicContact CD2-CZ 4.09Å; L437-F439 VanDerWaalsContact O-CD2 3.3Å; L437-F439 WeakPolarHBondContact O-CD2 3.48Å; L437-F439 PolarHBondContact O-N 3.21Å; F439-T441 PolarHBondContact O-N 2.88Å
440P32.9Very low33.5Very low122 Ų122147 Ų14779%0.79274%0.738SS**  trans-61.6114.1173.3-15.328.7000107.6N438 D442N438-P440 VanDerWaalsContact O-CD 3.26Å; N438-P440 WeakPolarHBondContact O-CD 3.43Å; N438-P440 VanDerWaalsContact O-N 3.14Å; P440-D442 VanDerWaalsContact C-N 3.28Å; P440-D442 PolarHBondContact O-N 2.97Å
441T32.6Very low33.1Very low131 Ų131149 Ų14980%0.80475%0.748SS**SBendtrans-60.894.1163.234.70000107.9F439F439-T441 PolarHBondContact O-N 2.88Å
442D34.4Very low32.6Very low158 Ų158152.7 Ų152.785%0.84576%0.756SS**  trans176.582.5146.4-88-22.1000109.6P440P440-D442 VanDerWaalsContact C-N 3.28Å; P440-D442 PolarHBondContact O-N 2.97Å
443E33.5Very low31.9Very low198 Ų198158 Ų15893%0.92578%0.776SS**  trans-17373.2142.7-106-179.8-173.900107.6
444R29.2Very low31.6Very low246 Ų246156.1 Ų156.193%0.92877%0.773SS**  trans-72.6136.4168.8-85.6-179.7171.5169.2-0.8109
445L30.2Very low31.2Very low156 Ų156153.8 Ų153.882%0.81777%0.765SS**SBendtrans88.286.5155.5-137.183.2000115.1
446N29.5Very low30.8Very low144 Ų144153.4 Ų153.477%0.7776%0.764SS**  -176.92.9129.5-92.8-10000117E448N446-E448 PolarHBondContact O-N 2.73Å
447N29.4Very low30.9Very low165 Ų165150.9 Ų150.988%0.88276%0.76SS**SBendtrans-94.691.8172.1-71.1-7.1000110.3K449N447-K449 PolarHBondContact O-N 3.35Å
448E30.4Very low31Very low178 Ų178151.8 Ų151.883%0.83276%0.762SS**  trans-17.4118.7159.4-161158.8-166.500112.3N446 V450N446-E448 PolarHBondContact O-N 2.73Å; E448-V450 VanDerWaalsContact C-N 3.34Å; E448-V450 PolarHBondContact O-N 2.74Å
449K28Very low31Very low185 Ų185149.7 Ų149.780%0.80475%0.75SS**  trans-5496.5179.2-70.2173.5174.2175.50109.1N447 I451N447-K449 PolarHBondContact O-N 3.35Å; K449-I451 HydrophobicContact CB-CG1 3.96Å; K449-I451 PolarHBondContact O-N 3.45Å
450V27.8Very low31.3Very low134 Ų134147.6 Ų147.681%0.81275%0.746SS**  trans-67.481.1156.3-179.20000105.4E448 R452E448-V450 VanDerWaalsContact C-N 3.34Å; E448-V450 PolarHBondContact O-N 2.74Å; V450-R452 HydrophobicContact CG1-CB 4.42Å; V450-R452 PolarHBondContact O-N 2.71Å
451I27.7Very low31.7Very low132 Ų132149.8 Ų149.868%0.67775%0.746SS**  trans-68.187.4163.4-58.4177000104.1K449 E453K449-I451 HydrophobicContact CB-CG1 3.96Å; K449-I451 PolarHBondContact O-N 3.45Å; I451-E453 VanDerWaalsContact C-N 3.29Å; I451-E453 PolarHBondContact O-N 2.68Å
452R27.3Very low32Very low208 Ų208150.6 Ų150.679%0.78573%0.734SS**  trans-70.996.5169.5-157.3176.6-172.9-173.20105V450 T454V450-R452 HydrophobicContact CG1-CB 4.42Å; V450-R452 PolarHBondContact O-N 2.71Å; R452-T454 PolarHBondContact O-N 2.76Å
453E28.1Very low32.8Very low166 Ų166145.8 Ų145.878%0.77671%0.712SS**  trans-57.394.4166.9-75.5-179.3159.600107.3I451 N455I451-E453 VanDerWaalsContact C-N 3.29Å; I451-E453 PolarHBondContact O-N 2.68Å; E453-N455 PolarHBondContact O-N 2.95Å
454T29.1Very low33.8Very low84 Ų84141.6 Ų141.652%0.51569%0.692SS.*  trans-68.1102168.244.30000106.5R452 E456R452-T454 PolarHBondContact O-N 2.76Å; T454-E456 PolarHBondContact O-N 3.4Å
455N33.2Very low35.5Very low112 Ų112132.1 Ų132.160%0.59966%0.663SS**  trans-50.6131.4173.3-78.8-30.3000109E453 A457 E458E453-N455 PolarHBondContact O-N 2.95Å; N455-A457 PolarHBondContact O-N 3.44Å; N455-E458 PolarHBondContact O-N 2.82Å
456E35.2Very low37.6Very low164 Ų164125.4 Ų125.477%0.76663%0.628SS**Hα-helixtrans-52-17.9176.7-74.8-177.5143.100113.5T454 N460T454-E456 PolarHBondContact O-N 3.4Å; E456-N460 PolarHBondContact O-N 3.11Å; E456-N460 PolarHBondContact O-ND2 3.28Å
457A37.3Very low39.8Very low72 Ų72118.6 Ų118.660%0.59559%0.592SS**Hα-helixtrans-63.9-39.2172.200000113.3N455N455-A457 PolarHBondContact O-N 3.44Å
458E35.7Very low42.2Very low122 Ų122116.6 Ų116.657%0.5757%0.572SS**Hα-helixtrans-77.6-32.6179.6-69.9-175.3166.500111.8N455 N460 E461N455-E458 PolarHBondContact O-N 2.82Å; E458-N460 VanDerWaalsContact C-N 3.25Å; E458-N460 PolarHBondContact O-N 3.3Å; E458-E461 PolarHBondContact O-N 2.71Å
459L31.6Very low44.7Very low100 Ų100108.9 Ų108.952%0.52454%0.536SS..Hα-helixtrans-65.8-26.9174.7-104123.3000113E461 W462L459-E461 VanDerWaalsContact C-N 3.33Å; L459-W462 VanDerWaalsContact O-CD1 3.29Å
460N34.6Very low47.3Very low123 Ų123103 Ų10366%0.65851%0.511SS*.THydrogen-bonded Turntrans-78.4-14176.9-76.8-42.9000113.9E456 E458 W462E456-N460 PolarHBondContact O-N 3.11Å; E456-N460 PolarHBondContact O-ND2 3.28Å; E458-N460 VanDerWaalsContact C-N 3.25Å; E458-N460 PolarHBondContact O-N 3.3Å; N460-W462 PolarHBondContact O-N 2.76Å
461E40.3Very low49.7Very low168 Ų168101.5 Ų101.579%0.78551%0.506SS*.THydrogen-bonded Turntrans-79.1-1174.4-73.8-167152.100113.5E458 L459E458-E461 PolarHBondContact O-N 2.71Å; L459-E461 VanDerWaalsContact C-N 3.33Å
462W39.2Very low52.2Low147 Ų14798.6 Ų98.656%0.55750%0.502SS*.SBendtrans-64.7133.7178.2-81.560.8000112.3L459 N460 H464 S465L459-W462 VanDerWaalsContact O-CD1 3.29Å; N460-W462 PolarHBondContact O-N 2.76Å; W462-H464 AromaticContact CE3-CD2 3.85Å; W462-H464 PolarHBondContact O-N 2.76Å; W462-S465 PolarHBondContact O-N 2.67Å; W462-S465 PolarHBondContact O-OG 3.44Å
463P52.6Low54.7Low58 Ų5892.3 Ų92.338%0.37748%0.481SS..G310 helixtrans-60.1-13.2-174.519.4-30.2000114.9Q419 S465 I466Q419-P463 PolarHBondContact NE2-O 3.34Å; P463-S465 PolarHBondContact O-N 2.84Å; P463-I466 HydrophobicContact CB-CD1 4.19Å; P463-I466 WeakPolarHBondContact O-CD1 3.21Å; P463-I466 WeakPolarHBondContact O-CG1 3.43Å; P463-I466 PolarHBondContact O-N 3.39Å
464H53.1Low56.9Low110 Ų11090.7 Ų90.751%0.50947%0.467SS..G310 helixtrans-66.8-9.9176.3-61.5-73.8000114.7W462 R468W462-H464 AromaticContact CE3-CD2 3.85Å; W462-H464 PolarHBondContact O-N 2.76Å; H464-R468 WeakPolarHBondContact O-CD 3.32Å; H464-R468 PolarHBondContact O-NE 2.85Å; H464-R468 VanDerWaalsContact O-NE 3.14Å
465S65.7Low59.3Low46 Ų4693.1 Ų93.132%0.32247%0.473SS..G310 helixtrans-83.4-16.9176.963.90000114W462 P463 G467 R468W462-S465 PolarHBondContact O-N 2.67Å; W462-S465 PolarHBondContact O-OG 3.44Å; P463-S465 PolarHBondContact O-N 2.84Å; S465-G467 PolarHBondContact O-N 3.48Å; S465-R468 VanDerWaalsContact O-CB 3.31Å; S465-R468 WeakPolarHBondContact O-CB 3.16Å; S465-R468 PolarHBondContact O-N 3.09Å
466I73.6Confident61.5Low15 Ų1590.7 Ų90.78%0.07746%0.459CS..THydrogen-bonded Turntrans-60.6130-172.9-61.6164.6000111.1Q419 P463 R468 N544Q419-I466 HydrophobicContact CG-CB 4.14Å; Q419-I466 HydrophobicContact CG-CD1 4.21Å; Q419-I466 HydrophobicContact CG-CG2 4.29Å; P463-I466 HydrophobicContact CB-CD1 4.19Å; P463-I466 WeakPolarHBondContact O-CD1 3.21Å; P463-I466 WeakPolarHBondContact O-CG1 3.43Å; P463-I466 PolarHBondContact O-N 3.39Å; I466-R468 PolarHBondContact O-N 3.14Å; I466-N544 HydrophobicContact CD1-CB 3.93Å; I466-N544 HydrophobicContact CG1-CB 4.1Å; I466-N544 HydrophobicContact CG2-CB 3.87Å
467G75.6Confident63.2Low1 Ų186.9 Ų86.91%0.0145%0.449CS..THydrogen-bonded Turntrans72.92.1179.400000114.6Y417 S465 G485 H541 E542Y417-G467 WeakPolarHBondContact O-CA 3.45Å; S465-G467 PolarHBondContact O-N 3.48Å; G467-G485 PolarHBondContact O-N 2.76Å; G467-H541 PolarHBondContact O-CD2 3.39Å; G467-H541 VanDerWaalsContact O-CD2 3.31Å; G467-E542 WeakPolarHBondContact CA-O 3.43Å; G467-E542 PolarHBondContact N-O 3.44Å
468R80.1Confident65Low123 Ų12390.7 Ų90.746%0.46446%0.458SS..SBendtrans-80.3156.4170.3-67.2-173.4174.9-173.3-2.4110.7H464 S465 I466 P484 H541 E542H464-R468 WeakPolarHBondContact O-CD 3.32Å; H464-R468 PolarHBondContact O-NE 2.85Å; H464-R468 VanDerWaalsContact O-NE 3.14Å; S465-R468 VanDerWaalsContact O-CB 3.31Å; S465-R468 WeakPolarHBondContact O-CB 3.16Å; S465-R468 PolarHBondContact O-N 3.09Å; I466-R468 PolarHBondContact O-N 3.14Å; R468-P484 HydrophobicContact CG-CB 3.9Å; R468-P484 HydrophobicContact CG-CG 3.79Å; R468-H541 CarbonylContact O-C 3.6Å; R468-H541 WeakPolarHBondContact O-CA 3.37Å; R468-E542 PolarHBondContact O-N 3.11Å
469L82.4Confident66.9Low16 Ų1686.2 Ų86.28%0.08444%0.438CS..BIsolated β-bridgetrans-64.9133172.4-168.467.8000109.9F473 L479 L540L469-F473 HydrophobicContact CD1-CB 4.21Å; L469-F473 HydrophobicContact CD2-CB 4.25Å; L469-F473 WeakPolarHBondContact CD2-O 3.41Å; L469-F473 HydrophobicContact CG-CB 4.08Å; L469-L479 HydrophobicContact CD1-CB 4.08Å; L469-L479 HydrophobicContact CD1-CD1 4.07Å; L469-L479 HydrophobicContact CD2-CB 3.73Å; L469-L479 HydrophobicContact CG-CB 4.49Å; L469-L540 HydrophobicContact CD1-CB 3.71Å
470K84.1Confident68.8Low62 Ų6288.6 Ų88.627%0.2744%0.44SS..PPolyproline II helixtrans-53142.9175.8-76.9172.1177.4173.10111A472 F473 F539 L540 E542K470-A472 VanDerWaalsContact C-N 3.26Å; K470-A472 PolarHBondContact O-N 3.49Å; K470-A472 VanDerWaalsContact O-N 3.16Å; K470-F473 HydrophobicContact CB-CD2 4.06Å; K470-F473 PolarHBondContact O-N 2.87Å; K470-F539 WeakPolarHBondContact CE-O 3.46Å; K470-F539 PolarHBondContact NZ-O 3.28Å; K470-L540 VanDerWaalsContact CB-O 3.3Å; K470-L540 WeakPolarHBondContact CB-O 3.17Å; K470-L540 VanDerWaalsContact CG-O 3.23Å; K470-L540 WeakPolarHBondContact CG-O 3.26Å; K470-L540 PolarHBondContact N-O 3.11Å; K470-E542 HydrophobicContact CG-CG 3.92Å; K470-E542 WeakPolarHBondContact CG-OE1 3.32Å
471S77.5Confident70.6Confident102 Ų10289.1 Ų89.171%0.71344%0.442SS*.G310 helixtrans-52.3-41.4-175.756.30000113.2F473 R474S471-F473 PolarHBondContact O-N 3.37Å; S471-R474 WeakPolarHBondContact O-CB 3.42Å; S471-R474 PolarHBondContact O-N 2.96Å
472A80Confident72.1Confident72 Ų7282.9 Ų82.960%0.59542%0.418SS*.G310 helixtrans-58.7-28.1178.400000114.4K470 H475K470-A472 VanDerWaalsContact C-N 3.26Å; K470-A472 PolarHBondContact O-N 3.49Å; K470-A472 VanDerWaalsContact O-N 3.16Å; A472-H475 PolarHBondContact O-ND1 3.49Å
473F79.8Confident73.9Confident76 Ų7679.8 Ų79.833%0.33342%0.415SS..G310 helixtrans-104.58.3-175.2-61.1-79.5000113.4L469 K470 S471 H475 L476 L540L469-F473 HydrophobicContact CD1-CB 4.21Å; L469-F473 HydrophobicContact CD2-CB 4.25Å; L469-F473 WeakPolarHBondContact CD2-O 3.41Å; L469-F473 HydrophobicContact CG-CB 4.08Å; K470-F473 HydrophobicContact CB-CD2 4.06Å; K470-F473 PolarHBondContact O-N 2.87Å; S471-F473 PolarHBondContact O-N 3.37Å; F473-H475 PolarHBondContact O-N 3.24Å; F473-L476 HydrophobicContact CB-CD1 4.49Å; F473-L476 PolarHBondContact O-N 3.02Å; F473-L540 HydrophobicContact CD1-CD2 3.8Å; F473-L540 HydrophobicContact CD2-CD2 3.68Å; F473-L540 HydrophobicContact CE1-CD2 3.72Å; F473-L540 HydrophobicContact CE2-CD2 3.6Å; F473-L540 HydrophobicContact CG-CD2 3.77Å; F473-L540 HydrophobicContact CZ-CD2 3.61Å
474R74.9Confident75.1Confident131 Ų13180.3 Ų80.349%0.49442%0.418SS..THydrogen-bonded Turntrans-63-8.5-179.1-160.8178.8-103-168.9-3114.1S471 L476 R480S471-R474 WeakPolarHBondContact O-CB 3.42Å; S471-R474 PolarHBondContact O-N 2.96Å; R474-L476 PolarHBondContact O-N 3.07Å; R474-R480 HydrophobicContact CG-CG 4.19Å
475H78.6Confident76.4Confident135 Ų13575.1 Ų75.163%0.62539%0.394SS*.THydrogen-bonded Turntrans-70.2-15.4171.567.2-90.6000113.8A472 F473 P477A472-H475 PolarHBondContact O-ND1 3.49Å; F473-H475 PolarHBondContact O-N 3.24Å; H475-P477 WeakPolarHBondContact O-CD 3.31Å
476L79Confident77.4Confident61 Ų6180 Ų8032%0.31941%0.406SS..  trans-86.2103.8177.9-64.1172000110.5F473 R474 I478 L479 R480 L540F473-L476 HydrophobicContact CB-CD1 4.49Å; F473-L476 PolarHBondContact O-N 3.02Å; R474-L476 PolarHBondContact O-N 3.07Å; L476-I478 PolarHBondContact O-N 2.83Å; L476-L479 HydrophobicContact CB-CB 4.5Å; L476-L479 HydrophobicContact CB-CD1 4.45Å; L476-L479 HydrophobicContact CD1-CD1 3.96Å; L476-L479 PolarHBondContact O-N 3.05Å; L476-R480 WeakPolarHBondContact O-CB 3.34Å; L476-R480 PolarHBondContact O-N 3.5Å; L476-R480 VanDerWaalsContact O-N 3.16Å; L476-L540 HydrophobicContact CD1-CD1 4.26Å
477P72.5Confident78.1Confident84 Ų8479.7 Ų79.755%0.54541%0.406SS..Hα-helixtrans-64.8-42.8-170.624.3-33000112.7H475 L479 R480 D481H475-P477 WeakPolarHBondContact O-CD 3.31Å; P477-L479 PolarHBondContact O-N 2.84Å; P477-R480 PolarHBondContact O-N 3.29Å; P477-R480 VanDerWaalsContact O-N 3.11Å; P477-D481 PolarHBondContact O-N 3.3Å
478I75.3Confident78.8Confident152 Ų15279.7 Ų79.778%0.77941%0.406SS*.Hα-helixtrans-57.9-36.9-177.5-63.6166.1000112.2L476L476-I478 PolarHBondContact O-N 2.83Å
479L75.5Confident79.3Confident29 Ų2976.4 Ų76.415%0.15240%0.397CS..Hα-helixtrans-85.8-29.1-179.4-65.1177.8000112.2L469 L476 P477 A487 I537 L540L469-L479 HydrophobicContact CD1-CB 4.08Å; L469-L479 HydrophobicContact CD1-CD1 4.07Å; L469-L479 HydrophobicContact CD2-CB 3.73Å; L469-L479 HydrophobicContact CG-CB 4.49Å; L476-L479 HydrophobicContact CB-CB 4.5Å; L476-L479 HydrophobicContact CB-CD1 4.45Å; L476-L479 HydrophobicContact CD1-CD1 3.96Å; L476-L479 PolarHBondContact O-N 3.05Å; P477-L479 PolarHBondContact O-N 2.84Å; L479-A487 HydrophobicContact CD2-CB 4.47Å; L479-I537 HydrophobicContact CD2-CG2 4Å; L479-L540 HydrophobicContact CD1-CD1 4.12Å
480R70.1Confident79.7Confident149 Ų14979.3 Ų79.356%0.56241%0.412SS*.Hα-helixtrans-66.9-40.2-179.9-178.7-175.8175.7-178-3.9112.5R474 L476 P477 S482R474-R480 HydrophobicContact CG-CG 4.19Å; L476-R480 WeakPolarHBondContact O-CB 3.34Å; L476-R480 PolarHBondContact O-N 3.5Å; L476-R480 VanDerWaalsContact O-N 3.16Å; P477-R480 PolarHBondContact O-N 3.29Å; P477-R480 VanDerWaalsContact O-N 3.11Å; R480-S482 PolarHBondContact O-N 3.11Å
