A0A087XMX0_POEFO Loading...

Golgin A7 family, member Ba

AlphaFold DB , UniProt , Accession A0A087XMX0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 158 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
1M46.9Very low58.2Low194 Ų19496.9 Ų96.996%0.95651%0.507SS*.  0-46.10-70.6-147.7-105.400114.3E4M1-E4 WeakPolarHBondContact CA-OE2 3.37Å; M1-E4 PolarHBondContact N-OE2 3.42Å
2A42.8Very low58.9Low91 Ų91100.5 Ų100.575%0.75251%0.509SS*.Hα-helixtrans-81.3-29.2176.100000114.1E4A2-E4 VanDerWaalsContact C-N 3.3Å; A2-E4 PolarHBondContact O-N 3.17Å
3T53.2Low59.5Low118 Ų118104.7 Ų104.772%0.72453%0.525SS*.Hα-helixtrans-72.6-21-176.8-16.60000113.5
4E52.2Low60Low91 Ų91101.4 Ų101.443%0.42552%0.517SS..Hα-helixtrans-88.9-44.8-168.5-68.8151.5143.800112.3M1 A2 H6 N7M1-E4 WeakPolarHBondContact CA-OE2 3.37Å; M1-E4 PolarHBondContact N-OE2 3.42Å; A2-E4 VanDerWaalsContact C-N 3.3Å; A2-E4 PolarHBondContact O-N 3.17Å; E4-H6 PolarHBondContact O-N 3.37Å; E4-N7 PolarHBondContact O-N 3.28Å; E4-N7 VanDerWaalsContact O-N 3.13Å
5F55.9Low60.9Low119 Ų11995.5 Ų95.552%0.52249%0.489SS..Hα-helixtrans-58.4-31.2169.3-89.9-88.8000112.6N7 Q9F5-N7 VanDerWaalsContact C-N 3.31Å; F5-N7 PolarHBondContact O-N 3.39Å; F5-Q9 PolarHBondContact O-N 2.9Å
6H58.2Low62Low112 Ų11292.5 Ų92.552%0.51948%0.479SS..Hα-helixtrans-62.5-39.1178.1-160.670000111.5E4 Q9 E10E4-H6 PolarHBondContact O-N 3.37Å; H6-Q9 PolarHBondContact O-N 2.9Å; H6-E10 WeakPolarHBondContact O-CB 3.45Å; H6-E10 PolarHBondContact O-N 3.43Å
7N62.8Low63.2Low81 Ų8191.6 Ų91.643%0.43348%0.475SS..Hα-helixtrans-69.9-37.8-175-163.1-97.6000113E4 F5 E10 L11E4-N7 PolarHBondContact O-N 3.28Å; E4-N7 VanDerWaalsContact O-N 3.13Å; F5-N7 VanDerWaalsContact C-N 3.31Å; F5-N7 PolarHBondContact O-N 3.39Å; N7-E10 PolarHBondContact O-N 3.31Å; N7-L11 PolarHBondContact O-N 3.03Å
8L67.8Low64.3Low24 Ų2489.2 Ų89.213%0.12647%0.47CS..Hα-helixtrans-69.5-38.2175-61.9-178.1000112.1R12 N110 E111 A115 L120L8-R12 WeakPolarHBondContact O-CG 3.4Å; L8-R12 PolarHBondContact O-N 3.19Å; L8-N110 HydrophobicContact CD1-CB 4.42Å; L8-N110 HydrophobicContact CD2-CB 4.22Å; L8-E111 HydrophobicContact CD1-CG 4.23Å; L8-E111 HydrophobicContact CG-CG 4.43Å; L8-A115 HydrophobicContact CD2-CB 3.58Å; L8-L120 HydrophobicContact CD1-CD1 4.48Å; L8-L120 HydrophobicContact CD2-CD1 3.77Å
9Q67.3Low65.5Low109 Ų10988.6 Ų88.651%0.50947%0.468SS..Hα-helixtrans-68-40.6173.7-75.1-177-32.400111.1F5 H6 R12 H13F5-Q9 PolarHBondContact O-N 2.9Å; H6-Q9 PolarHBondContact O-N 2.9Å; Q9-R12 WeakPolarHBondContact O-CB 3.12Å; Q9-R12 PolarHBondContact O-N 3.22Å; Q9-R12 VanDerWaalsContact O-N 3.13Å; Q9-H13 PolarHBondContact O-CD2 3.1Å; Q9-H13 PolarHBondContact O-N 2.96Å
10E65.9Low66.6Low96 Ų9687.8 Ų87.845%0.44946%0.46SS..Hα-helixtrans-61.1-46.1176.3-168.1173.6-167.200110.7H6 N7 R12 H13 S14H6-E10 WeakPolarHBondContact O-CB 3.45Å; H6-E10 PolarHBondContact O-N 3.43Å; N7-E10 PolarHBondContact O-N 3.31Å; E10-R12 VanDerWaalsContact C-N 3.29Å; E10-R12 PolarHBondContact O-N 2.96Å; E10-H13 CarbonylContact O-C 2.98Å; E10-H13 WeakPolarHBondContact O-CA 3.48Å; E10-H13 PolarHBondContact O-N 3.21Å; E10-S14 WeakPolarHBondContact O-CB 3.38Å; E10-S14 PolarHBondContact O-N 3.24Å; E10-S14 PolarHBondContact O-OG 2.9Å