481D72Confident80.2Confident134 Ų13476.7 Ų76.772%0.71740%0.401SS*.THydrogen-bonded Turntrans-78.4-6.1-174.4-62.1-21.2000113.1P477P477-D481 PolarHBondContact O-N 3.3Å
482S73.1Confident81.1Confident38 Ų3872 Ų7227%0.26637%0.368SS..SBendtrans-75138.1178.1-1640000111.4R480 A487R480-S482 PolarHBondContact O-N 3.11Å; S482-A487 PolarHBondContact OG-N 3.43Å
483T76.5Confident81.8Confident81 Ų8172.7 Ų72.750%0.49736%0.361SS..PPolyproline II helixtrans-56.9140.3172.151.90000110.2G485 R486T483-G485 PolarHBondContact O-N 3.18Å; T483-R486 WeakPolarHBondContact O-CB 3.5Å; T483-R486 PolarHBondContact O-N 3.03Å; T483-R486 WeakPolarHBondContact OG1-CB 3.47Å; T483-R486 VanDerWaalsContact OG1-CD 3.24Å; T483-R486 WeakPolarHBondContact OG1-CD 3.47Å
484P77.3Confident82.6Confident69 Ų6972.2 Ų72.245%0.44836%0.362SS..THydrogen-bonded Turntrans-49.2130.2-178.5-25.131.6000112.3R468 R486R468-P484 HydrophobicContact CG-CB 3.9Å; R468-P484 HydrophobicContact CG-CG 3.79Å; P484-R486 VanDerWaalsContact C-N 3.25Å; P484-R486 PolarHBondContact O-N 3.32Å
485G81.4Confident83.7Confident1 Ų166.9 Ų66.91%0.0134%0.342CS..THydrogen-bonded Turntrans81.5-19.2179.500000115.9Y417 C418 G467 T483 P488 I489Y417-G485 VanDerWaalsContact O-CA 3.23Å; Y417-G485 WeakPolarHBondContact O-CA 3.4Å; C418-G485 VanDerWaalsContact SG-CA 3.6Å; G467-G485 PolarHBondContact O-N 2.76Å; T483-G485 PolarHBondContact O-N 3.18Å; G485-P488 VanDerWaalsContact C-CD 3.48Å; G485-P488 VanDerWaalsContact O-CD 3.29Å; G485-P488 WeakPolarHBondContact O-CD 3.33Å; G485-P488 VanDerWaalsContact O-CG 3.26Å; G485-P488 WeakPolarHBondContact O-CG 3.14Å; G485-I489 WeakPolarHBondContact O-CG1 3.43Å; G485-I489 PolarHBondContact O-N 3.49Å; G485-I489 VanDerWaalsContact O-N 3.11Å
486R85.5Confident84.6Confident148 Ų14861.4 Ų61.456%0.55832%0.318SS*.Hα-helixtrans-68.8-45.4-178.7-175.1178.6-179.7-178.9-0.5112.8T483 P484 I489 I490T483-R486 WeakPolarHBondContact O-CB 3.5Å; T483-R486 PolarHBondContact O-N 3.03Å; T483-R486 WeakPolarHBondContact OG1-CB 3.47Å; T483-R486 VanDerWaalsContact OG1-CD 3.24Å; T483-R486 WeakPolarHBondContact OG1-CD 3.47Å; P484-R486 VanDerWaalsContact C-N 3.25Å; P484-R486 PolarHBondContact O-N 3.32Å; R486-I489 PolarHBondContact O-N 2.8Å; R486-I490 HydrophobicContact CG-CD1 3.8Å; R486-I490 HydrophobicContact CG-CG1 4.4Å; R486-I490 VanDerWaalsContact O-CG1 3.32Å; R486-I490 WeakPolarHBondContact O-CG1 3.36Å; R486-I490 PolarHBondContact O-N 3.01Å
487A88.5Confident85.4Confident9 Ų963.4 Ų63.47%0.07433%0.328CS..Hα-helixtrans-57.9-48.5176.200000113.1L479 S482 I490 S491 H541L479-A487 HydrophobicContact CD2-CB 4.47Å; S482-A487 PolarHBondContact OG-N 3.43Å; A487-I490 PolarHBondContact O-N 2.76Å; A487-S491 WeakPolarHBondContact O-CB 3.45Å; A487-S491 PolarHBondContact O-N 2.72Å; A487-S491 PolarHBondContact O-OG 3.41Å; A487-H541 WeakPolarHBondContact CB-NE2 3.33Å
488P90.9Very high86.6Confident2 Ų260 Ų601%0.01331%0.305CS..Hα-helixtrans-67.2-34.4176.921.7-30.8000113.1Y417 G485 S491 L492 M538 H541Y417-P488 HydrophobicContact CD1-CB 3.93Å; Y417-P488 HydrophobicContact CD1-CG 4.12Å; Y417-P488 HydrophobicContact CD2-CB 4.33Å; Y417-P488 HydrophobicContact CG-CB 3.78Å; Y417-P488 HydrophobicContact CG-CG 4.11Å; G485-P488 VanDerWaalsContact C-CD 3.48Å; G485-P488 VanDerWaalsContact O-CD 3.29Å; G485-P488 WeakPolarHBondContact O-CD 3.33Å; G485-P488 VanDerWaalsContact O-CG 3.26Å; G485-P488 WeakPolarHBondContact O-CG 3.14Å; P488-S491 PolarHBondContact O-N 2.64Å; P488-L492 WeakPolarHBondContact O-CB 3.32Å; P488-L492 PolarHBondContact O-N 3.46Å; P488-M538 HydrophobicContact CB-CG 4.15Å; P488-H541 HydrophobicContact CB-CB 4.42Å; P488-H541 HydrophobicContact CG-CB 4.2Å
489I90.5Very high87.7Confident53 Ų5352.7 Ų52.727%0.27227%0.268SS..Hα-helixtrans-63.4-48.5172.4-69.2168.5000111.3C418 G485 R486 S491 L492 L493C418-I489 HydrophobicContact CB-CD1 4.45Å; C418-I489 WeakPolarHBondContact SG-CD1 3.35Å; G485-I489 WeakPolarHBondContact O-CG1 3.43Å; G485-I489 PolarHBondContact O-N 3.49Å; G485-I489 VanDerWaalsContact O-N 3.11Å; R486-I489 PolarHBondContact O-N 2.8Å; I489-S491 PolarHBondContact O-N 3.37Å; I489-L492 WeakPolarHBondContact O-CB 3.34Å; I489-L492 PolarHBondContact O-N 2.85Å; I489-L492 VanDerWaalsContact O-N 3.12Å; I489-L493 HydrophobicContact CG2-CD1 4.13Å; I489-L493 HydrophobicContact CG2-CG 4.36Å; I489-L493 WeakPolarHBondContact O-CG 3.42Å; I489-L493 PolarHBondContact O-N 2.95Å
490I91.6Very high88.6Confident78 Ų7855.4 Ų55.440%0.428%0.279SS..Hα-helixtrans-59.8-40.7178.9-69.3170.5000109.6R486 A487 L493 L494R486-I490 HydrophobicContact CG-CD1 3.8Å; R486-I490 HydrophobicContact CG-CG1 4.4Å; R486-I490 VanDerWaalsContact O-CG1 3.32Å; R486-I490 WeakPolarHBondContact O-CG1 3.36Å; R486-I490 PolarHBondContact O-N 3.01Å; A487-I490 PolarHBondContact O-N 2.76Å; I490-L493 PolarHBondContact O-N 3.47Å; I490-L494 HydrophobicContact CG2-CD1 3.78Å; I490-L494 HydrophobicContact CG2-CG 4.29Å; I490-L494 WeakPolarHBondContact O-CB 3.39Å; I490-L494 VanDerWaalsContact O-CG 3.3Å; I490-L494 WeakPolarHBondContact O-CG 3.49Å; I490-L494 PolarHBondContact O-N 3.37Å
491S94Very high89.8Confident6 Ų648.8 Ų48.84%0.04226%0.257CS..Hα-helixtrans-63.3-41.4175.9-55.80000111.8A487 P488 I489 L494 Y495 F534 I537A487-S491 WeakPolarHBondContact O-CB 3.45Å; A487-S491 PolarHBondContact O-N 2.72Å; A487-S491 PolarHBondContact O-OG 3.41Å; P488-S491 PolarHBondContact O-N 2.64Å; I489-S491 PolarHBondContact O-N 3.37Å; S491-L494 PolarHBondContact O-N 3.11Å; S491-Y495 WeakPolarHBondContact O-CB 3.32Å; S491-Y495 PolarHBondContact O-N 2.97Å; S491-F534 WeakPolarHBondContact O-CB 3.47Å; S491-I537 WeakPolarHBondContact OG-CG2 3.24Å
492L95.5Very high91Very high5 Ų542.9 Ų42.93%0.02623%0.225CC..Hα-helixtrans-61.5-45.3175.2-179.865.6000111.6M410 C413 I414 P488 I489 Y495 T496 M538M410-L492 HydrophobicContact CB-CD2 4.09Å; M410-L492 HydrophobicContact CG-CD1 4.45Å; M410-L492 HydrophobicContact CG-CD2 4.38Å; M410-L492 HydrophobicContact CG-CG 4.47Å; C413-L492 HydrophobicContact CB-CD1 4.08Å; C413-L492 HydrophobicContact CB-CD2 3.7Å; C413-L492 HydrophobicContact CB-CG 4.5Å; I414-L492 HydrophobicContact CD1-CD2 4.42Å; I414-L492 HydrophobicContact CG1-CD2 3.86Å; P488-L492 WeakPolarHBondContact O-CB 3.32Å; P488-L492 PolarHBondContact O-N 3.46Å; I489-L492 WeakPolarHBondContact O-CB 3.34Å; I489-L492 PolarHBondContact O-N 2.85Å; I489-L492 VanDerWaalsContact O-N 3.12Å; L492-Y495 WeakPolarHBondContact O-CB 3.48Å; L492-Y495 PolarHBondContact O-N 3.28Å; L492-T496 WeakPolarHBondContact O-CG2 3.18Å; L492-T496 PolarHBondContact O-N 3.03Å; L492-M538 HydrophobicContact CB-SD 3.93Å; L492-M538 HydrophobicContact CD1-SD 4.16Å
493L95.2Very high92Very high86 Ų8641.1 Ų41.145%0.4521%0.213SC..Hα-helixtrans-63.5-46.7177.5-67174.8000111.4M410 I489 I490 Y495 T496 I497M410-L493 HydrophobicContact CE-CD2 3.99Å; I489-L493 HydrophobicContact CG2-CD1 4.13Å; I489-L493 HydrophobicContact CG2-CG 4.36Å; I489-L493 WeakPolarHBondContact O-CG 3.42Å; I489-L493 PolarHBondContact O-N 2.95Å; I490-L493 PolarHBondContact O-N 3.47Å; L493-Y495 VanDerWaalsContact C-N 3.33Å; L493-Y495 PolarHBondContact O-N 2.77Å; L493-T496 PolarHBondContact O-N 2.91Å; L493-T496 VanDerWaalsContact O-N 3.17Å; L493-T496 PolarHBondContact O-OG1 3.17Å; L493-I497 PolarHBondContact O-N 3.47Å
494L97Very high92.7Very high66 Ų6638.8 Ų38.835%0.34620%0.2SC..Hα-helixtrans-65.9-37177.4-66.6173.1000111.9I490 S491 T496 I497 C498 F534I490-L494 HydrophobicContact CG2-CD1 3.78Å; I490-L494 HydrophobicContact CG2-CG 4.29Å; I490-L494 WeakPolarHBondContact O-CB 3.39Å; I490-L494 VanDerWaalsContact O-CG 3.3Å; I490-L494 WeakPolarHBondContact O-CG 3.49Å; I490-L494 PolarHBondContact O-N 3.37Å; S491-L494 PolarHBondContact O-N 3.11Å; L494-T496 VanDerWaalsContact C-N 3.33Å; L494-T496 PolarHBondContact O-N 3.4Å; L494-I497 HydrophobicContact CD2-CD1 4.4Å; L494-I497 PolarHBondContact O-N 2.9Å; L494-C498 PolarHBondContact O-N 3.31Å; L494-C498 PolarHBondContact O-SG 3.29Å; L494-C498 VanDerWaalsContact O-SG 3.35Å; L494-F534 HydrophobicContact CB-CD1 4.02Å; L494-F534 HydrophobicContact CB-CD2 3.69Å; L494-F534 HydrophobicContact CB-CE1 3.79Å; L494-F534 HydrophobicContact CB-CE2 3.46Å; L494-F534 VanDerWaalsContact CB-CE2 3.46Å; L494-F534 HydrophobicContact CB-CG 4Å; L494-F534 HydrophobicContact CB-CZ 3.53Å; L494-F534 HydrophobicContact CD1-CD1 4.2Å; L494-F534 HydrophobicContact CD1-CE1 3.42Å; L494-F534 VanDerWaalsContact CD1-CE1 3.42Å; L494-F534 HydrophobicContact CD1-CE2 4.36Å; L494-F534 HydrophobicContact CD1-CZ 3.53Å; L494-F534 HydrophobicContact CG-CE1 4.25Å; L494-F534 HydrophobicContact CG-CE2 4.46Å; L494-F534 HydrophobicContact CG-CZ 4.09Å
495Y97.8Very high93.5Very high19 Ų1936.4 Ų36.48%0.07518%0.183CC..Hα-helixtrans-58.1-45170.9172.6-94.2000111.3S491 L492 L493 I497 C498 A499 A531 V535 C560 V563S491-Y495 WeakPolarHBondContact O-CB 3.32Å; S491-Y495 PolarHBondContact O-N 2.97Å; L492-Y495 WeakPolarHBondContact O-CB 3.48Å; L492-Y495 PolarHBondContact O-N 3.28Å; L493-Y495 VanDerWaalsContact C-N 3.33Å; L493-Y495 PolarHBondContact O-N 2.77Å; Y495-I497 VanDerWaalsContact C-N 3.26Å; Y495-I497 PolarHBondContact O-N 3.39Å; Y495-C498 PolarHBondContact O-N 2.87Å; Y495-C498 VanDerWaalsContact O-N 3.15Å; Y495-A499 HydrophobicContact CD1-CB 4.48Å; Y495-A499 HydrophobicContact CE1-CB 4Å; Y495-A499 VanDerWaalsContact O-CB 3.32Å; Y495-A499 WeakPolarHBondContact O-CB 3.3Å; Y495-A499 PolarHBondContact O-N 3.47Å; Y495-A531 HydrophobicContact CD2-CB 4.03Å; Y495-A531 WeakPolarHBondContact CD2-O 3.44Å; Y495-A531 HydrophobicContact CE2-CB 3.91Å; Y495-V535 HydrophobicContact CD2-CG2 3.6Å; Y495-V535 HydrophobicContact CE2-CG2 3.58Å; Y495-V535 HydrophobicContact CG-CG2 4.45Å; Y495-C560 HydrophobicContact CD1-CB 4.27Å; Y495-C560 HydrophobicContact CE1-CB 3.54Å; Y495-C560 HydrophobicContact CE2-CB 4.15Å; Y495-C560 VanDerWaalsContact CZ-CB 3.47Å; Y495-C560 VanDerWaalsContact OH-C 3.24Å; Y495-C560 PolarHBondContact OH-O 3.17Å; Y495-V563 HydrophobicContact CE1-CB 4.35Å; Y495-V563 HydrophobicContact CE1-CG1 4.3Å
496T96.8Very high93.9Very high20 Ų2039.7 Ų39.712%0.12320%0.2CC..Hα-helixtrans-61.2-36.6179.665.80000112.2M410 L492 L493 L494 A499 F500 V563 F567M410-T496 HydrophobicContact CE-CG2 3.93Å; M410-T496 HydrophobicContact CG-CG2 4.15Å; M410-T496 HydrophobicContact SD-CG2 3.73Å; L492-T496 WeakPolarHBondContact O-CG2 3.18Å; L492-T496 PolarHBondContact O-N 3.03Å; L493-T496 PolarHBondContact O-N 2.91Å; L493-T496 VanDerWaalsContact O-N 3.17Å; L493-T496 PolarHBondContact O-OG1 3.17Å; L494-T496 VanDerWaalsContact C-N 3.33Å; L494-T496 PolarHBondContact O-N 3.4Å; T496-A499 PolarHBondContact O-N 3.22Å; T496-F500 WeakPolarHBondContact O-CB 3.24Å; T496-F500 PolarHBondContact O-N 2.93Å; T496-V563 HydrophobicContact CG2-CG1 4.01Å; T496-F567 WeakPolarHBondContact O-CE2 3.42Å
497I96.6Very high94Very high103 Ų10334.9 Ų34.953%0.52819%0.185SC..Hα-helixtrans-66-47174.5-62168.8000110.4L493 L494 Y495 A499 F500 G501L493-I497 PolarHBondContact O-N 3.47Å; L494-I497 HydrophobicContact CD2-CD1 4.4Å; L494-I497 PolarHBondContact O-N 2.9Å; Y495-I497 VanDerWaalsContact C-N 3.26Å; Y495-I497 PolarHBondContact O-N 3.39Å; I497-A499 VanDerWaalsContact C-N 3.35Å; I497-A499 PolarHBondContact O-N 3.07Å; I497-F500 PolarHBondContact O-N 2.82Å; I497-G501 PolarHBondContact O-N 3.48Å
498C97.6Very high93.8Very high11 Ų1138.2 Ų38.27%0.07421%0.206CC..Hα-helixtrans-61.6-42.2176.1-64.50000112.1L494 Y495 G501 L502 F527 A531L494-C498 PolarHBondContact O-N 3.31Å; L494-C498 PolarHBondContact O-SG 3.29Å; L494-C498 VanDerWaalsContact O-SG 3.35Å; Y495-C498 PolarHBondContact O-N 2.87Å; Y495-C498 VanDerWaalsContact O-N 3.15Å; C498-G501 PolarHBondContact O-N 2.92Å; C498-L502 WeakPolarHBondContact O-CB 3.23Å; C498-L502 WeakPolarHBondContact O-CG 3.35Å; C498-L502 PolarHBondContact O-N 3.28Å; C498-F527 HydrophobicContact CB-CB 4.46Å; C498-F527 HydrophobicContact CB-CD1 4.23Å; C498-A531 HydrophobicContact CB-CB 3.97Å
499A97.5Very high93.6Very high0 Ų038.5 Ų38.50%021%0.209CC..Hα-helixtrans-63.7-42.917900000111.7Y495 T496 I497 L502 A503 V563 F564 F567Y495-A499 HydrophobicContact CD1-CB 4.48Å; Y495-A499 HydrophobicContact CE1-CB 4Å; Y495-A499 VanDerWaalsContact O-CB 3.32Å; Y495-A499 WeakPolarHBondContact O-CB 3.3Å; Y495-A499 PolarHBondContact O-N 3.47Å; T496-A499 PolarHBondContact O-N 3.22Å; I497-A499 VanDerWaalsContact C-N 3.35Å; I497-A499 PolarHBondContact O-N 3.07Å; A499-L502 PolarHBondContact O-N 3.46Å; A499-A503 WeakPolarHBondContact O-CB 3.42Å; A499-A503 PolarHBondContact O-N 3.38Å; A499-V563 HydrophobicContact CB-CG1 4.48Å; A499-F564 HydrophobicContact CB-CB 4.29Å; A499-F564 HydrophobicContact CB-CD2 4.28Å; A499-F567 HydrophobicContact CB-CD2 4Å; A499-F567 HydrophobicContact CB-CE2 4.34Å
500F96.1Very high93.4Very high86 Ų8637 Ų3738%0.37721%0.205SC..Hα-helixtrans-64.2-41.9173.9-176.3-99.6000112T496 I497 A503 S504 F567 V571T496-F500 WeakPolarHBondContact O-CB 3.24Å; T496-F500 PolarHBondContact O-N 2.93Å; I497-F500 PolarHBondContact O-N 2.82Å; F500-A503 PolarHBondContact O-N 3.45Å; F500-S504 WeakPolarHBondContact O-CB 3.48Å; F500-S504 PolarHBondContact O-N 2.96Å; F500-S504 PolarHBondContact O-OG 2.95Å; F500-F567 HydrophobicContact CB-CD2 3.96Å; F500-F567 HydrophobicContact CB-CE2 4Å; F500-F567 HydrophobicContact CB-CG 4.27Å; F500-F567 HydrophobicContact CB-CZ 4.34Å; F500-F567 HydrophobicContact CD2-CB 4.44Å; F500-F567 AromaticContact CD2-CD1 3.73Å; F500-F567 HydrophobicContact CD2-CD1 3.73Å; F500-F567 HydrophobicContact CD2-CE1 4.04Å; F500-F567 HydrophobicContact CD2-CG 4.01Å; F500-V571 HydrophobicContact CD2-CG1 4.41Å; F500-V571 HydrophobicContact CE2-CG1 3.9Å; F500-V571 HydrophobicContact CZ-CG1 4.41Å
501G95.5Very high93.3Very high9 Ų939.3 Ų39.39%0.09321%0.214CC..Hα-helixtrans-61.1-44.2174.800000112.9I497 C498 S504 L505I497-G501 PolarHBondContact O-N 3.48Å; C498-G501 PolarHBondContact O-N 2.92Å; G501-S504 PolarHBondContact O-N 3.35Å; G501-L505 WeakPolarHBondContact O-CG 3.22Å; G501-L505 PolarHBondContact O-N 3.32Å
502L96Very high93.2Very high11 Ų1143.3 Ų43.36%0.05823%0.229CC..Hα-helixtrans-62-49.3174.2-74.8169.5000111.8C498 A499 S504 L505 L506 F524 F527 L528 A531 F564C498-L502 WeakPolarHBondContact O-CB 3.23Å; C498-L502 WeakPolarHBondContact O-CG 3.35Å; C498-L502 PolarHBondContact O-N 3.28Å; A499-L502 PolarHBondContact O-N 3.46Å; L502-S504 VanDerWaalsContact C-N 3.31Å; L502-S504 PolarHBondContact O-N 3.45Å; L502-L505 PolarHBondContact O-N 3.12Å; L502-L506 WeakPolarHBondContact O-CB 3.48Å; L502-L506 VanDerWaalsContact O-CG 3.29Å; L502-L506 WeakPolarHBondContact O-CG 3.3Å; L502-L506 PolarHBondContact O-N 3.3Å; L502-F524 HydrophobicContact CD2-CD2 3.76Å; L502-F524 HydrophobicContact CD2-CE2 3.63Å; L502-F524 HydrophobicContact CD2-CZ 4.31Å; L502-F527 HydrophobicContact CD2-CB 3.88Å; L502-F527 HydrophobicContact CG-CB 3.76Å; L502-L528 HydrophobicContact CD1-CD1 4.47Å; L502-L528 HydrophobicContact CD2-CB 4.08Å; L502-A531 HydrophobicContact CD1-CB 3.92Å; L502-F564 HydrophobicContact CB-CD2 4.43Å; L502-F564 HydrophobicContact CB-CE2 3.8Å
503A93.8Very high92.9Very high0 Ų045.6 Ų45.60%024%0.241CC..Hα-helixtrans-58.2-44.6178.700000111.5A499 F500 L505 L506 L507 F564 F567 V571A499-A503 WeakPolarHBondContact O-CB 3.42Å; A499-A503 PolarHBondContact O-N 3.38Å; F500-A503 PolarHBondContact O-N 3.45Å; A503-L505 VanDerWaalsContact C-N 3.34Å; A503-L505 PolarHBondContact O-N 3.19Å; A503-L506 PolarHBondContact O-N 3.12Å; A503-L507 PolarHBondContact O-N 3.02Å; A503-L507 VanDerWaalsContact O-N 3.14Å; A503-F564 HydrophobicContact CB-CE2 4.44Å; A503-F567 HydrophobicContact CB-CB 3.8Å; A503-V571 HydrophobicContact CB-CG1 4.37Å; A503-V571 HydrophobicContact CB-CG2 4.28Å
504S92.6Very high92.6Very high33 Ų3349.2 Ų49.223%0.23126%0.255CS..Hα-helixtrans-62.8-38.5178.3-59.50000112.4F500 G501 L502 P508 G509F500-S504 WeakPolarHBondContact O-CB 3.48Å; F500-S504 PolarHBondContact O-N 2.96Å; F500-S504 PolarHBondContact O-OG 2.95Å; G501-S504 PolarHBondContact O-N 3.35Å; L502-S504 VanDerWaalsContact C-N 3.31Å; L502-S504 PolarHBondContact O-N 3.45Å; S504-P508 WeakPolarHBondContact O-CD 3.49Å; S504-P508 VanDerWaalsContact O-CG 3.22Å; S504-P508 WeakPolarHBondContact O-CG 3.36Å; S504-G509 PolarHBondContact O-N 3.5Å
505L92.3Very high92.3Very high19 Ų1951.4 Ų51.410%0.09926%0.264CS..Hα-helixtrans-75.8-37177.1-77.2172.5000113.1G501 L502 A503 L507 G509 A510 I513 I523 F524 F527G501-L505 WeakPolarHBondContact O-CG 3.22Å; G501-L505 PolarHBondContact O-N 3.32Å; L502-L505 PolarHBondContact O-N 3.12Å; A503-L505 VanDerWaalsContact C-N 3.34Å; A503-L505 PolarHBondContact O-N 3.19Å; L505-L507 VanDerWaalsContact C-N 3.32Å; L505-L507 PolarHBondContact O-N 3.46Å; L505-G509 CarbonylContact O-C 3.52Å; L505-G509 WeakPolarHBondContact O-CA 3.49Å; L505-A510 WeakPolarHBondContact O-CA 3.39Å; L505-A510 PolarHBondContact O-N 2.99Å; L505-I513 HydrophobicContact CB-CD1 4.18Å; L505-I513 WeakPolarHBondContact O-CD1 3.41Å; L505-I523 HydrophobicContact CD1-CB 4.12Å; L505-I523 HydrophobicContact CD1-CG2 3.69Å; L505-F524 HydrophobicContact CB-CD2 4.36Å; L505-F524 HydrophobicContact CD1-CB 4.02Å; L505-F527 HydrophobicContact CD1-CD2 4.08Å; L505-F527 HydrophobicContact CD1-CE2 4.47Å
506L90.1Very high91.9Very high70 Ų7054 Ų5437%0.36629%0.289SS..Hα-helixtrans-73-23.8-178-77170.3000113.8L502 A503 A510 F524 F564L502-L506 WeakPolarHBondContact O-CB 3.48Å; L502-L506 VanDerWaalsContact O-CG 3.29Å; L502-L506 WeakPolarHBondContact O-CG 3.3Å; L502-L506 PolarHBondContact O-N 3.3Å; A503-L506 PolarHBondContact O-N 3.12Å; L506-A510 WeakPolarHBondContact O-CB 3.39Å; L506-F524 HydrophobicContact CD1-CE2 4.13Å; L506-F524 HydrophobicContact CD2-CD2 4.42Å; L506-F524 HydrophobicContact CD2-CE2 3.52Å; L506-F524 HydrophobicContact CD2-CZ 4.02Å; L506-F524 HydrophobicContact CG-CD2 4.46Å; L506-F524 HydrophobicContact CG-CE2 3.69Å; L506-F564 HydrophobicContact CD1-CE2 4.19Å; L506-F564 HydrophobicContact CD1-CZ 3.71Å
507L87.4Confident91.7Very high47 Ų4757.9 Ų57.925%0.24630%0.302CS..THydrogen-bonded Turntrans-115.7-84.1-173-63.4171.5000111.6A503 L505 G509 A510 C568 V571 K572A503-L507 PolarHBondContact O-N 3.02Å; A503-L507 VanDerWaalsContact O-N 3.14Å; L505-L507 VanDerWaalsContact C-N 3.32Å; L505-L507 PolarHBondContact O-N 3.46Å; L507-G509 PolarHBondContact O-N 3.39Å; L507-A510 VanDerWaalsContact O-CB 3.25Å; L507-A510 WeakPolarHBondContact O-CB 3.31Å; L507-A510 PolarHBondContact O-N 3.37Å; L507-A510 VanDerWaalsContact O-N 3.14Å; L507-C568 HydrophobicContact CD1-CB 3.7Å; L507-C568 WeakPolarHBondContact CD1-O 3.12Å; L507-V571 HydrophobicContact CB-CG2 3.94Å; L507-V571 HydrophobicContact CD1-CG2 3.76Å; L507-V571 HydrophobicContact CG-CG2 4.45Å; L507-K572 HydrophobicContact CB-CG 4.39Å; L507-K572 HydrophobicContact CD1-CG 4.23Å
508P85.2Confident91.6Very high78 Ų7862.4 Ų62.451%0.50631%0.312SS..THydrogen-bonded Turntrans-63.7-31.8179.123.5-29.8000112.3S504 A510 V571S504-P508 WeakPolarHBondContact O-CD 3.49Å; S504-P508 VanDerWaalsContact O-CG 3.22Å; S504-P508 WeakPolarHBondContact O-CG 3.36Å; P508-A510 VanDerWaalsContact C-N 3.35Å; P508-V571 HydrophobicContact CG-CB 4.2Å; P508-V571 HydrophobicContact CG-CG2 4.42Å
509G86.7Confident91.4Very high8 Ų866.2 Ų66.28%0.08233%0.325CS..THydrogen-bonded Turntrans-84.52.6176.500000115.7S504 L505 L507 Q511 Y512S504-G509 PolarHBondContact O-N 3.5Å; L505-G509 CarbonylContact O-C 3.52Å; L505-G509 WeakPolarHBondContact O-CA 3.49Å; L507-G509 PolarHBondContact O-N 3.39Å; G509-Q511 PolarHBondContact O-N 2.81Å; G509-Q511 VanDerWaalsContact O-N 3.13Å; G509-Y512 PolarHBondContact O-N 2.9Å
510A87.1Confident91.3Very high23 Ų2366.2 Ų66.219%0.1933%0.325CS..Hα-helixtrans-58.7-33.4-17100000113L505 L506 L507 P508 Y512 I513 Q514L505-A510 WeakPolarHBondContact O-CA 3.39Å; L505-A510 PolarHBondContact O-N 2.99Å; L506-A510 WeakPolarHBondContact O-CB 3.39Å; L507-A510 VanDerWaalsContact O-CB 3.25Å; L507-A510 WeakPolarHBondContact O-CB 3.31Å; L507-A510 PolarHBondContact O-N 3.37Å; L507-A510 VanDerWaalsContact O-N 3.14Å; P508-A510 VanDerWaalsContact C-N 3.35Å; A510-Y512 VanDerWaalsContact C-N 3.3Å; A510-Y512 PolarHBondContact O-N 3.2Å; A510-I513 PolarHBondContact O-N 2.77Å; A510-Q514 WeakPolarHBondContact O-CG 2.99Å; A510-Q514 PolarHBondContact O-N 3.23Å
511Q89.2Confident91.1Very high126 Ų12664.8 Ų64.859%0.58932%0.323SS*.Hα-helixtrans-58.4-40.8177.4-67.1178.2-26.900111.8G509 I513 Q514 E515G509-Q511 PolarHBondContact O-N 2.81Å; G509-Q511 VanDerWaalsContact O-N 3.13Å; Q511-I513 VanDerWaalsContact C-N 3.32Å; Q511-I513 PolarHBondContact O-N 3.01Å; Q511-Q514 PolarHBondContact O-N 3.23Å; Q511-E515 WeakPolarHBondContact O-CB 3.32Å; Q511-E515 VanDerWaalsContact O-CG 3.31Å; Q511-E515 WeakPolarHBondContact O-CG 3.44Å; Q511-E515 PolarHBondContact O-N 3.49Å
512Y91.1Very high91.1Very high90 Ų9068.2 Ų68.235%0.35334%0.342SS..Hα-helixtrans-68.9-31.5179.2-56.8-61.5000112.9G509 A510 A516 R517 W519G509-Y512 PolarHBondContact O-N 2.9Å; A510-Y512 VanDerWaalsContact C-N 3.3Å; A510-Y512 PolarHBondContact O-N 3.2Å; Y512-A516 PolarHBondContact O-N 2.83Å; Y512-R517 WeakPolarHBondContact O-CB 3.36Å; Y512-R517 PolarHBondContact O-N 3.13Å; Y512-W519 HydrophobicContact CD1-CH2 4.15Å; Y512-W519 AromaticContact CD1-CZ2 3.8Å; Y512-W519 HydrophobicContact CD1-CZ2 3.8Å; Y512-W519 AromaticContact CD2-CH2 3.84Å; Y512-W519 HydrophobicContact CD2-CH2 3.84Å; Y512-W519 HydrophobicContact CD2-CZ2 4.33Å; Y512-W519 HydrophobicContact CE1-CZ2 4.28Å; Y512-W519 HydrophobicContact CE2-CH2 4.31Å; Y512-W519 AromaticContact CG-CH2 3.73Å; Y512-W519 HydrophobicContact CG-CH2 3.73Å; Y512-W519 AromaticContact CG-CZ2 3.8Å; Y512-W519 HydrophobicContact CG-CZ2 3.8Å
513I88.8Confident91.1Very high53 Ų5370.8 Ų70.827%0.27236%0.355SS..Hα-helixtrans-72.1-43.2173.6-61.7-178.9000110.2L505 A510 Q511 E515 A516 A520 F524L505-I513 HydrophobicContact CB-CD1 4.18Å; L505-I513 WeakPolarHBondContact O-CD1 3.41Å; A510-I513 PolarHBondContact O-N 2.77Å; Q511-I513 VanDerWaalsContact C-N 3.32Å; Q511-I513 PolarHBondContact O-N 3.01Å; I513-E515 VanDerWaalsContact C-N 3.34Å; I513-E515 PolarHBondContact O-N 2.91Å; I513-A516 WeakPolarHBondContact O-CA 3.17Å; I513-A516 PolarHBondContact O-N 3.45Å; I513-A520 HydrophobicContact CG1-CB 4.47Å; I513-F524 HydrophobicContact CD1-CD2 4.03Å; I513-F524 HydrophobicContact CD1-CG 4.33Å
514Q88.7Confident91.1Very high162 Ų16273.1 Ų73.176%0.75737%0.365SS*.Hα-helixtrans-64.6-37.2177.7-72.4176.8-3.400112.3A510 Q511 A516A510-Q514 WeakPolarHBondContact O-CG 2.99Å; A510-Q514 PolarHBondContact O-N 3.23Å; Q511-Q514 PolarHBondContact O-N 3.23Å; Q514-A516 PolarHBondContact O-N 3.31Å
515E91.5Very high91.2Very high111 Ų11175.4 Ų75.452%0.51937%0.374SS..THydrogen-bonded Turntrans-71.91.5171-71.7176.6-167.900113.3Q511 I513 R517Q511-E515 WeakPolarHBondContact O-CB 3.32Å; Q511-E515 VanDerWaalsContact O-CG 3.31Å; Q511-E515 WeakPolarHBondContact O-CG 3.44Å; Q511-E515 PolarHBondContact O-N 3.49Å; I513-E515 VanDerWaalsContact C-N 3.34Å; I513-E515 PolarHBondContact O-N 2.91Å; E515-R517 HydrophobicContact CB-CG 4.1Å; E515-R517 PolarHBondContact O-N 3.27Å; E515-R517 IonicContact OE2-CZ 3.12Å; E515-R517 IonicContact OE2-NE 2.74Å; E515-R517 PolarHBondContact OE2-NE 2.94Å; E515-R517 IonicContact OE2-NH2 2.84Å; E515-R517 PolarHBondContact OE2-NH2 3.21Å
516A89.3Confident91.4Very high74 Ų7479.7 Ų79.761%0.61240%0.397SS*.THydrogen-bonded Turntrans52.236-178.800000113.8Y512 I513 Q514 W518Y512-A516 PolarHBondContact O-N 2.83Å; I513-A516 WeakPolarHBondContact O-CA 3.17Å; I513-A516 PolarHBondContact O-N 3.45Å; Q514-A516 PolarHBondContact O-N 3.31Å; A516-W518 PolarHBondContact O-N 3.08Å
517R92.3Very high91.8Very high102 Ų10278.7 Ų78.739%0.38539%0.389SS..  trans-65.8121.8177.4-63.3-165.2-175.3-163.1-0.3109.9Y512 E515 W519 A520 V521Y512-R517 WeakPolarHBondContact O-CB 3.36Å; Y512-R517 PolarHBondContact O-N 3.13Å; E515-R517 HydrophobicContact CB-CG 4.1Å; E515-R517 PolarHBondContact O-N 3.27Å; E515-R517 IonicContact OE2-CZ 3.12Å; E515-R517 IonicContact OE2-NE 2.74Å; E515-R517 PolarHBondContact OE2-NE 2.94Å; E515-R517 IonicContact OE2-NH2 2.84Å; E515-R517 PolarHBondContact OE2-NH2 3.21Å; R517-W519 VanDerWaalsContact C-N 3.3Å; R517-W519 PolarHBondContact O-N 3.18Å; R517-A520 HydrophobicContact CB-CB 4.32Å; R517-A520 PolarHBondContact O-N 2.9Å; R517-V521 PolarHBondContact O-N 2.79Å; R517-V521 VanDerWaalsContact O-N 3.11Å
518W94.1Very high92.2Very high198 Ų19879.9 Ų79.975%0.7540%0.396SS*.Hα-helixtrans-51.9-45.3-173.969.5-90.5000112.9A516 A520 V521 V522A516-W518 PolarHBondContact O-N 3.08Å; W518-A520 VanDerWaalsContact C-N 3.34Å; W518-A520 PolarHBondContact O-N 3.3Å; W518-V521 PolarHBondContact O-N 3.16Å; W518-V522 HydrophobicContact CE3-CG2 4.44Å; W518-V522 WeakPolarHBondContact O-CG2 3.37Å; W518-V522 PolarHBondContact O-N 3.29Å
519W94.9Very high92.8Very high91 Ų9181.3 Ų81.335%0.34540%0.398SS..Hα-helixtrans-63.6-39.3-178.362.4-95.6000112Y512 R517 V522 I523Y512-W519 HydrophobicContact CD1-CH2 4.15Å; Y512-W519 AromaticContact CD1-CZ2 3.8Å; Y512-W519 HydrophobicContact CD1-CZ2 3.8Å; Y512-W519 AromaticContact CD2-CH2 3.84Å; Y512-W519 HydrophobicContact CD2-CH2 3.84Å; Y512-W519 HydrophobicContact CD2-CZ2 4.33Å; Y512-W519 HydrophobicContact CE1-CZ2 4.28Å; Y512-W519 HydrophobicContact CE2-CH2 4.31Å; Y512-W519 AromaticContact CG-CH2 3.73Å; Y512-W519 HydrophobicContact CG-CH2 3.73Å; Y512-W519 AromaticContact CG-CZ2 3.8Å; Y512-W519 HydrophobicContact CG-CZ2 3.8Å; R517-W519 VanDerWaalsContact C-N 3.3Å; R517-W519 PolarHBondContact O-N 3.18Å; W519-V522 PolarHBondContact O-N 2.81Å; W519-I523 HydrophobicContact CE3-CD1 4.02Å; W519-I523 WeakPolarHBondContact O-CB 3.45Å; W519-I523 WeakPolarHBondContact O-CG1 3.42Å; W519-I523 PolarHBondContact O-N 3.44Å
520A93.9Very high93.2Very high0 Ų081.6 Ų81.60%040%0.401CS..Hα-helixtrans-67.7-41.817900000110.6I513 R517 W518 F524I513-A520 HydrophobicContact CG1-CB 4.47Å; R517-A520 HydrophobicContact CB-CB 4.32Å; R517-A520 PolarHBondContact O-N 2.9Å; W518-A520 VanDerWaalsContact C-N 3.34Å; W518-A520 PolarHBondContact O-N 3.3Å; A520-F524 VanDerWaalsContact O-CB 3.24Å; A520-F524 WeakPolarHBondContact O-CB 3.45Å; A520-F524 PolarHBondContact O-N 3.22Å
521V93.3Very high93.7Very high55 Ų5580.9 Ų80.933%0.33340%0.395SS..Hα-helixtrans-63.9-45.2176177.90000111.2R517 W518 F524 I525R517-V521 PolarHBondContact O-N 2.79Å; R517-V521 VanDerWaalsContact O-N 3.11Å; W518-V521 PolarHBondContact O-N 3.16Å; V521-F524 PolarHBondContact O-N 3.16Å; V521-I525 HydrophobicContact CG1-CD1 3.85Å; V521-I525 VanDerWaalsContact O-CG1 3.3Å; V521-I525 WeakPolarHBondContact O-CG1 3.44Å; V521-I525 PolarHBondContact O-N 3.32Å
522V95.1Very high94.1Very high81 Ų8179.6 Ų79.649%0.49139%0.391SS..Hα-helixtrans-62.7-46.7177.8172.80000111.4W518 W519 F524 I525 L526W518-V522 HydrophobicContact CE3-CG2 4.44Å; W518-V522 WeakPolarHBondContact O-CG2 3.37Å; W518-V522 PolarHBondContact O-N 3.29Å; W519-V522 PolarHBondContact O-N 2.81Å; V522-F524 VanDerWaalsContact C-N 3.33Å; V522-F524 PolarHBondContact O-N 2.61Å; V522-I525 PolarHBondContact O-N 3.18Å; V522-L526 WeakPolarHBondContact O-CB 3.19Å; V522-L526 PolarHBondContact O-N 2.79Å
523I95.2Very high94.3Very high65 Ų6580.7 Ų80.733%0.33340%0.398SS..Hα-helixtrans-64.8-39.7179-63.8170.9000110.6L505 W519 L526 F527L505-I523 HydrophobicContact CD1-CB 4.12Å; L505-I523 HydrophobicContact CD1-CG2 3.69Å; W519-I523 HydrophobicContact CE3-CD1 4.02Å; W519-I523 WeakPolarHBondContact O-CB 3.45Å; W519-I523 WeakPolarHBondContact O-CG1 3.42Å; W519-I523 PolarHBondContact O-N 3.44Å; I523-L526 PolarHBondContact O-N 3.42Å; I523-F527 HydrophobicContact CG2-CD2 3.56Å; I523-F527 HydrophobicContact CG2-CE2 3.3Å; I523-F527 HydrophobicContact CG2-CZ 4.17Å; I523-F527 WeakPolarHBondContact O-CD2 3.48Å; I523-F527 PolarHBondContact O-N 3.17Å
524F94.6Very high94.7Very high49 Ų4979.7 Ų79.722%0.21539%0.392CS..Hα-helixtrans-59.3-49.5175.6179-97.3000111.7L502 L505 L506 I513 A520 V521 V522 L526 F527 L528L502-F524 HydrophobicContact CD2-CD2 3.76Å; L502-F524 HydrophobicContact CD2-CE2 3.63Å; L502-F524 HydrophobicContact CD2-CZ 4.31Å; L505-F524 HydrophobicContact CB-CD2 4.36Å; L505-F524 HydrophobicContact CD1-CB 4.02Å; L506-F524 HydrophobicContact CD1-CE2 4.13Å; L506-F524 HydrophobicContact CD2-CD2 4.42Å; L506-F524 HydrophobicContact CD2-CE2 3.52Å; L506-F524 HydrophobicContact CD2-CZ 4.02Å; L506-F524 HydrophobicContact CG-CD2 4.46Å; L506-F524 HydrophobicContact CG-CE2 3.69Å; I513-F524 HydrophobicContact CD1-CD2 4.03Å; I513-F524 HydrophobicContact CD1-CG 4.33Å; A520-F524 VanDerWaalsContact O-CB 3.24Å; A520-F524 WeakPolarHBondContact O-CB 3.45Å; A520-F524 PolarHBondContact O-N 3.22Å; V521-F524 PolarHBondContact O-N 3.16Å; V522-F524 VanDerWaalsContact C-N 3.33Å; V522-F524 PolarHBondContact O-N 2.61Å; F524-L526 VanDerWaalsContact C-N 3.32Å; F524-L526 PolarHBondContact O-N 3.46Å; F524-F527 PolarHBondContact O-N 2.92Å; F524-L528 HydrophobicContact CE1-CD2 4.29Å; F524-L528 WeakPolarHBondContact O-CB 3.29Å; F524-L528 PolarHBondContact O-N 3.23Å
525I95.2Very high95Very high82 Ų8272.7 Ų72.742%0.42136%0.36SS..Hα-helixtrans-61.2-43177.3-68.4168.3000110.6V521 V522 L528 I529V521-I525 HydrophobicContact CG1-CD1 3.85Å; V521-I525 VanDerWaalsContact O-CG1 3.3Å; V521-I525 WeakPolarHBondContact O-CG1 3.44Å; V521-I525 PolarHBondContact O-N 3.32Å; V522-I525 PolarHBondContact O-N 3.18Å; I525-L528 PolarHBondContact O-N 3.01Å; I525-I529 HydrophobicContact CG2-CD1 3.61Å; I525-I529 HydrophobicContact CG2-CG1 4.27Å; I525-I529 WeakPolarHBondContact O-CB 3.5Å; I525-I529 VanDerWaalsContact O-CG1 3.3Å; I525-I529 WeakPolarHBondContact O-CG1 3.39Å; I525-I529 PolarHBondContact O-N 3.44Å
526L96.6Very high95.1Very high108 Ų10870.7 Ų70.757%0.56536%0.355SS*.Hα-helixtrans-61.6-46.6179.1-176.8146.3000111.8V522 I523 F524 L528 G530V522-L526 WeakPolarHBondContact O-CB 3.19Å; V522-L526 PolarHBondContact O-N 2.79Å; I523-L526 PolarHBondContact O-N 3.42Å; F524-L526 VanDerWaalsContact C-N 3.32Å; F524-L526 PolarHBondContact O-N 3.46Å; L526-L528 VanDerWaalsContact C-N 3.35Å; L526-G530 PolarHBondContact O-N 3.46Å
527F97.1Very high95.2Very high49 Ų4967.9 Ų67.922%0.21533%0.33CS..Hα-helixtrans-69.1-32.9176.8-72.2-46.5000112.7C498 L502 L505 I523 F524 G530 A531C498-F527 HydrophobicContact CB-CB 4.46Å; C498-F527 HydrophobicContact CB-CD1 4.23Å; L502-F527 HydrophobicContact CD2-CB 3.88Å; L502-F527 HydrophobicContact CG-CB 3.76Å; L505-F527 HydrophobicContact CD1-CD2 4.08Å; L505-F527 HydrophobicContact CD1-CE2 4.47Å; I523-F527 HydrophobicContact CG2-CD2 3.56Å; I523-F527 HydrophobicContact CG2-CE2 3.3Å; I523-F527 HydrophobicContact CG2-CZ 4.17Å; I523-F527 WeakPolarHBondContact O-CD2 3.48Å; I523-F527 PolarHBondContact O-N 3.17Å; F524-F527 PolarHBondContact O-N 2.92Å; F527-G530 PolarHBondContact O-N 3.46Å; F527-A531 VanDerWaalsContact O-CB 3.23Å; F527-A531 WeakPolarHBondContact O-CB 3.33Å; F527-A531 PolarHBondContact O-N 3.17Å
528L96.6Very high95.2Very high73 Ų7363 Ų6338%0.38231%0.311SS..Hα-helixtrans-65.7-48.9176.2-176.564.2000111L502 F524 I525 L526 G530 A531 I532L502-L528 HydrophobicContact CD1-CD1 4.47Å; L502-L528 HydrophobicContact CD2-CB 4.08Å; F524-L528 HydrophobicContact CE1-CD2 4.29Å; F524-L528 WeakPolarHBondContact O-CB 3.29Å; F524-L528 PolarHBondContact O-N 3.23Å; I525-L528 PolarHBondContact O-N 3.01Å; L526-L528 VanDerWaalsContact C-N 3.35Å; L528-G530 VanDerWaalsContact C-N 3.34Å; L528-G530 PolarHBondContact O-N 3.15Å; L528-A531 PolarHBondContact O-N 3.26Å; L528-I532 HydrophobicContact CD1-CD1 4.3Å; L528-I532 HydrophobicContact CG-CD1 4.16Å; L528-I532 VanDerWaalsContact O-CG1 3.31Å; L528-I532 WeakPolarHBondContact O-CG1 3.12Å; L528-I532 PolarHBondContact O-N 2.97Å
529I97.2Very high95.1Very high108 Ų10857 Ų5755%0.55429%0.291SS*.Hα-helixtrans-61.6-44.8175.8-67.4171.4000110I525 I532 F533I525-I529 HydrophobicContact CG2-CD1 3.61Å; I525-I529 HydrophobicContact CG2-CG1 4.27Å; I525-I529 WeakPolarHBondContact O-CB 3.5Å; I525-I529 VanDerWaalsContact O-CG1 3.3Å; I525-I529 WeakPolarHBondContact O-CG1 3.39Å; I525-I529 PolarHBondContact O-N 3.44Å; I529-I532 PolarHBondContact O-N 3.46Å; I529-F533 WeakPolarHBondContact O-CB 3.34Å; I529-F533 PolarHBondContact O-N 3.26Å
530G96.5Very high94.8Very high14 Ų1453.8 Ų53.814%0.14428%0.28CS..Hα-helixtrans-58.9-48176.500000112.5L526 F527 L528 I532 F533 F534L526-G530 PolarHBondContact O-N 3.46Å; F527-G530 PolarHBondContact O-N 3.46Å; L528-G530 VanDerWaalsContact C-N 3.34Å; L528-G530 PolarHBondContact O-N 3.15Å; G530-I532 PolarHBondContact O-N 2.88Å; G530-F533 PolarHBondContact O-N 3.44Å; G530-F534 WeakPolarHBondContact O-CD2 3.42Å; G530-F534 WeakPolarHBondContact O-CG 3.41Å; G530-F534 PolarHBondContact O-N 2.91Å
531A96.9Very high94.6Very high7 Ų754 Ų546%0.05828%0.281CS..Hα-helixtrans-59.4-47.117800000111.8Y495 C498 L502 F527 L528 V535Y495-A531 HydrophobicContact CD2-CB 4.03Å; Y495-A531 WeakPolarHBondContact CD2-O 3.44Å; Y495-A531 HydrophobicContact CE2-CB 3.91Å; C498-A531 HydrophobicContact CB-CB 3.97Å; L502-A531 HydrophobicContact CD1-CB 3.92Å; F527-A531 VanDerWaalsContact O-CB 3.23Å; F527-A531 WeakPolarHBondContact O-CB 3.33Å; F527-A531 PolarHBondContact O-N 3.17Å; L528-A531 PolarHBondContact O-N 3.26Å; A531-V535 VanDerWaalsContact O-CG2 3.3Å; A531-V535 WeakPolarHBondContact O-CG2 2.93Å; A531-V535 PolarHBondContact O-N 3.32Å; A531-V535 VanDerWaalsContact O-N 3.12Å
532I96.6Very high94.2Very high99 Ų9954.3 Ų54.351%0.50828%0.279SS..Hα-helixtrans-62.1-46.9176.6-66.3167.1000110.3L528 I529 G530 F534 V535 V536L528-I532 HydrophobicContact CD1-CD1 4.3Å; L528-I532 HydrophobicContact CG-CD1 4.16Å; L528-I532 VanDerWaalsContact O-CG1 3.31Å; L528-I532 WeakPolarHBondContact O-CG1 3.12Å; L528-I532 PolarHBondContact O-N 2.97Å; I529-I532 PolarHBondContact O-N 3.46Å; G530-I532 PolarHBondContact O-N 2.88Å; I532-F534 PolarHBondContact O-N 2.93Å; I532-V535 PolarHBondContact O-N 3.12Å; I532-V536 HydrophobicContact CG2-CG2 4.35Å; I532-V536 WeakPolarHBondContact O-CG2 3.3Å; I532-V536 PolarHBondContact O-N 2.92Å
533F95.9Very high93.8Very high114 Ų11452.1 Ų52.150%0.526%0.263SS..Hα-helixtrans-57.7-47.7-179.6175.5-105.7000112.3I529 G530 V535 V536 I537I529-F533 WeakPolarHBondContact O-CB 3.34Å; I529-F533 PolarHBondContact O-N 3.26Å; G530-F533 PolarHBondContact O-N 3.44Å; F533-V535 PolarHBondContact O-N 2.84Å; F533-V536 WeakPolarHBondContact O-CB 3.47Å; F533-V536 PolarHBondContact O-N 2.88Å; F533-I537 HydrophobicContact CD1-CD1 3.93Å; F533-I537 HydrophobicContact CE1-CD1 3.39Å; F533-I537 HydrophobicContact CE1-CG1 4.41Å; F533-I537 HydrophobicContact CE2-CD1 4.27Å; F533-I537 HydrophobicContact CZ-CD1 3.59Å; F533-I537 HydrophobicContact CZ-CG1 4.34Å; F533-I537 WeakPolarHBondContact O-CG1 3.41Å; F533-I537 PolarHBondContact O-N 2.91Å
534F96.6Very high93.1Very high32 Ų3249.4 Ų49.414%0.1425%0.25CC..Hα-helixtrans-69.4-33.8179.7-65.2-52.7000113.1S491 L494 G530 I532 I537 M538S491-F534 WeakPolarHBondContact O-CB 3.47Å; L494-F534 HydrophobicContact CB-CD1 4.02Å; L494-F534 HydrophobicContact CB-CD2 3.69Å; L494-F534 HydrophobicContact CB-CE1 3.79Å; L494-F534 HydrophobicContact CB-CE2 3.46Å; L494-F534 VanDerWaalsContact CB-CE2 3.46Å; L494-F534 HydrophobicContact CB-CG 4Å; L494-F534 HydrophobicContact CB-CZ 3.53Å; L494-F534 HydrophobicContact CD1-CD1 4.2Å; L494-F534 HydrophobicContact CD1-CE1 3.42Å; L494-F534 VanDerWaalsContact CD1-CE1 3.42Å; L494-F534 HydrophobicContact CD1-CE2 4.36Å; L494-F534 HydrophobicContact CD1-CZ 3.53Å; L494-F534 HydrophobicContact CG-CE1 4.25Å; L494-F534 HydrophobicContact CG-CE2 4.46Å; L494-F534 HydrophobicContact CG-CZ 4.09Å; G530-F534 WeakPolarHBondContact O-CD2 3.42Å; G530-F534 WeakPolarHBondContact O-CG 3.41Å; G530-F534 PolarHBondContact O-N 2.91Å; I532-F534 PolarHBondContact O-N 2.93Å; F534-I537 HydrophobicContact CD1-CD1 4.16Å; F534-I537 PolarHBondContact O-N 3.33Å; F534-M538 PolarHBondContact O-N 3.38Å; F534-M538 VanDerWaalsContact O-N 3.11Å
535V95.8Very high92.1Very high15 Ų1554.2 Ų54.29%0.09127%0.27CS..Hα-helixtrans-63.3-43.6170.9168.70000111Y495 A531 I532 F533 I537 M538 F539 P556 L557 C560Y495-V535 HydrophobicContact CD2-CG2 3.6Å; Y495-V535 HydrophobicContact CE2-CG2 3.58Å; Y495-V535 HydrophobicContact CG-CG2 4.45Å; A531-V535 VanDerWaalsContact O-CG2 3.3Å; A531-V535 WeakPolarHBondContact O-CG2 2.93Å; A531-V535 PolarHBondContact O-N 3.32Å; A531-V535 VanDerWaalsContact O-N 3.12Å; I532-V535 PolarHBondContact O-N 3.12Å; F533-V535 PolarHBondContact O-N 2.84Å; V535-I537 PolarHBondContact O-N 2.78Å; V535-M538 HydrophobicContact CB-CE 4.48Å; V535-M538 HydrophobicContact CG2-CE 4.08Å; V535-M538 PolarHBondContact O-N 3.33Å; V535-F539 HydrophobicContact CG1-CD2 3.85Å; V535-F539 HydrophobicContact CG1-CE2 3.8Å; V535-F539 WeakPolarHBondContact O-CD2 3.23Å; V535-F539 PolarHBondContact O-N 3.35Å; V535-P556 HydrophobicContact CG1-CG 4.44Å; V535-L557 HydrophobicContact CG1-CD2 3.75Å; V535-C560 HydrophobicContact CG2-CB 4.26Å
536V93.7Very high90.8Very high69 Ų6954.2 Ų54.242%0.41828%0.277SS..Hα-helixtrans-59.5-47.1175.3170.60000110.3I532 F533 M538 F539 L540I532-V536 HydrophobicContact CG2-CG2 4.35Å; I532-V536 WeakPolarHBondContact O-CG2 3.3Å; I532-V536 PolarHBondContact O-N 2.92Å; F533-V536 WeakPolarHBondContact O-CB 3.47Å; F533-V536 PolarHBondContact O-N 2.88Å; V536-M538 VanDerWaalsContact C-N 3.29Å; V536-M538 PolarHBondContact O-N 3.37Å; V536-F539 WeakPolarHBondContact O-CA 3.2Å; V536-F539 WeakPolarHBondContact O-CB 3.33Å; V536-F539 PolarHBondContact O-N 2.7Å; V536-L540 HydrophobicContact CG1-CD1 4.44Å; V536-L540 HydrophobicContact CG1-CG 4.37Å; V536-L540 WeakPolarHBondContact O-CG 3.36Å; V536-L540 PolarHBondContact O-N 3.31Å
537I91.7Very high89.6Confident15 Ų1550.2 Ų50.28%0.07726%0.256CS..Hα-helixtrans-55.1-46.2176.8-67172000111L479 S491 F533 F534 V535 F539 L540 H541L479-I537 HydrophobicContact CD2-CG2 4Å; S491-I537 WeakPolarHBondContact OG-CG2 3.24Å; F533-I537 HydrophobicContact CD1-CD1 3.93Å; F533-I537 HydrophobicContact CE1-CD1 3.39Å; F533-I537 HydrophobicContact CE1-CG1 4.41Å; F533-I537 HydrophobicContact CE2-CD1 4.27Å; F533-I537 HydrophobicContact CZ-CD1 3.59Å; F533-I537 HydrophobicContact CZ-CG1 4.34Å; F533-I537 WeakPolarHBondContact O-CG1 3.41Å; F533-I537 PolarHBondContact O-N 2.91Å; F534-I537 HydrophobicContact CD1-CD1 4.16Å; F534-I537 PolarHBondContact O-N 3.33Å; V535-I537 PolarHBondContact O-N 2.78Å; I537-F539 VanDerWaalsContact C-N 3.29Å; I537-F539 PolarHBondContact O-N 2.83Å; I537-L540 WeakPolarHBondContact O-CB 3.47Å; I537-L540 PolarHBondContact O-N 2.89Å; I537-L540 VanDerWaalsContact O-N 3.11Å; I537-H541 PolarHBondContact O-ND1 3.01Å
538M92.2Very high88.4Confident0 Ų054.8 Ų54.80%028%0.282CS..Hα-helixtrans-61.4-36.3177-70.2-175.6-71.800112.3Y417 P488 L492 F534 V535 V536 L540 H541 P556 C560Y417-M538 WeakPolarHBondContact CE1-O 3.48Å; Y417-M538 HydrophobicContact CE2-CB 4.3Å; Y417-M538 VanDerWaalsContact CZ-O 3.23Å; Y417-M538 PolarHBondContact OH-O 3.22Å; P488-M538 HydrophobicContact CB-CG 4.15Å; L492-M538 HydrophobicContact CB-SD 3.93Å; L492-M538 HydrophobicContact CD1-SD 4.16Å; F534-M538 PolarHBondContact O-N 3.38Å; F534-M538 VanDerWaalsContact O-N 3.11Å; V535-M538 HydrophobicContact CB-CE 4.48Å; V535-M538 HydrophobicContact CG2-CE 4.08Å; V535-M538 PolarHBondContact O-N 3.33Å; V536-M538 VanDerWaalsContact C-N 3.29Å; V536-M538 PolarHBondContact O-N 3.37Å; M538-L540 VanDerWaalsContact C-N 3.31Å; M538-L540 PolarHBondContact O-N 3.22Å; M538-H541 PolarHBondContact O-N 3.5Å; M538-P556 HydrophobicContact CB-CB 4.19Å; M538-P556 HydrophobicContact CB-CG 3.69Å; M538-P556 HydrophobicContact CE-CB 4.11Å; M538-P556 HydrophobicContact CE-CG 4.28Å; M538-P556 HydrophobicContact SD-CB 4.16Å; M538-C560 WeakPolarHBondContact CE-SG 3.3Å
539F91.2Very high87.7Confident71 Ų7152.3 Ų52.331%0.31127%0.271SS..Hα-helixtrans-65.4-30.5173.7-91-66.3000114.5K470 V535 V536 I537 H541 P556 L557K470-F539 WeakPolarHBondContact CE-O 3.46Å; K470-F539 PolarHBondContact NZ-O 3.28Å; V535-F539 HydrophobicContact CG1-CD2 3.85Å; V535-F539 HydrophobicContact CG1-CE2 3.8Å; V535-F539 WeakPolarHBondContact O-CD2 3.23Å; V535-F539 PolarHBondContact O-N 3.35Å; V536-F539 WeakPolarHBondContact O-CA 3.2Å; V536-F539 WeakPolarHBondContact O-CB 3.33Å; V536-F539 PolarHBondContact O-N 2.7Å; I537-F539 VanDerWaalsContact C-N 3.29Å; I537-F539 PolarHBondContact O-N 2.83Å; F539-H541 PolarHBondContact O-N 3.28Å; F539-P556 HydrophobicContact CD2-CG 4.16Å; F539-P556 HydrophobicContact CE2-CG 4.19Å; F539-P556 HydrophobicContact CG-CG 4.49Å; F539-L557 HydrophobicContact CE2-CD1 3.9Å; F539-L557 HydrophobicContact CE2-CD2 3.81Å; F539-L557 HydrophobicContact CE2-CG 3.52Å; F539-L557 HydrophobicContact CZ-CD1 3.56Å; F539-L557 HydrophobicContact CZ-CD2 4.29Å; F539-L557 HydrophobicContact CZ-CG 3.49Å; F539-L557 VanDerWaalsContact CZ-CG 3.49Å
540L89.3Confident87.4Confident24 Ų2450.2 Ų50.213%0.12626%0.258CS..Hα-helixtrans-72.3-15.5177.8-58.9-178.2000112.7L469 K470 F473 L476 L479 V536 I537 M538L469-L540 HydrophobicContact CD1-CB 3.71Å; K470-L540 VanDerWaalsContact CB-O 3.3Å; K470-L540 WeakPolarHBondContact CB-O 3.17Å; K470-L540 VanDerWaalsContact CG-O 3.23Å; K470-L540 WeakPolarHBondContact CG-O 3.26Å; K470-L540 PolarHBondContact N-O 3.11Å; F473-L540 HydrophobicContact CD1-CD2 3.8Å; F473-L540 HydrophobicContact CD2-CD2 3.68Å; F473-L540 HydrophobicContact CE1-CD2 3.72Å; F473-L540 HydrophobicContact CE2-CD2 3.6Å; F473-L540 HydrophobicContact CG-CD2 3.77Å; F473-L540 HydrophobicContact CZ-CD2 3.61Å; L476-L540 HydrophobicContact CD1-CD1 4.26Å; L479-L540 HydrophobicContact CD1-CD1 4.12Å; V536-L540 HydrophobicContact CG1-CD1 4.44Å; V536-L540 HydrophobicContact CG1-CG 4.37Å; V536-L540 WeakPolarHBondContact O-CG 3.36Å; V536-L540 PolarHBondContact O-N 3.31Å; I537-L540 WeakPolarHBondContact O-CB 3.47Å; I537-L540 PolarHBondContact O-N 2.89Å; I537-L540 VanDerWaalsContact O-N 3.11Å; M538-L540 VanDerWaalsContact C-N 3.31Å; M538-L540 PolarHBondContact O-N 3.22Å
541H88.5Confident87.1Confident3 Ų353 Ų531%0.01427%0.266CS..BIsolated β-bridgetrans-93.8149.6178.7-6878.6000112Y417 G467 R468 A487 P488 I537 M538 F539Y417-H541 HydrophobicContact CD1-CB 4.06Å; Y417-H541 HydrophobicContact CE1-CB 4.03Å; G467-H541 PolarHBondContact O-CD2 3.39Å; G467-H541 VanDerWaalsContact O-CD2 3.31Å; R468-H541 CarbonylContact O-C 3.6Å; R468-H541 WeakPolarHBondContact O-CA 3.37Å; A487-H541 WeakPolarHBondContact CB-NE2 3.33Å; P488-H541 HydrophobicContact CB-CB 4.42Å; P488-H541 HydrophobicContact CG-CB 4.2Å; I537-H541 PolarHBondContact O-ND1 3.01Å; M538-H541 PolarHBondContact O-N 3.5Å; F539-H541 PolarHBondContact O-N 3.28Å
542E85.3Confident86.9Confident63 Ų6352.8 Ų52.829%0.29426%0.264SS..PPolyproline II helixtrans-73.1134.2176.8-69.1-67.6-174.600111.4G467 R468 K470G467-E542 WeakPolarHBondContact CA-O 3.43Å; G467-E542 PolarHBondContact N-O 3.44Å; R468-E542 PolarHBondContact O-N 3.11Å; K470-E542 HydrophobicContact CG-CG 3.92Å; K470-E542 WeakPolarHBondContact CG-OE1 3.32Å
543Q86.6Confident86.6Confident34 Ų3450.9 Ų50.916%0.15926%0.258CS..PPolyproline II helixtrans-96145.6177.2-69.3177.639.300110.3R416 Y417 K545 V555R416-Q543 CarbonylContact O-C 3.59Å; R416-Q543 WeakPolarHBondContact O-CA 3.18Å; Y417-Q543 HydrophobicContact CD1-CG 4.17Å; Y417-Q543 HydrophobicContact CE1-CG 3.48Å; Y417-Q543 VanDerWaalsContact CE1-CG 3.48Å; Y417-Q543 HydrophobicContact CE2-CG 4.36Å; Y417-Q543 PolarHBondContact OH-NE2 2.94Å; Q543-K545 PolarHBondContact O-N 3.29Å; Q543-V555 PolarHBondContact NE2-O 2.97Å
544N80.3Confident86.4Confident9 Ų952.7 Ų52.75%0.04827%0.266CS..  trans-66.5114.6166.4-170.4-7000110.2R416 I466 S546 F547R416-N544 WeakPolarHBondContact O-CB 3.47Å; R416-N544 PolarHBondContact O-N 3.26Å; I466-N544 HydrophobicContact CD1-CB 3.93Å; I466-N544 HydrophobicContact CG1-CB 4.1Å; I466-N544 HydrophobicContact CG2-CB 3.87Å; N544-S546 PolarHBondContact OD1-N 2.84Å; N544-S546 PolarHBondContact OD1-OG 3.34Å; N544-F547 HydrophobicContact CB-CE2 3.82Å; N544-F547 HydrophobicContact CB-CZ 4.02Å; N544-F547 WeakPolarHBondContact ND2-CZ 3.38Å; N544-F547 WeakPolarHBondContact O-CE2 3.44Å
545K75.4Confident86.2Confident149 Ų14951.4 Ų51.465%0.64826%0.261SS*.  trans-109.42.5176.7-67-179-175.7172.40113.1Q543 F547 K551Q543-K545 PolarHBondContact O-N 3.29Å; K545-F547 PolarHBondContact O-N 2.81Å; K545-F547 VanDerWaalsContact O-N 3.11Å; K545-K551 WeakPolarHBondContact O-CE 3.49Å; K545-K551 PolarHBondContact O-NZ 3.41Å
546S67.7Low86.1Confident82 Ų8250.7 Ų50.757%0.57326%0.256SS*.  trans-74.70.1-171.668.30000115.1N544N544-S546 PolarHBondContact OD1-N 2.84Å; N544-S546 PolarHBondContact OD1-OG 3.34Å
547F70.8Confident86.1Confident24 Ų2451.4 Ų51.411%0.10526%0.258CS..  trans-75.1130.4-175.7-48.3-75.2000113.3R93 N544 K545 S549 K551R93-F547 VanDerWaalsContact CZ-CE2 3.4Å; R93-F547 VanDerWaalsContact NH1-CE2 3.31Å; N544-F547 HydrophobicContact CB-CE2 3.82Å; N544-F547 HydrophobicContact CB-CZ 4.02Å; N544-F547 WeakPolarHBondContact ND2-CZ 3.38Å; N544-F547 WeakPolarHBondContact O-CE2 3.44Å; K545-F547 PolarHBondContact O-N 2.81Å; K545-F547 VanDerWaalsContact O-N 3.11Å; F547-S549 PolarHBondContact O-N 2.95Å; F547-K551 WeakPolarHBondContact O-CE 3.4Å; F547-K551 PolarHBondContact O-NZ 3.19Å
548D72Confident86.3Confident145 Ų14551.6 Ų51.678%0.77526%0.259SS*.SBendtrans-84.526.5173-61.5-27.9000113.8
549S82.1Confident86.6Confident21 Ų2151.7 Ų51.715%0.14726%0.259CS..SBendtrans-129173.2-175.852.80000110.8R93 F547 K551R93-S549 VanDerWaalsContact CG-OG 3.23Å; R93-S549 WeakPolarHBondContact CG-OG 3.29Å; F547-S549 PolarHBondContact O-N 2.95Å; S549-K551 PolarHBondContact O-N 3.37Å
550F89.3Confident86.8Confident65 Ų6548.4 Ų48.429%0.28525%0.245SC..  trans-54.8140.1178.9176.5-98.6000111.7L85 A88 E89 P272 V552L85-F550 HydrophobicContact CD2-CE1 4.37Å; L85-F550 HydrophobicContact CD2-CZ 3.93Å; A88-F550 HydrophobicContact CB-CD1 3.88Å; A88-F550 HydrophobicContact CB-CE1 3.93Å; E89-F550 HydrophobicContact CB-CD1 4.27Å; P272-F550 HydrophobicContact CB-CB 3.73Å; P272-F550 HydrophobicContact CB-CD1 4.03Å; P272-F550 HydrophobicContact CB-CD2 4.05Å; P272-F550 HydrophobicContact CB-CG 3.65Å; P272-F550 HydrophobicContact CG-CB 3.84Å; P272-F550 HydrophobicContact CG-CG 4.3Å; F550-V552 HydrophobicContact CE1-CG2 4.39Å
551K91.1Very high87.2Confident73 Ų7350.8 Ų50.832%0.31726%0.257SS..  trans-129121.7-176.9-77.2168.8-164.3160.10108R416 K545 F547 S549R416-K551 VanDerWaalsContact NH2-CB 3.27Å; K545-K551 WeakPolarHBondContact O-CE 3.49Å; K545-K551 PolarHBondContact O-NZ 3.41Å; F547-K551 WeakPolarHBondContact O-CE 3.4Å; F547-K551 PolarHBondContact O-NZ 3.19Å; S549-K551 PolarHBondContact O-N 3.37Å
552V92.3Very high87.6Confident2 Ų250.6 Ų50.61%0.01226%0.257CS..  trans-51.8128.7167.2178.80000108.9L85 E89 R416 F550 V555 I558L85-V552 VanDerWaalsContact C-CG2 3.46Å; L85-V552 HydrophobicContact CB-CG2 4.08Å; L85-V552 WeakPolarHBondContact O-CG2 3.29Å; E89-V552 HydrophobicContact CB-CG2 3.85Å; E89-V552 VanDerWaalsContact OE2-CB 3.27Å; E89-V552 WeakPolarHBondContact OE2-CB 3.12Å; E89-V552 VanDerWaalsContact OE2-CG2 3.27Å; E89-V552 WeakPolarHBondContact OE2-CG2 3.48Å; E89-V552 PolarHBondContact OE2-N 3.32Å; R416-V552 VanDerWaalsContact NH2-N 3.18Å; R416-V552 PolarHBondContact NH2-O 3.28Å; F550-V552 HydrophobicContact CE1-CG2 4.39Å; V552-V555 HydrophobicContact CB-CG2 3.99Å; V552-V555 HydrophobicContact CG1-CG2 4.06Å; V552-I558 HydrophobicContact CG1-CB 3.81Å; V552-I558 HydrophobicContact CG1-CD1 4.11Å; V552-I558 HydrophobicContact CG1-CG2 3.61Å
553P91.1Very high88.1Confident58 Ų5847.7 Ų47.738%0.37724%0.243SC..THydrogen-bonded Turntrans-73.1160.3176.229.4-32.7000111V555 I558P553-V555 PolarHBondContact O-N 3.37Å; P553-I558 HydrophobicContact CG-CD1 3.82Å; P553-I558 VanDerWaalsContact O-CD1 3.23Å; P553-I558 WeakPolarHBondContact O-CD1 3.35Å
554F91.2Very high88.6Confident153 Ų15348.1 Ų48.167%0.67124%0.244SC*.THydrogen-bonded Turntrans54.228.3173.8-49.2-67.5000116.1L557 I558F554-L557 HydrophobicContact CB-CB 4.47Å; F554-L557 WeakPolarHBondContact O-CA 3.32Å; F554-L557 VanDerWaalsContact O-CB 3.29Å; F554-L557 WeakPolarHBondContact O-CB 3.48Å; F554-L557 PolarHBondContact O-N 3.29Å; F554-I558 HydrophobicContact CB-CG1 4.37Å; F554-I558 HydrophobicContact CD2-CD1 4.36Å
555V91.6Very high89.2Confident4 Ų449.6 Ų49.62%0.02425%0.252CS..THydrogen-bonded Turntrans-59.2133.3168.6176.40000108.5V412 Y417 Q543 V552 P553 P559V412-V555 HydrophobicContact CG1-CG2 4.3Å; Y417-V555 HydrophobicContact CE2-CG1 4.21Å; Q543-V555 PolarHBondContact NE2-O 2.97Å; V552-V555 HydrophobicContact CB-CG2 3.99Å; V552-V555 HydrophobicContact CG1-CG2 4.06Å; P553-V555 PolarHBondContact O-N 3.37Å; V555-P559 HydrophobicContact CG1-CG 4.46Å; V555-P559 HydrophobicContact CG2-CG 4.02Å
556P94Very high90.1Very high0 Ų042.5 Ų42.50%022%0.221CC..THydrogen-bonded Turncis-93.2-0.211.336.9-34.8000115.9Y417 V535 M538 F539 I558 P559 C560Y417-P556 HydrophobicContact CE2-CB 4.23Å; Y417-P556 WeakPolarHBondContact OH-CD 3.23Å; V535-P556 HydrophobicContact CG1-CG 4.44Å; M538-P556 HydrophobicContact CB-CB 4.19Å; M538-P556 HydrophobicContact CB-CG 3.69Å; M538-P556 HydrophobicContact CE-CB 4.11Å; M538-P556 HydrophobicContact CE-CG 4.28Å; M538-P556 HydrophobicContact SD-CB 4.16Å; F539-P556 HydrophobicContact CD2-CG 4.16Å; F539-P556 HydrophobicContact CE2-CG 4.19Å; F539-P556 HydrophobicContact CG-CG 4.49Å; P556-I558 PolarHBondContact O-N 3.11Å; P556-P559 WeakPolarHBondContact O-CD 3.46Å; P556-C560 WeakPolarHBondContact O-CB 3.23Å; P556-C560 PolarHBondContact O-N 3.24Å; P556-C560 PolarHBondContact O-SG 3.44Å
557L95.1Very high91.4Very high85 Ų8540 Ų4045%0.44520%0.2SC..Hα-helixtrans-58.4-49.6-174.2-68.6168.8000113.4V535 F539 F554 C560 L561V535-L557 HydrophobicContact CG1-CD2 3.75Å; F539-L557 HydrophobicContact CE2-CD1 3.9Å; F539-L557 HydrophobicContact CE2-CD2 3.81Å; F539-L557 HydrophobicContact CE2-CG 3.52Å; F539-L557 HydrophobicContact CZ-CD1 3.56Å; F539-L557 HydrophobicContact CZ-CD2 4.29Å; F539-L557 HydrophobicContact CZ-CG 3.49Å; F539-L557 VanDerWaalsContact CZ-CG 3.49Å; F554-L557 HydrophobicContact CB-CB 4.47Å; F554-L557 WeakPolarHBondContact O-CA 3.32Å; F554-L557 VanDerWaalsContact O-CB 3.29Å; F554-L557 WeakPolarHBondContact O-CB 3.48Å; F554-L557 PolarHBondContact O-N 3.29Å; L557-C560 PolarHBondContact O-N 2.9Å; L557-L561 VanDerWaalsContact O-CB 3.25Å; L557-L561 WeakPolarHBondContact O-CB 3.44Å; L557-L561 PolarHBondContact O-N 2.75Å
558I95.9Very high92.4Very high19 Ų1939.8 Ų39.810%0.09720%0.202CC..Hα-helixtrans-61.8-53.1-178.2-70.4-174.5000111.2L82 L85 V552 P553 F554 P556 C560 L561 C562L82-I558 HydrophobicContact CD2-CD1 4.39Å; L82-I558 HydrophobicContact CD2-CG1 4.45Å; L82-I558 HydrophobicContact CD2-CG2 4.08Å; L85-I558 HydrophobicContact CD1-CD1 4.32Å; V552-I558 HydrophobicContact CG1-CB 3.81Å; V552-I558 HydrophobicContact CG1-CD1 4.11Å; V552-I558 HydrophobicContact CG1-CG2 3.61Å; P553-I558 HydrophobicContact CG-CD1 3.82Å; P553-I558 VanDerWaalsContact O-CD1 3.23Å; P553-I558 WeakPolarHBondContact O-CD1 3.35Å; F554-I558 HydrophobicContact CB-CG1 4.37Å; F554-I558 HydrophobicContact CD2-CD1 4.36Å; P556-I558 PolarHBondContact O-N 3.11Å; I558-C560 VanDerWaalsContact C-N 3.34Å; I558-C560 PolarHBondContact O-N 3.03Å; I558-L561 PolarHBondContact O-N 2.96Å; I558-C562 PolarHBondContact O-N 2.92Å; I558-C562 PolarHBondContact O-SG 3.34Å
559P96.6Very high93.1Very high1 Ų134.4 Ų34.41%0.00617%0.173CC..Hα-helixtrans-59.4-41176.4-26.634.4000113.8S409 V412 C413 V555 P556 C562 V563S409-P559 WeakPolarHBondContact O-CB 3.26Å; V412-P559 HydrophobicContact CB-CG 4.39Å; V412-P559 HydrophobicContact CG1-CG 3.97Å; C413-P559 VanDerWaalsContact SG-CB 3.55Å; V555-P559 HydrophobicContact CG1-CG 4.46Å; V555-P559 HydrophobicContact CG2-CG 4.02Å; P556-P559 WeakPolarHBondContact O-CD 3.46Å; P559-C562 WeakPolarHBondContact O-CB 3.37Å; P559-C562 PolarHBondContact O-N 2.84Å; P559-V563 WeakPolarHBondContact O-CG2 3.35Å; P559-V563 PolarHBondContact O-N 3.36Å
560C97.5Very high93.4Very high2 Ų233.6 Ų33.61%0.01417%0.166CC..Hα-helixtrans-60.4-46.2175.7-79.10000111.7Y495 V535 M538 P556 L557 I558 C562 V563 F564Y495-C560 HydrophobicContact CD1-CB 4.27Å; Y495-C560 HydrophobicContact CE1-CB 3.54Å; Y495-C560 HydrophobicContact CE2-CB 4.15Å; Y495-C560 VanDerWaalsContact CZ-CB 3.47Å; Y495-C560 VanDerWaalsContact OH-C 3.24Å; Y495-C560 PolarHBondContact OH-O 3.17Å; V535-C560 HydrophobicContact CG2-CB 4.26Å; M538-C560 WeakPolarHBondContact CE-SG 3.3Å; P556-C560 WeakPolarHBondContact O-CB 3.23Å; P556-C560 PolarHBondContact O-N 3.24Å; P556-C560 PolarHBondContact O-SG 3.44Å; L557-C560 PolarHBondContact O-N 2.9Å; I558-C560 VanDerWaalsContact C-N 3.34Å; I558-C560 PolarHBondContact O-N 3.03Å; C560-C562 VanDerWaalsContact C-N 3.3Å; C560-C562 PolarHBondContact O-N 2.91Å; C560-V563 WeakPolarHBondContact O-CB 3.35Å; C560-V563 PolarHBondContact O-N 2.88Å; C560-F564 PolarHBondContact O-N 2.85Å
561L96.4Very high93.4Very high74 Ų7431.6 Ų31.639%0.38716%0.159SC..Hα-helixtrans-60.1-40.6175.5-178.661000111.5L82 L557 I558 F564 L565L82-L561 HydrophobicContact CD1-CD2 3.72Å; L82-L561 HydrophobicContact CD1-CG 4.22Å; L557-L561 VanDerWaalsContact O-CB 3.25Å; L557-L561 WeakPolarHBondContact O-CB 3.44Å; L557-L561 PolarHBondContact O-N 2.75Å; I558-L561 PolarHBondContact O-N 2.96Å; L561-F564 HydrophobicContact CD1-CD1 4.46Å; L561-F564 PolarHBondContact O-N 3.22Å; L561-L565 HydrophobicContact CD1-CD1 4.1Å; L561-L565 HydrophobicContact CD1-CG 4.07Å; L561-L565 HydrophobicContact CG-CD1 3.91Å; L561-L565 HydrophobicContact CG-CG 4.3Å; L561-L565 WeakPolarHBondContact O-CB 3.36Å; L561-L565 VanDerWaalsContact O-CG 3.26Å; L561-L565 WeakPolarHBondContact O-CG 3.38Å; L561-L565 PolarHBondContact O-N 3.02Å
562C96.5Very high93Very high0 Ų033.7 Ų33.70%017%0.169CC..Hα-helixtrans-59.1-49.4174.2-62.50000111.5L82 S409 I558 P559 C560 F564 L565 N566L82-C562 VanDerWaalsContact CB-SG 3.55Å; L82-C562 PolarHBondContact O-SG 3.43Å; S409-C562 WeakPolarHBondContact OG-CB 3.4Å; I558-C562 PolarHBondContact O-N 2.92Å; I558-C562 PolarHBondContact O-SG 3.34Å; P559-C562 WeakPolarHBondContact O-CB 3.37Å; P559-C562 PolarHBondContact O-N 2.84Å; C560-C562 VanDerWaalsContact C-N 3.3Å; C560-C562 PolarHBondContact O-N 2.91Å; C562-F564 VanDerWaalsContact C-N 3.32Å; C562-F564 PolarHBondContact O-N 3.39Å; C562-L565 PolarHBondContact O-N 3.22Å; C562-N566 WeakPolarHBondContact O-CB 3.29Å; C562-N566 PolarHBondContact O-N 2.73Å; C562-N566 PolarHBondContact O-ND2 3.2Å; C562-N566 PolarHBondContact O-OD1 3.15Å
563V97Very high92.5Very high1 Ų135 Ų351%0.00618%0.175CC..Hα-helixtrans-55.7-47.4176.9169.10000110.9T406 M410 Y495 T496 A499 P559 C560 N566 F567T406-V563 HydrophobicContact CG2-CB 4.49Å; T406-V563 HydrophobicContact CG2-CG1 4.07Å; T406-V563 HydrophobicContact CG2-CG2 4.17Å; M410-V563 HydrophobicContact CG-CG2 4.04Å; Y495-V563 HydrophobicContact CE1-CB 4.35Å; Y495-V563 HydrophobicContact CE1-CG1 4.3Å; T496-V563 HydrophobicContact CG2-CG1 4.01Å; A499-V563 HydrophobicContact CB-CG1 4.48Å; P559-V563 WeakPolarHBondContact O-CG2 3.35Å; P559-V563 PolarHBondContact O-N 3.36Å; C560-V563 WeakPolarHBondContact O-CB 3.35Å; C560-V563 PolarHBondContact O-N 2.88Å; V563-N566 PolarHBondContact O-N 3.44Å; V563-F567 HydrophobicContact CG1-CD2 3.83Å; V563-F567 HydrophobicContact CG1-CE2 3.46Å; V563-F567 VanDerWaalsContact CG1-CE2 3.46Å; V563-F567 HydrophobicContact CG1-CZ 4.24Å; V563-F567 WeakPolarHBondContact O-CD2 3.29Å; V563-F567 WeakPolarHBondContact O-CG 3.3Å; V563-F567 PolarHBondContact O-N 3.33Å
564F96.7Very high92.1Very high43 Ų4334.3 Ų34.319%0.18917%0.172CC..Hα-helixtrans-62.8-48178.3173.1-108000112.6A499 L502 A503 L506 C560 L561 C562 N566 F567 C568A499-F564 HydrophobicContact CB-CB 4.29Å; A499-F564 HydrophobicContact CB-CD2 4.28Å; L502-F564 HydrophobicContact CB-CD2 4.43Å; L502-F564 HydrophobicContact CB-CE2 3.8Å; A503-F564 HydrophobicContact CB-CE2 4.44Å; L506-F564 HydrophobicContact CD1-CE2 4.19Å; L506-F564 HydrophobicContact CD1-CZ 3.71Å; C560-F564 PolarHBondContact O-N 2.85Å; L561-F564 HydrophobicContact CD1-CD1 4.46Å; L561-F564 PolarHBondContact O-N 3.22Å; C562-F564 VanDerWaalsContact C-N 3.32Å; C562-F564 PolarHBondContact O-N 3.39Å; F564-N566 VanDerWaalsContact C-N 3.34Å; F564-N566 PolarHBondContact O-N 2.93Å; F564-F567 PolarHBondContact O-N 2.91Å; F564-C568 VanDerWaalsContact CZ-SG 3.54Å; F564-C568 PolarHBondContact O-N 3.19Å; F564-C568 PolarHBondContact O-SG 3.21Å
565L93.9Very high91.9Very high41 Ų4132.1 Ų32.122%0.21517%0.173CC..Hα-helixtrans-63.5-40.3179.1-69174.1000111.8T79 L82 L561 C562 F567 C568 L569T79-L565 HydrophobicContact CG2-CB 3.73Å; T79-L565 HydrophobicContact CG2-CD1 3.88Å; T79-L565 HydrophobicContact CG2-CG 4.38Å; L82-L565 HydrophobicContact CD1-CD1 4.13Å; L561-L565 HydrophobicContact CD1-CD1 4.1Å; L561-L565 HydrophobicContact CD1-CG 4.07Å; L561-L565 HydrophobicContact CG-CD1 3.91Å; L561-L565 HydrophobicContact CG-CG 4.3Å; L561-L565 WeakPolarHBondContact O-CB 3.36Å; L561-L565 VanDerWaalsContact O-CG 3.26Å; L561-L565 WeakPolarHBondContact O-CG 3.38Å; L561-L565 PolarHBondContact O-N 3.02Å; C562-L565 PolarHBondContact O-N 3.22Å; L565-F567 VanDerWaalsContact C-N 3.33Å; L565-F567 PolarHBondContact O-N 3.04Å; L565-C568 WeakPolarHBondContact O-CB 3.23Å; L565-C568 PolarHBondContact O-N 2.81Å; L565-L569 WeakPolarHBondContact O-CG 3.32Å; L565-L569 PolarHBondContact O-N 3.3Å
566N93.8Very high91.4Very high0 Ų036.1 Ų36.10%019%0.192CC..Hα-helixtrans-63.3-41175.7-65.8-15.2000110.8N83 L402 Y405 T406 C562 V563 F564 L569 M570N83-N566 PolarHBondContact ND2-OD1 2.87Å; N83-N566 PolarHBondContact OD1-ND2 3.41Å; L402-N566 HydrophobicContact CD2-CB 4.13Å; Y405-N566 WeakPolarHBondContact CB-ND2 3.19Å; T406-N566 PolarHBondContact N-ND2 2.65Å; T406-N566 WeakPolarHBondContact OG1-CB 3.38Å; T406-N566 PolarHBondContact OG1-ND2 3.03Å; C562-N566 WeakPolarHBondContact O-CB 3.29Å; C562-N566 PolarHBondContact O-N 2.73Å; C562-N566 PolarHBondContact O-ND2 3.2Å; C562-N566 PolarHBondContact O-OD1 3.15Å; V563-N566 PolarHBondContact O-N 3.44Å; F564-N566 VanDerWaalsContact C-N 3.34Å; F564-N566 PolarHBondContact O-N 2.93Å; N566-L569 PolarHBondContact O-N 2.6Å; N566-M570 HydrophobicContact CB-CE 3.92Å; N566-M570 VanDerWaalsContact O-CG 3.31Å; N566-M570 WeakPolarHBondContact O-CG 3.17Å; N566-M570 PolarHBondContact O-N 3.4Å
567F94Very high91Very high28 Ų2836.4 Ų36.412%0.12319%0.194CC..Hα-helixtrans-64.2-40.9173.5-73.4-39000112.8T406 T496 A499 F500 A503 V563 F564 L565 L569 M570 V571T406-F567 HydrophobicContact CG2-CE1 4.22Å; T406-F567 HydrophobicContact CG2-CZ 3.99Å; T496-F567 WeakPolarHBondContact O-CE2 3.42Å; A499-F567 HydrophobicContact CB-CD2 4Å; A499-F567 HydrophobicContact CB-CE2 4.34Å; F500-F567 HydrophobicContact CB-CD2 3.96Å; F500-F567 HydrophobicContact CB-CE2 4Å; F500-F567 HydrophobicContact CB-CG 4.27Å; F500-F567 HydrophobicContact CB-CZ 4.34Å; F500-F567 HydrophobicContact CD2-CB 4.44Å; F500-F567 AromaticContact CD2-CD1 3.73Å; F500-F567 HydrophobicContact CD2-CD1 3.73Å; F500-F567 HydrophobicContact CD2-CE1 4.04Å; F500-F567 HydrophobicContact CD2-CG 4.01Å; A503-F567 HydrophobicContact CB-CB 3.8Å; V563-F567 HydrophobicContact CG1-CD2 3.83Å; V563-F567 HydrophobicContact CG1-CE2 3.46Å; V563-F567 VanDerWaalsContact CG1-CE2 3.46Å; V563-F567 HydrophobicContact CG1-CZ 4.24Å; V563-F567 WeakPolarHBondContact O-CD2 3.29Å; V563-F567 WeakPolarHBondContact O-CG 3.3Å; V563-F567 PolarHBondContact O-N 3.33Å; F564-F567 PolarHBondContact O-N 2.91Å; L565-F567 VanDerWaalsContact C-N 3.33Å; L565-F567 PolarHBondContact O-N 3.04Å; F567-L569 PolarHBondContact O-N 3.49Å; F567-M570 HydrophobicContact CD1-CE 3.67Å; F567-M570 HydrophobicContact CD1-SD 4.13Å; F567-M570 HydrophobicContact CE1-CE 3.98Å; F567-M570 HydrophobicContact CE1-SD 4.46Å; F567-M570 PolarHBondContact O-N 3.36Å; F567-M570 VanDerWaalsContact O-N 3.15Å; F567-V571 WeakPolarHBondContact O-CG1 3.46Å; F567-V571 WeakPolarHBondContact O-CG2 3.32Å; F567-V571 PolarHBondContact O-N 3.5Å
568C91.4Very high90.7Very high21 Ų2136.2 Ų36.214%0.14219%0.188CC..Hα-helixtrans-55.1-40.3173.1-75.10000111.9L507 F564 L565 V571L507-C568 HydrophobicContact CD1-CB 3.7Å; L507-C568 WeakPolarHBondContact CD1-O 3.12Å; F564-C568 VanDerWaalsContact CZ-SG 3.54Å; F564-C568 PolarHBondContact O-N 3.19Å; F564-C568 PolarHBondContact O-SG 3.21Å; L565-C568 WeakPolarHBondContact O-CB 3.23Å; L565-C568 PolarHBondContact O-N 2.81Å; C568-V571 WeakPolarHBondContact O-CG2 3.44Å
569L87.7Confident90.4Very high32 Ų3238.7 Ų38.717%0.16820%0.204CC..Hα-helixtrans-71.1-42.5176-65.4177.4000112.4T79 F248 L402 L565 N566 F567 K572T79-L569 HydrophobicContact CG2-CD1 4.42Å; F248-L569 HydrophobicContact CB-CD1 3.89Å; F248-L569 HydrophobicContact CD1-CD1 3.84Å; F248-L569 HydrophobicContact CD2-CD1 3.65Å; F248-L569 HydrophobicContact CE1-CD1 4.3Å; F248-L569 HydrophobicContact CE2-CD1 4.12Å; F248-L569 HydrophobicContact CG-CD1 3.48Å; F248-L569 VanDerWaalsContact CG-CD1 3.48Å; F248-L569 HydrophobicContact CZ-CD1 4.41Å; L402-L569 HydrophobicContact CD1-CB 3.62Å; L402-L569 HydrophobicContact CD2-CB 4.06Å; L402-L569 HydrophobicContact CD2-CD1 3.83Å; L565-L569 WeakPolarHBondContact O-CG 3.32Å; L565-L569 PolarHBondContact O-N 3.3Å; N566-L569 PolarHBondContact O-N 2.6Å; F567-L569 PolarHBondContact O-N 3.49Å; L569-K572 PolarHBondContact O-N 2.93Å
570M89Confident89.9Confident3 Ų340.3 Ų40.32%0.01521%0.209CC..Hα-helixtrans-63.9-41.5-179.2-74.5-174.1-118.600113.3L402 I403 T406 N566 F567 K572 L573 W578L402-M570 HydrophobicContact CB-CE 3.85Å; L402-M570 HydrophobicContact CB-CG 3.63Å; L402-M570 HydrophobicContact CB-SD 4.18Å; L402-M570 HydrophobicContact CD1-CG 3.78Å; L402-M570 HydrophobicContact CG-CG 4.34Å; L402-M570 WeakPolarHBondContact O-CE 3.4Å; I403-M570 HydrophobicContact CG1-CE 4.38Å; I403-M570 HydrophobicContact CG1-SD 3.76Å; T406-M570 VanDerWaalsContact OG1-CE 3.23Å; T406-M570 WeakPolarHBondContact OG1-CE 3.41Å; N566-M570 HydrophobicContact CB-CE 3.92Å; N566-M570 VanDerWaalsContact O-CG 3.31Å; N566-M570 WeakPolarHBondContact O-CG 3.17Å; N566-M570 PolarHBondContact O-N 3.4Å; F567-M570 HydrophobicContact CD1-CE 3.67Å; F567-M570 HydrophobicContact CD1-SD 4.13Å; F567-M570 HydrophobicContact CE1-CE 3.98Å; F567-M570 HydrophobicContact CE1-SD 4.46Å; F567-M570 PolarHBondContact O-N 3.36Å; F567-M570 VanDerWaalsContact O-N 3.15Å; M570-K572 PolarHBondContact O-N 2.92Å; M570-L573 WeakPolarHBondContact O-CB 3.44Å; M570-L573 PolarHBondContact O-N 3.37Å; M570-L573 VanDerWaalsContact O-N 3.16Å; M570-W578 HydrophobicContact CB-CZ2 4.09Å
571V88.9Confident89.5Confident23 Ų2340.7 Ų40.714%0.13921%0.211CC..THydrogen-bonded Turntrans-70.9-14.4-177.3-61.40000113.5F500 A503 L507 P508 F567 C568F500-V571 HydrophobicContact CD2-CG1 4.41Å; F500-V571 HydrophobicContact CE2-CG1 3.9Å; F500-V571 HydrophobicContact CZ-CG1 4.41Å; A503-V571 HydrophobicContact CB-CG1 4.37Å; A503-V571 HydrophobicContact CB-CG2 4.28Å; L507-V571 HydrophobicContact CB-CG2 3.94Å; L507-V571 HydrophobicContact CD1-CG2 3.76Å; L507-V571 HydrophobicContact CG-CG2 4.45Å; P508-V571 HydrophobicContact CG-CB 4.2Å; P508-V571 HydrophobicContact CG-CG2 4.42Å; F567-V571 WeakPolarHBondContact O-CG1 3.46Å; F567-V571 WeakPolarHBondContact O-CG2 3.32Å; F567-V571 PolarHBondContact O-N 3.5Å; C568-V571 WeakPolarHBondContact O-CG2 3.44Å
572K83Confident89.3Confident118 Ų11841.6 Ų41.651%0.51322%0.215SC..THydrogen-bonded Turntrans-85.5-12.1174.1-93.7-127.3176.1178.40113.7L507 L569 M570L507-K572 HydrophobicContact CB-CG 4.39Å; L507-K572 HydrophobicContact CD1-CG 4.23Å; L569-K572 PolarHBondContact O-N 2.93Å; M570-K572 PolarHBondContact O-N 2.92Å
573L81.9Confident89.1Confident29 Ų2946.2 Ų46.215%0.15224%0.239CC..SBendtrans-70.5152.3179.2-63.1174.1000111.1I399 M570 T577I399-L573 HydrophobicContact CB-CD1 3.64Å; I399-L573 HydrophobicContact CD1-CD1 4.2Å; I399-L573 HydrophobicContact CG1-CD1 4.23Å; M570-L573 WeakPolarHBondContact O-CB 3.44Å; M570-L573 PolarHBondContact O-N 3.37Å; M570-L573 VanDerWaalsContact O-N 3.16Å; L573-T577 HydrophobicContact CB-CG2 4.4Å; L573-T577 HydrophobicContact CD1-CG2 4.4Å
574S82.7Confident88.8Confident43 Ų4347.7 Ų47.730%0.30124%0.244SC..  trans-61.7148-179.285.10000111.4M576 T577 W578S574-M576 PolarHBondContact O-N 3.46Å; S574-M576 PolarHBondContact OG-N 3.29Å; S574-T577 VanDerWaalsContact O-CB 3.24Å; S574-T577 WeakPolarHBondContact O-CB 3.31Å; S574-T577 PolarHBondContact O-N 3.39Å; S574-T577 PolarHBondContact OG-N 3.02Å; S574-T577 VanDerWaalsContact OG-N 3.08Å; S574-T577 PolarHBondContact OG-OG1 3.36Å; S574-W578 PolarHBondContact O-N 2.87Å
575P85.7Confident88.7Confident107 Ų10747.5 Ų47.570%0.69525%0.245SC*.Hα-helixtrans-57.1-32172.9-25.634.8000112.9T577 W578 V579P575-T577 VanDerWaalsContact C-N 3.3Å; P575-T577 PolarHBondContact O-N 2.73Å; P575-W578 WeakPolarHBondContact O-CB 3.2Å; P575-W578 PolarHBondContact O-N 2.78Å; P575-V579 WeakPolarHBondContact O-CG2 3.37Å; P575-V579 PolarHBondContact O-N 3.36Å; P575-V579 VanDerWaalsContact O-N 3.11Å
576M82.1Confident88.7Confident88 Ų8848.9 Ų48.943%0.43326%0.255SS..Hα-helixtrans-66.5-33.7178.4-166.859.1178.800112S574 W578 V579 R580S574-M576 PolarHBondContact O-N 3.46Å; S574-M576 PolarHBondContact OG-N 3.29Å; M576-W578 VanDerWaalsContact C-N 3.33Å; M576-W578 PolarHBondContact O-N 2.88Å; M576-V579 PolarHBondContact O-N 3.23Å; M576-R580 VanDerWaalsContact O-CG 3.3Å; M576-R580 WeakPolarHBondContact O-CG 3.38Å; M576-R580 PolarHBondContact O-N 3.36Å; M576-R580 VanDerWaalsContact O-N 3.08Å
577T85.2Confident88.7Confident6 Ų652.5 Ų52.54%0.03727%0.274CS..Hα-helixtrans-59.7-43.8172.6-55.10000111.2D395 I399 L573 S574 P575 R580 F581D395-T577 VanDerWaalsContact O-CG2 3.27Å; D395-T577 WeakPolarHBondContact O-CG2 3.35Å; I399-T577 HydrophobicContact CB-CG2 4.14Å; I399-T577 HydrophobicContact CG2-CG2 3.76Å; L573-T577 HydrophobicContact CB-CG2 4.4Å; L573-T577 HydrophobicContact CD1-CG2 4.4Å; S574-T577 VanDerWaalsContact O-CB 3.24Å; S574-T577 WeakPolarHBondContact O-CB 3.31Å; S574-T577 PolarHBondContact O-N 3.39Å; S574-T577 PolarHBondContact OG-N 3.02Å; S574-T577 VanDerWaalsContact OG-N 3.08Å; S574-T577 PolarHBondContact OG-OG1 3.36Å; P575-T577 VanDerWaalsContact C-N 3.3Å; P575-T577 PolarHBondContact O-N 2.73Å; T577-R580 PolarHBondContact O-N 3.23Å; T577-F581 PolarHBondContact O-N 3.31Å
578W88.6Confident88.7Confident81 Ų8151.1 Ų51.131%0.30727%0.268SS..Hα-helixtrans-63.9-43.9176.7-7793.1000112.5I399 M570 S574 P575 M576 R580 F581 I582I399-W578 HydrophobicContact CD1-CD2 3.38Å; I399-W578 VanDerWaalsContact CD1-CE2 3.41Å; I399-W578 HydrophobicContact CD1-CE3 3.6Å; I399-W578 HydrophobicContact CD1-CG 3.93Å; I399-W578 HydrophobicContact CD1-CH2 3.88Å; I399-W578 HydrophobicContact CD1-CZ2 3.69Å; I399-W578 HydrophobicContact CD1-CZ3 3.84Å; M570-W578 HydrophobicContact CB-CZ2 4.09Å; S574-W578 PolarHBondContact O-N 2.87Å; P575-W578 WeakPolarHBondContact O-CB 3.2Å; P575-W578 PolarHBondContact O-N 2.78Å; M576-W578 VanDerWaalsContact C-N 3.33Å; M576-W578 PolarHBondContact O-N 2.88Å; W578-R580 VanDerWaalsContact C-N 3.35Å; W578-R580 PolarHBondContact O-N 3.07Å; W578-F581 PolarHBondContact O-N 2.96Å; W578-I582 VanDerWaalsContact O-CG1 3.28Å; W578-I582 WeakPolarHBondContact O-CG1 3.25Å; W578-I582 PolarHBondContact O-N 3.14Å
579V89.2Confident88.9Confident72 Ų7252.1 Ų52.144%0.43627%0.271SS..Hα-helixtrans-59-47.3177.9172.80000110.8P575 M576 F581 I582 I583P575-V579 WeakPolarHBondContact O-CG2 3.37Å; P575-V579 PolarHBondContact O-N 3.36Å; P575-V579 VanDerWaalsContact O-N 3.11Å; M576-V579 PolarHBondContact O-N 3.23Å; V579-F581 VanDerWaalsContact C-N 3.33Å; V579-F581 PolarHBondContact O-N 2.9Å; V579-I582 PolarHBondContact O-N 3.17Å; V579-I583 HydrophobicContact CG1-CD1 3.89Å; V579-I583 VanDerWaalsContact O-CG1 3.3Å; V579-I583 WeakPolarHBondContact O-CG1 3.49Å; V579-I583 PolarHBondContact O-N 3.19Å
580R87Confident89.2Confident34 Ų3456 Ų5613%0.12829%0.291CS..Hα-helixtrans-61.6-41.4178.7-68.3167.9-178.4-140.35.2112.1F164 F396 M576 T577 W578 I583 W584F164-R580 VanDerWaalsContact CD2-NH1 3.35Å; F396-R580 HydrophobicContact CD2-CB 4.1Å; F396-R580 HydrophobicContact CE1-CB 4.21Å; F396-R580 HydrophobicContact CE2-CB 3.73Å; F396-R580 HydrophobicContact CZ-CB 3.78Å; M576-R580 VanDerWaalsContact O-CG 3.3Å; M576-R580 WeakPolarHBondContact O-CG 3.38Å; M576-R580 PolarHBondContact O-N 3.36Å; M576-R580 VanDerWaalsContact O-N 3.08Å; T577-R580 PolarHBondContact O-N 3.23Å; W578-R580 VanDerWaalsContact C-N 3.35Å; W578-R580 PolarHBondContact O-N 3.07Å; R580-I583 PolarHBondContact O-N 2.96Å; R580-W584 PolarHBondContact O-N 2.81Å
581F88.6Confident89.3Confident10 Ų1058.4 Ų58.44%0.04430%0.304CS..Hα-helixtrans-64.8-43.6176.3-176.5-101.2000112.4F396 I399 I403 T577 W578 V579 I583 W584 L585F396-F581 HydrophobicContact CE2-CB 3.95Å; F396-F581 HydrophobicContact CE2-CD2 4.49Å; I399-F581 HydrophobicContact CG1-CG 4.41Å; I399-F581 HydrophobicContact CG2-CB 3.92Å; I399-F581 HydrophobicContact CG2-CD2 3.91Å; I399-F581 HydrophobicContact CG2-CG 4.02Å; I403-F581 HydrophobicContact CD1-CD1 4.01Å; I403-F581 HydrophobicContact CD1-CE1 3.29Å; I403-F581 HydrophobicContact CD1-CE2 4.27Å; I403-F581 HydrophobicContact CD1-CZ 3.45Å; I403-F581 VanDerWaalsContact CD1-CZ 3.45Å; T577-F581 PolarHBondContact O-N 3.31Å; W578-F581 PolarHBondContact O-N 2.96Å; V579-F581 VanDerWaalsContact C-N 3.33Å; V579-F581 PolarHBondContact O-N 2.9Å; F581-I583 VanDerWaalsContact C-N 3.33Å; F581-I583 PolarHBondContact O-N 3.29Å; F581-W584 PolarHBondContact O-N 2.86Å; F581-L585 HydrophobicContact CE1-CD1 3.86Å; F581-L585 HydrophobicContact CZ-CD1 4.12Å; F581-L585 WeakPolarHBondContact O-CB 3.24Å; F581-L585 PolarHBondContact O-N 3.41Å
582I92Very high89.4Confident94 Ų9457.3 Ų57.348%0.48230%0.297SS..Hα-helixtrans-61.5-42.9176.3-69.5165.9000110.7W578 V579 W584 L585 V586W578-I582 VanDerWaalsContact O-CG1 3.28Å; W578-I582 WeakPolarHBondContact O-CG1 3.25Å; W578-I582 PolarHBondContact O-N 3.14Å; V579-I582 PolarHBondContact O-N 3.17Å; I582-W584 PolarHBondContact O-N 3Å; I582-L585 PolarHBondContact O-N 3.16Å; I582-V586 HydrophobicContact CG2-CG2 4.32Å; I582-V586 VanDerWaalsContact O-CG2 3.27Å; I582-V586 WeakPolarHBondContact O-CG2 3.46Å; I582-V586 PolarHBondContact O-N 3.25Å
583I92.1Very high89.8Confident97 Ų9755.9 Ų55.950%0.49729%0.291SS..Hα-helixtrans-59-48.3176.6-68.5164.8000110.5V579 R580 F581 L585 V586 I587V579-I583 HydrophobicContact CG1-CD1 3.89Å; V579-I583 VanDerWaalsContact O-CG1 3.3Å; V579-I583 WeakPolarHBondContact O-CG1 3.49Å; V579-I583 PolarHBondContact O-N 3.19Å; R580-I583 PolarHBondContact O-N 2.96Å; F581-I583 VanDerWaalsContact C-N 3.33Å; F581-I583 PolarHBondContact O-N 3.29Å; I583-L585 VanDerWaalsContact C-N 3.33Å; I583-L585 PolarHBondContact O-N 2.82Å; I583-V586 PolarHBondContact O-N 3.34Å; I583-I587 HydrophobicContact CG2-CD1 4.31Å; I583-I587 WeakPolarHBondContact O-CG1 3.24Å; I583-I587 PolarHBondContact O-N 2.78Å; I583-I587 VanDerWaalsContact O-N 3.08Å
584W92Very high90.1Very high31 Ų3157 Ų5712%0.11731%0.31CS..Hα-helixtrans-61.3-42.2177.4-179.9-103.2000112.7W118 L122 F380 F396 R580 F581 I582 V586 I587 G588W118-W584 AromaticContact CD1-CD1 3.58Å; W118-W584 AromaticContact CD1-CE2 3.99Å; W118-W584 AromaticContact CD1-NE1 3.21Å; W118-W584 HydrophobicContact CD2-CZ2 4.33Å; W118-W584 AromaticContact CE2-CE2 3.53Å; W118-W584 AromaticContact CE2-CZ2 3.59Å; W118-W584 AromaticContact CE2-NE1 3.58Å; W118-W584 AromaticContact CG-NE1 3.91Å; W118-W584 HydrophobicContact CH2-CH2 4.28Å; W118-W584 HydrophobicContact CH2-CZ2 4.04Å; W118-W584 HydrophobicContact CZ2-CD2 4.44Å; W118-W584 AromaticContact CZ2-CE2 3.77Å; W118-W584 AromaticContact CZ2-CH2 3.8Å; W118-W584 HydrophobicContact CZ2-CH2 3.8Å; W118-W584 AromaticContact CZ2-CZ2 3.43Å; W118-W584 HydrophobicContact CZ2-CZ2 3.43Å; W118-W584 VanDerWaalsContact CZ2-CZ2 3.43Å; W118-W584 HydrophobicContact CZ2-CZ3 4.42Å; W118-W584 AromaticContact NE1-CD1 3.42Å; W118-W584 AromaticContact NE1-CD2 3.83Å; W118-W584 AromaticContact NE1-CE2 3.29Å; W118-W584 VanDerWaalsContact NE1-CE2 3.29Å; W118-W584 AromaticContact NE1-CG 3.9Å; W118-W584 AromaticContact NE1-CZ2 3.88Å; W118-W584 AromaticContact NE1-NE1 2.98Å; W118-W584 PolarHBondContact NE1-O 3.24Å; W118-W584 PolarHBondContact O-NE1 3.26Å; L122-W584 HydrophobicContact CB-CD2 4.2Å; L122-W584 HydrophobicContact CB-CG 4.33Å; L122-W584 HydrophobicContact CB-CZ2 3.95Å; L122-W584 VanDerWaalsContact CB-NE1 3.3Å; L122-W584 HydrophobicContact CD1-CD2 3.93Å; L122-W584 HydrophobicContact CD1-CE3 4.17Å; L122-W584 HydrophobicContact CD1-CG 4.31Å; L122-W584 HydrophobicContact CD1-CZ2 4.33Å; L122-W584 HydrophobicContact CD1-CZ3 4.47Å; L122-W584 HydrophobicContact CD2-CB 3.97Å; L122-W584 VanDerWaalsContact CD2-CD1 3.42Å; L122-W584 HydrophobicContact CD2-CD2 4.02Å; L122-W584 HydrophobicContact CD2-CG 3.52Å; L122-W584 HydrophobicContact CG-CD2 4.25Å; L122-W584 HydrophobicContact CG-CG 4.25Å; F380-W584 AromaticContact CE1-CH2 3.94Å; F380-W584 HydrophobicContact CE1-CH2 3.94Å; F380-W584 AromaticContact CE1-CZ3 3.9Å; F380-W584 HydrophobicContact CE1-CZ3 3.9Å; F380-W584 HydrophobicContact CZ-CZ3 4.23Å; F396-W584 HydrophobicContact CZ-CB 4.48Å; R580-W584 PolarHBondContact O-N 2.81Å; F581-W584 PolarHBondContact O-N 2.86Å; I582-W584 PolarHBondContact O-N 3Å; W584-V586 VanDerWaalsContact C-N 3.34Å; W584-I587 WeakPolarHBondContact O-CB 2.92Å; W584-I587 PolarHBondContact O-N 2.9Å; W584-G588 PolarHBondContact O-N 2.83Å
585L93.2Very high90.4Very high39 Ų3957.8 Ų57.820%0.20431%0.306CS..Hα-helixtrans-64.6-39.8178.1-172.7140.7000111.2I115 F581 I582 I583 I587 G588 L589I115-L585 HydrophobicContact CG2-CD1 3.83Å; F581-L585 HydrophobicContact CE1-CD1 3.86Å; F581-L585 HydrophobicContact CZ-CD1 4.12Å; F581-L585 WeakPolarHBondContact O-CB 3.24Å; F581-L585 PolarHBondContact O-N 3.41Å; I582-L585 PolarHBondContact O-N 3.16Å; I583-L585 VanDerWaalsContact C-N 3.33Å; I583-L585 PolarHBondContact O-N 2.82Å; L585-I587 PolarHBondContact O-N 3.45Å; L585-G588 PolarHBondContact O-N 3.42Å; L585-L589 HydrophobicContact CD2-CD1 3.55Å; L585-L589 HydrophobicContact CD2-CG 3.97Å; L585-L589 WeakPolarHBondContact O-CG 3.33Å; L585-L589 PolarHBondContact O-N 2.94Å
586V95.3Very high90.2Very high70 Ų7052.7 Ų52.742%0.42427%0.273SS..Hα-helixtrans-61.2-43.1174.3168.80000111.3I582 I583 W584 G588 L589 I590I582-V586 HydrophobicContact CG2-CG2 4.32Å; I582-V586 VanDerWaalsContact O-CG2 3.27Å; I582-V586 WeakPolarHBondContact O-CG2 3.46Å; I582-V586 PolarHBondContact O-N 3.25Å; I583-V586 PolarHBondContact O-N 3.34Å; W584-V586 VanDerWaalsContact C-N 3.34Å; V586-G588 VanDerWaalsContact C-N 3.3Å; V586-G588 PolarHBondContact O-N 3.42Å; V586-L589 PolarHBondContact O-N 2.84Å; V586-I590 HydrophobicContact CG1-CD1 4.1Å; V586-I590 WeakPolarHBondContact O-CG1 3.18Å; V586-I590 PolarHBondContact O-N 2.84Å
587I94.3Very high90.2Very high76 Ų7651.8 Ų51.839%0.3927%0.265SS..Hα-helixtrans-58.4-45.7174.4-64.9166.3000110.3W118 I583 W584 L585 L589 I590 I591W118-I587 HydrophobicContact CZ2-CG2 4.16Å; I583-I587 HydrophobicContact CG2-CD1 4.31Å; I583-I587 WeakPolarHBondContact O-CG1 3.24Å; I583-I587 PolarHBondContact O-N 2.78Å; I583-I587 VanDerWaalsContact O-N 3.08Å; W584-I587 WeakPolarHBondContact O-CB 2.92Å; W584-I587 PolarHBondContact O-N 2.9Å; L585-I587 PolarHBondContact O-N 3.45Å; I587-L589 PolarHBondContact O-N 3.27Å; I587-I590 PolarHBondContact O-N 2.85Å; I587-I591 HydrophobicContact CG2-CD1 4.27Å; I587-I591 WeakPolarHBondContact O-CG1 3.39Å; I587-I591 PolarHBondContact O-N 3.38Å; I587-I591 VanDerWaalsContact O-N 3.14Å
588G93.9Very high89.9Confident0 Ų060.1 Ų60.10%030%0.296CS..Hα-helixtrans-60-45.7175.800000112.7F114 W584 L585 V586 I590 I591 Y592F114-G588 VanDerWaalsContact CE1-C 3.5Å; F114-G588 WeakPolarHBondContact CE1-O 3.47Å; F114-G588 WeakPolarHBondContact CZ-O 3.36Å; W584-G588 PolarHBondContact O-N 2.83Å; L585-G588 PolarHBondContact O-N 3.42Å; V586-G588 VanDerWaalsContact C-N 3.3Å; V586-G588 PolarHBondContact O-N 3.42Å; G588-I590 VanDerWaalsContact C-N 3.29Å; G588-I590 PolarHBondContact O-N 3.4Å; G588-I591 WeakPolarHBondContact O-CB 3.21Å; G588-I591 PolarHBondContact O-N 3.2Å; G588-I591 VanDerWaalsContact O-N 3.09Å; G588-Y592 PolarHBondContact O-N 3.11Å
589L93.7Very high89.6Confident41 Ų4161.1 Ų61.122%0.21530%0.304CS..Hα-helixtrans-61.5-37.8178.2-70.8179.5000111.9F111 I115 L585 V586 I587 I591 Y592 F593F111-L589 HydrophobicContact CE2-CD2 3.64Å; F111-L589 HydrophobicContact CZ-CD2 3.88Å; I115-L589 HydrophobicContact CG1-CD2 4.5Å; L585-L589 HydrophobicContact CD2-CD1 3.55Å; L585-L589 HydrophobicContact CD2-CG 3.97Å; L585-L589 WeakPolarHBondContact O-CG 3.33Å; L585-L589 PolarHBondContact O-N 2.94Å; V586-L589 PolarHBondContact O-N 2.84Å; I587-L589 PolarHBondContact O-N 3.27Å; L589-I591 VanDerWaalsContact C-N 3.32Å; L589-I591 PolarHBondContact O-N 3.23Å; L589-Y592 PolarHBondContact O-N 3.16Å; L589-F593 HydrophobicContact CB-CD2 4.36Å; L589-F593 HydrophobicContact CB-CE2 4.42Å; L589-F593 HydrophobicContact CD2-CE2 4.19Å; L589-F593 WeakPolarHBondContact O-CD2 3.26Å; L589-F593 PolarHBondContact O-N 3.19Å
590I94.6Very high89.1Confident115 Ų11557.8 Ų57.859%0.5928%0.283SS*.Hα-helixtrans-60.5-44.1173.7-68.2165000110.4V586 I587 G588 G594V586-I590 HydrophobicContact CG1-CD1 4.1Å; V586-I590 WeakPolarHBondContact O-CG1 3.18Å; V586-I590 PolarHBondContact O-N 2.84Å; I587-I590 PolarHBondContact O-N 2.85Å; G588-I590 VanDerWaalsContact C-N 3.29Å; G588-I590 PolarHBondContact O-N 3.4Å; I590-G594 WeakPolarHBondContact O-CA 3.49Å; I590-G594 PolarHBondContact O-N 2.84Å
591I91.9Very high88.2Confident53 Ų5360 Ų6027%0.27230%0.297SS..Hα-helixtrans-65.4-43.6177.2-65.1167000111W118 L356 I587 G588 L589 G594 Y595 G596W118-I591 HydrophobicContact CH2-CD1 3.45Å; W118-I591 VanDerWaalsContact CH2-CD1 3.45Å; W118-I591 HydrophobicContact CZ2-CD1 3.88Å; W118-I591 HydrophobicContact CZ3-CD1 4.06Å; L356-I591 HydrophobicContact CD2-CG2 4.2Å; I587-I591 HydrophobicContact CG2-CD1 4.27Å; I587-I591 WeakPolarHBondContact O-CG1 3.39Å; I587-I591 PolarHBondContact O-N 3.38Å; I587-I591 VanDerWaalsContact O-N 3.14Å; G588-I591 WeakPolarHBondContact O-CB 3.21Å; G588-I591 PolarHBondContact O-N 3.2Å; G588-I591 VanDerWaalsContact O-N 3.09Å; L589-I591 VanDerWaalsContact C-N 3.32Å; L589-I591 PolarHBondContact O-N 3.23Å; I591-G594 PolarHBondContact O-N 3.45Å; I591-Y595 PolarHBondContact O-N 3.06Å; I591-G596 PolarHBondContact O-N 3.33Å
592Y90.9Very high86.9Confident0 Ų061.5 Ų61.50%030%0.304CS..Iπ-helixtrans-62-52.9178.8178.5-98.7000111.9E110 F111 F114 L355 G588 L589 G594 G596 W597E110-Y592 HydrophobicContact CG-CE2 4.28Å; E110-Y592 PolarHBondContact OE1-OH 3.39Å; F111-Y592 HydrophobicContact CD2-CD1 4.15Å; F111-Y592 AromaticContact CD2-CE1 3.68Å; F111-Y592 HydrophobicContact CD2-CE1 3.68Å; F111-Y592 HydrophobicContact CE2-CD1 4.4Å; F111-Y592 HydrophobicContact CE2-CE1 4.3Å; F114-Y592 HydrophobicContact CB-CD2 3.78Å; F114-Y592 HydrophobicContact CB-CE2 4Å; F114-Y592 AromaticContact CD1-CD2 3.93Å; F114-Y592 HydrophobicContact CD1-CD2 3.93Å; F114-Y592 HydrophobicContact CD1-CG 4.03Å; F114-Y592 AromaticContact CD2-CD2 3.65Å; F114-Y592 HydrophobicContact CD2-CD2 3.65Å; F114-Y592 HydrophobicContact CD2-CG 4.38Å; F114-Y592 HydrophobicContact CE1-CG 4.37Å; F114-Y592 HydrophobicContact CE2-CD2 4.23Å; F114-Y592 AromaticContact CG-CD2 3.46Å; F114-Y592 HydrophobicContact CG-CD2 3.46Å; F114-Y592 VanDerWaalsContact CG-CD2 3.46Å; F114-Y592 HydrophobicContact CG-CE2 4.2Å; F114-Y592 HydrophobicContact CG-CG 4.05Å; L355-Y592 HydrophobicContact CD2-CD2 4.49Å; L355-Y592 HydrophobicContact CD2-CE2 4.06Å; G588-Y592 PolarHBondContact O-N 3.11Å; L589-Y592 PolarHBondContact O-N 3.16Å; Y592-G594 VanDerWaalsContact C-N 3.31Å; Y592-G594 PolarHBondContact O-N 3.39Å; Y592-G596 PolarHBondContact O-N 3.34Å; Y592-W597 HydrophobicContact CE1-CB 4.25Å; Y592-W597 WeakPolarHBondContact O-CB 3.26Å; Y592-W597 PolarHBondContact O-N 2.94Å
593F90.1Very high85.3Confident87 Ų8758.5 Ų58.538%0.38229%0.293SS..Iπ-helixtrans-71.2-27.6-179.9-71.4-64.7000112.7F111 L589F111-F593 HydrophobicContact CE2-CE2 4.33Å; F111-F593 HydrophobicContact CE2-CZ 4.02Å; L589-F593 HydrophobicContact CB-CD2 4.36Å; L589-F593 HydrophobicContact CB-CE2 4.42Å; L589-F593 HydrophobicContact CD2-CE2 4.19Å; L589-F593 WeakPolarHBondContact O-CD2 3.26Å; L589-F593 PolarHBondContact O-N 3.19Å
594G88.8Confident83.1Confident53 Ų5358.1 Ų58.155%0.54630%0.299SS..Iπ-helixtrans-75.7-37.9176.900000114.1I590 I591 Y592I590-G594 WeakPolarHBondContact O-CA 3.49Å; I590-G594 PolarHBondContact O-N 2.84Å; I591-G594 PolarHBondContact O-N 3.45Å; Y592-G594 VanDerWaalsContact C-N 3.31Å; Y592-G594 PolarHBondContact O-N 3.39Å
595Y89.2Confident80.7Confident60 Ų6062.3 Ų62.324%0.23532%0.324CS..Iπ-helixtrans-129.1-60.6-173.6-180-89.3000113.1L356 P357 I591 W597 R598 H599L356-Y595 WeakPolarHBondContact O-CE1 3.34Å; P357-Y595 HydrophobicContact CG-CD1 4.34Å; P357-Y595 HydrophobicContact CG-CE1 4.37Å; P357-Y595 HydrophobicContact CG-CG 4.5Å; I591-Y595 PolarHBondContact O-N 3.06Å; Y595-W597 VanDerWaalsContact C-N 3.35Å; Y595-W597 PolarHBondContact O-N 3.42Å; Y595-R598 PolarHBondContact O-N 3.11Å; Y595-R598 VanDerWaalsContact O-N 3.08Å; Y595-H599 HydrophobicContact CD1-CB 4.36Å; Y595-H599 AromaticContact CD2-CE1 3.84Å; Y595-H599 AromaticContact CD2-ND1 3.59Å; Y595-H599 HydrophobicContact CE1-CB 3.8Å; Y595-H599 HydrophobicContact CE2-CB 4.37Å; Y595-H599 AromaticContact CE2-CE1 3.72Å; Y595-H599 AromaticContact CE2-CG 3.77Å; Y595-H599 AromaticContact CE2-ND1 3.55Å; Y595-H599 AromaticContact CG-ND1 4Å; Y595-H599 AromaticContact CZ-CG 3.68Å; Y595-H599 AromaticContact CZ-ND1 3.9Å; Y595-H599 PolarHBondContact O-N 3.45Å; Y595-H599 PolarHBondContact O-ND1 3.37Å; Y595-H599 VanDerWaalsContact O-ND1 3.13Å
596G82.5Confident78.2Confident0 Ų064.7 Ų64.70%034%0.342CS..Iπ-helixtrans-60.1-39.7-166.300000114L355 I591 Y592 R598 H599 S600L355-G596 WeakPolarHBondContact O-CA 3.29Å; I591-G596 PolarHBondContact O-N 3.33Å; Y592-G596 PolarHBondContact O-N 3.34Å; G596-R598 PolarHBondContact O-N 3.32Å; G596-H599 PolarHBondContact O-N 3.05Å; G596-S600 PolarHBondContact O-N 2.98Å
597W80.9Confident75.4Confident69 Ų6963.6 Ų63.626%0.26135%0.345SS..Hα-helixtrans-58.5-33.9178.4176.546.6000113.3V12 S15 Y592 Y595V12-W597 HydrophobicContact CB-CZ2 4.35Å; V12-W597 HydrophobicContact CG2-CH2 3.75Å; V12-W597 HydrophobicContact CG2-CZ2 3.44Å; V12-W597 VanDerWaalsContact CG2-CZ2 3.44Å; S15-W597 PolarHBondContact OG-NE1 3.42Å; Y592-W597 HydrophobicContact CE1-CB 4.25Å; Y592-W597 WeakPolarHBondContact O-CB 3.26Å; Y592-W597 PolarHBondContact O-N 2.94Å; Y595-W597 VanDerWaalsContact C-N 3.35Å; Y595-W597 PolarHBondContact O-N 3.42Å
598R80Confident72.5Confident180 Ų18068.6 Ų68.668%0.67937%0.366SS*.Hα-helixtrans-88.8-31.7-178.3-64.7-177.8-177-179.22.5113Y595 G596Y595-R598 PolarHBondContact O-N 3.11Å; Y595-R598 VanDerWaalsContact O-N 3.08Å; G596-R598 PolarHBondContact O-N 3.32Å
599H81.4Confident69.5Low103 Ų10374.3 Ų74.348%0.47741%0.407SS..Hα-helixtrans-102.7-2.2-172.6-6787000114.5G354 Y595 G596 I601G354-H599 CarbonylContact O-C 3.57Å; Y595-H599 HydrophobicContact CD1-CB 4.36Å; Y595-H599 AromaticContact CD2-CE1 3.84Å; Y595-H599 AromaticContact CD2-ND1 3.59Å; Y595-H599 HydrophobicContact CE1-CB 3.8Å; Y595-H599 HydrophobicContact CE2-CB 4.37Å; Y595-H599 AromaticContact CE2-CE1 3.72Å; Y595-H599 AromaticContact CE2-CG 3.77Å; Y595-H599 AromaticContact CE2-ND1 3.55Å; Y595-H599 AromaticContact CG-ND1 4Å; Y595-H599 AromaticContact CZ-CG 3.68Å; Y595-H599 AromaticContact CZ-ND1 3.9Å; Y595-H599 PolarHBondContact O-N 3.45Å; Y595-H599 PolarHBondContact O-ND1 3.37Å; Y595-H599 VanDerWaalsContact O-ND1 3.13Å; G596-H599 PolarHBondContact O-N 3.05Å; H599-I601 PolarHBondContact O-N 2.96Å
600S78.9Confident66.3Low1 Ų175.2 Ų75.21%0.00743%0.425CS..  trans-48.8130.1172166.20000110.4Y105 E110 D353 G596 H602 A603Y105-S600 PolarHBondContact OH-OG 2.89Å; E110-S600 VanDerWaalsContact CD-OG 3.31Å; E110-S600 WeakPolarHBondContact OE1-CB 3.3Å; E110-S600 WeakPolarHBondContact OE2-CB 3.45Å; E110-S600 PolarHBondContact OE2-OG 3.43Å; D353-S600 WeakPolarHBondContact O-CA 3.46Å; G596-S600 PolarHBondContact O-N 2.98Å; S600-H602 PolarHBondContact O-N 3.37Å; S600-H602 VanDerWaalsContact O-N 3.16Å; S600-H602 PolarHBondContact OG-N 2.9Å; S600-A603 WeakPolarHBondContact O-CA 3.43Å; S600-A603 WeakPolarHBondContact O-CB 3.35Å; S600-A603 PolarHBondContact O-N 3.28Å
601I68.3Low63Low80 Ų8077.8 Ų77.841%0.4143%0.432SS..Hα-helixtrans-58.7-31.6-179.1-69.2-176.2000111.6S352 D353 H599 A603 S604 N605S352-I601 WeakPolarHBondContact O-CD1 3.24Å; D353-I601 PolarHBondContact O-N 3.3Å; H599-I601 PolarHBondContact O-N 2.96Å; I601-A603 PolarHBondContact O-N 3.44Å; I601-S604 PolarHBondContact O-N 2.95Å; I601-S604 PolarHBondContact O-OG 2.72Å; I601-N605 PolarHBondContact O-N 3.33Å; I601-N605 VanDerWaalsContact O-N 3.16Å
602H61.8Low59.8Low43 Ų4382.8 Ų82.820%0.19946%0.459CS..Hα-helixtrans-76.4-5.8176.6-59.390.3000112.4R18 Y105 S600R18-H602 HydrophobicContact CB-CB 4.26Å; R18-H602 HydrophobicContact CG-CB 4.4Å; R18-H602 PolarHBondContact NE-O 3.2Å; Y105-H602 AromaticContact CZ-ND1 3.85Å; Y105-H602 PolarHBondContact OH-ND1 3.18Å; S600-H602 PolarHBondContact O-N 3.37Å; S600-H602 VanDerWaalsContact O-N 3.16Å; S600-H602 PolarHBondContact OG-N 2.9Å
603A57Low56.7Low30 Ų3088.8 Ų88.825%0.24849%0.49CS..Hα-helixtrans-76.5-37.9166.300000112.6S600 I601S600-A603 WeakPolarHBondContact O-CA 3.43Å; S600-A603 WeakPolarHBondContact O-CB 3.35Å; S600-A603 PolarHBondContact O-N 3.28Å; I601-A603 PolarHBondContact O-N 3.44Å
604S46.6Very low53.6Low90 Ų9090.7 Ų90.763%0.62951%0.508SS*.Hα-helixtrans-81.8-31.9179.652.20000112.7I601 P606I601-S604 PolarHBondContact O-N 2.95Å; I601-S604 PolarHBondContact O-OG 2.72Å; S604-P606 VanDerWaalsContact C-CD 3.43Å; S604-P606 WeakPolarHBondContact O-CD 3.44Å
605N42.2Very low50.6Low118 Ų11893.3 Ų93.363%0.63151%0.513SS*.  trans-118.472.9174.6-77-15.9000111.5I601 G607I601-N605 PolarHBondContact O-N 3.33Å; I601-N605 VanDerWaalsContact O-N 3.16Å; N605-G607 PolarHBondContact O-N 2.93Å
606P39.4Very low47.7Very low90 Ų9095.6 Ų95.658%0.58454%0.536SS*.  trans-67.888.3162.529.1-28.7000106.3S604 E608S604-P606 VanDerWaalsContact C-CD 3.43Å; S604-P606 WeakPolarHBondContact O-CD 3.44Å; P606-E608 PolarHBondContact O-N 2.79Å
607G38.2Very low45.1Very low47 Ų47105.3 Ų105.349%0.48558%0.578SS.*THydrogen-bonded Turntrans-41.1121.5-163.700000112.9N605 S609N605-G607 PolarHBondContact O-N 2.93Å; G607-S609 PolarHBondContact O-N 3.2Å
608E32.3Very low42.6Very low180 Ų180109.9 Ų109.984%0.84160%0.604SS**THydrogen-bonded Turntrans31.719.3162-90.9-175.1162.100120.9P606P606-E608 PolarHBondContact O-N 2.79Å
609S31.2Very low40.2Very low121 Ų121103.8 Ų103.885%0.84660%0.597SS**SBendtrans-101.812.1167.3-64.70000111.4G607G607-S609 PolarHBondContact O-N 3.2Å
610G26.6Very low37.8Very low59 Ų59103.9 Ų103.961%0.60861%0.609SS**  trans-119.8-11.9-175.400000115.8L612G610-L612 PolarHBondContact O-N 3.43Å
611K24.3Very low35.3Very low170 Ų170113.1 Ų113.174%0.73965%0.65SS**  trans-79.772.2163.8-78.2-177-178.6172.50107.6I613K611-I613 HydrophobicContact CB-CG1 4.26Å; K611-I613 PolarHBondContact O-N 3.02Å
612L25.6Very low33.4Very low158 Ų158115.8 Ų115.883%0.82767%0.665SS**  trans-53.292.5130-85.5161.6000103.5G610 T614G610-L612 PolarHBondContact O-N 3.43Å; L612-T614 PolarHBondContact O-N 2.85Å
613I26Very low31.9Very low126 Ų126122.1 Ų122.165%0.64670%0.695SS**  trans-51.897.8164.2-62.9171.8000102.1K611 V615K611-I613 HydrophobicContact CB-CG1 4.26Å; K611-I613 PolarHBondContact O-N 3.02Å; I613-V615 HydrophobicContact CG2-CG2 4.02Å; I613-V615 PolarHBondContact O-N 2.91Å
614T24.4Very low30.6Very low126 Ų126127.5 Ų127.577%0.77372%0.719SS**  trans-63.888.8157.428.20000101.6L612 P616L612-T614 PolarHBondContact O-N 2.85Å; T614-P616 WeakPolarHBondContact O-CD 3.18Å
615V26Very low29.8Very low108 Ų108131 Ų13166%0.65573%0.729SS**  trans-48.3111.7169.5177.70000103.1I613 K617I613-V615 HydrophobicContact CG2-CG2 4.02Å; I613-V615 PolarHBondContact O-N 2.91Å; V615-K617 PolarHBondContact O-N 2.92Å
616P28.6Very low29.1Very low108 Ų108132.2 Ų132.270%0.70174%0.741SS**  trans-56.9123.6174.7-12.725.6000103.7T614 M618T614-P616 WeakPolarHBondContact O-CD 3.18Å; P616-M618 PolarHBondContact O-N 3.37Å
617K28.1Very low28.7Very low205 Ų205130.6 Ų130.689%0.89174%0.741SS**  trans-41.7111.1172.2-78.7-179.1175179.90105.8V615 G619V615-K617 PolarHBondContact O-N 2.92Å; K617-G619 PolarHBondContact O-N 2.82Å
618M28.4Very low28.1Very low165 Ų165134.4 Ų134.481%0.81376%0.76SS**  trans-58.2101.1-179.9-138149.8-175.300104.1P616 S620P616-M618 PolarHBondContact O-N 3.37Å; M618-S620 PolarHBondContact O-N 2.79Å
619G29.4Very low27.9Very low51 Ų51129.5 Ų129.553%0.52676%0.758SS.*  trans-56.4128.3168.900000105.1K617 F621K617-G619 PolarHBondContact O-N 2.82Å; G619-F621 PolarHBondContact O-N 2.78Å
620S30.8Very low27.6Very low105 Ų105133.7 Ų133.773%0.73476%0.761SS**  trans-34.2105.4170.145.60000110.1M618 D622M618-S620 PolarHBondContact O-N 2.79Å; S620-D622 PolarHBondContact O-N 3.03Å
621F27.4Very low27.7Very low195 Ų195139.5 Ų139.586%0.85577%0.773SS**  trans-72.281.2164.8-97.5-93.9000106.3G619G619-F621 PolarHBondContact O-N 2.78Å
622D28.1Very low28Very low137 Ų137136.9 Ų136.973%0.73377%0.773SS**  trans-100.8142.8153.2-83.5-38.6000107.3S620S620-D622 PolarHBondContact O-N 3.03Å
623E29Very low28Very low176 Ų176140.9 Ų140.982%0.82278%0.779SS**SBendtrans86.196.8168.2-61.3-178.4168.800118.4
624D29.8Very low28Very low142 Ų142143 Ų14376%0.75979%0.786SS**  57.886.9118.7-65.7-17.1000118.9
625I30.2Very low28.2Very low163 Ų163143.8 Ų143.884%0.83679%0.785SS**  trans-134.585.5141.7-54.8-178.9000109
626T27.9Very low28.4Very low144 Ų144143.3 Ų143.388%0.88379%0.793SS**  trans-76.6114.4149.944.70000106.8
627G29.9Very low28.4Very low56 Ų56145.5 Ų145.558%0.57780%0.798SS**  trans175.680-176.800000114
628S27.2Very low28.4Very low128 Ų128141.4 Ų141.490%0.89579%0.791SS**  trans13.9116.7148.358.20000118.5
629G27.5Very low28.5Very low77 Ų77143.7 Ų143.779%0.79480%0.797SS**  trans165.549.3163.900000114.9
630F25.4Very low28.7Very low208 Ų208149.9 Ų149.991%0.91281%0.812SS**  trans-123.690.8170.4-115.4-91000108.6
631E27.5Very low28.8Very low182 Ų182152.2 Ų152.285%0.8582%0.816SS**  trans-82.8126.1159.8-91.9-176.9161.700108.2Y633E631-Y633 PolarHBondContact O-N 2.91Å
632P31.2Very low29Very low115 Ų115153.9 Ų153.975%0.74782%0.818SS**  trans-79.2123.5-174.524.7-20.6000110.8E634P632-E634 PolarHBondContact O-N 2.95Å
633Y26.4Very low29.3Very low241 Ų241156.4 Ų156.495%0.94583%0.826SS**  trans-70.791.5170.9-114.6-97000109.8E631E631-Y633 PolarHBondContact O-N 2.91Å
634E25.3Very low29.7Very low172 Ų172155.6 Ų155.680%0.80482%0.822SS**  trans-72.7122.2152.6-92.9-178.1153.300108.7P632P632-E634 PolarHBondContact O-N 2.95Å
635N29.2Very low30Very low141 Ų141160 Ų16075%0.75483%0.827SS**  trans169.185.4136.2-87.5-36.9000110.6N637N635-N637 PolarHBondContact O-N 3.28Å
636A30Very low30Very low98 Ų98160.7 Ų160.781%0.8183%0.832SS**  trans-82.494.9154.300000107.4
637N28.9Very low30.2Very low154 Ų154164.8 Ų164.882%0.82484%0.841SS**  trans-168.522.1161.4-96.2-20.5000115.2N635 F639N635-N637 PolarHBondContact O-N 3.28Å; N637-F639 VanDerWaalsContact C-N 3.34Å; N637-F639 PolarHBondContact O-N 2.76Å
638T27.8Very low30.2Very low120 Ų120170.2 Ų170.274%0.73685%0.854SS**THydrogen-bonded Turntrans-90.122.9-174.5-14.20000115.5
639F30.4Very low30.4Very low213 Ų213172.4 Ų172.493%0.93485%0.852SS**THydrogen-bonded Turntrans-101.114.4178.2-100.8-78.2000115.6N637N637-F639 VanDerWaalsContact C-N 3.34Å; N637-F639 PolarHBondContact O-N 2.76Å
640Q33.1Very low30.5Very low181 Ų181177.7 Ų177.785%0.84686%0.855SS**SBendtrans-117.411.6178.4-105.3-177.4-10.100116.6
641N32.4Very low30.8Very low153 Ų153175.9 Ų175.982%0.81885%0.852SS**SBendtrans-11421.1-178.4-87.1-15.6000116.3
642Y31.1Very low31Very low231 Ų231175.6 Ų175.691%0.90685%0.852SS**SBendtrans-1022.5172.9-99.5-80.8000115.7
643E34.3Very low31Very low190 Ų190179.6 Ų179.689%0.88886%0.859SS**SBendtrans-96.78.2178.9-100.2-175.5170.300115.9
644H37.7Very low31.4Very low159 Ų159175.2 Ų175.274%0.73685%0.853SS**SBendtrans-124.430.7179.6-116.9-64.1000116.3
645R36.8Very low31.8Very low233 Ų233175.5 Ų175.588%0.87986%0.857SS**SBendtrans-129.535.3169.6-101.5-169.8-159.7-176.47.7114.9
646L30.8Very low32Very low179 Ų179178.3 Ų178.394%0.93787%0.865SS**  trans-129.143.9161.6-74.2173.5000111.3
647E31.4Very low32.2Very low229 Ų229185.6 Ų185.6100%1.0787%0.87SS**  trans-117.10143.9-72.6-175161.500106.7

Retrieved 647 of 647 residues in 170 ms (Link to these results)

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