11L67.1Low67.8Low31 Ų3184 Ų8416%0.16244%0.441CS..Hα-helixtrans-53.4-42.9171.1-104.3149.8000112.9N7 H13 A15 A115 Y137N7-L11 PolarHBondContact O-N 3.03Å; L11-H13 VanDerWaalsContact C-N 3.26Å; L11-H13 PolarHBondContact O-N 2.82Å; L11-A15 WeakPolarHBondContact O-CB 3.46Å; L11-A15 PolarHBondContact O-N 3.28Å; L11-A115 HydrophobicContact CD1-CB 3.57Å; L11-A115 WeakPolarHBondContact CD1-O 3.43Å; L11-Y137 HydrophobicContact CD2-CG 4.42Å
12R67.1Low69.9Low140 Ų14079.7 Ų79.753%0.52842%0.417SS..Hα-helixtrans-68-23.9176.4-72.5179.7176.4-174.4-0.5113.4L8 Q9 E10 L120 Y137L8-R12 WeakPolarHBondContact O-CG 3.4Å; L8-R12 PolarHBondContact O-N 3.19Å; Q9-R12 WeakPolarHBondContact O-CB 3.12Å; Q9-R12 PolarHBondContact O-N 3.22Å; Q9-R12 VanDerWaalsContact O-N 3.13Å; E10-R12 VanDerWaalsContact C-N 3.29Å; E10-R12 PolarHBondContact O-N 2.96Å; R12-L120 HydrophobicContact CG-CD2 4.44Å; R12-L120 VanDerWaalsContact NE-CD2 3.35Å; R12-Y137 HydrophobicContact CG-CE1 4.34Å
13H66.5Low72.1Confident155 Ų15575.7 Ų75.772%0.71838%0.383SS*.Hα-helixtrans-98.5-33.6-177.1-79.8-66.2000113.8Q9 E10 L11Q9-H13 PolarHBondContact O-CD2 3.1Å; Q9-H13 PolarHBondContact O-N 2.96Å; E10-H13 CarbonylContact O-C 2.98Å; E10-H13 WeakPolarHBondContact O-CA 3.48Å; E10-H13 PolarHBondContact O-N 3.21Å; L11-H13 VanDerWaalsContact C-N 3.26Å; L11-H13 PolarHBondContact O-N 2.82Å
14S66.3Low73.9Confident59 Ų5976 Ų7641%0.41338%0.376SS..Hα-helixtrans-92.6-29.1-175.464.90000113E10E10-S14 WeakPolarHBondContact O-CB 3.38Å; E10-S14 PolarHBondContact O-N 3.24Å; E10-S14 PolarHBondContact O-OG 2.9Å
15A73.3Confident75.7Confident12 Ų1273.4 Ų73.410%0.09936%0.362CS..EExtended strand (participates in β ladder)trans-107.8145.1-178.200000112.1L11 Y137 E138L11-A15 WeakPolarHBondContact O-CB 3.46Å; L11-A15 PolarHBondContact O-N 3.28Å; A15-Y137 HydrophobicContact CB-CD1 4.15Å; A15-Y137 HydrophobicContact CB-CG 4.39Å; A15-E138 CarbonylContact C-O 3.52Å; A15-E138 WeakPolarHBondContact CA-O 3.18Å; A15-E138 WeakPolarHBondContact CB-O 3.07Å
16S79.5Confident77.3Confident48 Ų4869.2 Ų69.234%0.33635%0.345SS..EExtended strand (participates in β ladder)trans-82.3135.1171.945.20000110.1A18 Y137 E138S16-A18 PolarHBondContact O-N 2.93Å; S16-A18 VanDerWaalsContact O-N 3.1Å; S16-Y137 WeakPolarHBondContact O-CA 3.47Å; S16-E138 PolarHBondContact N-O 2.86Å; S16-E138 PolarHBondContact O-N 3.39Å; S16-E138 PolarHBondContact OG-O 3Å
17L82.1Confident78.5Confident78 Ų7870.4 Ų70.441%0.40835%0.346SS..EExtended strand (participates in β ladder)trans-66.3109.2171.3-177.3127.8000109.2K20 Y137L17-K20 VanDerWaalsContact CD1-CE 3.46Å; L17-K20 HydrophobicContact CD1-CG 4.24Å; L17-K20 HydrophobicContact CD2-CD 4.32Å; L17-K20 HydrophobicContact CD2-CG 4.03Å; L17-Y137 HydrophobicContact CB-CD1 4.45Å; L17-Y137 HydrophobicContact CB-CE1 4.18Å; L17-Y137 HydrophobicContact CD1-CE1 4.31Å
18A82.1Confident79.6Confident47 Ų4771.7 Ų71.739%0.38836%0.361SS..EExtended strand (participates in β ladder)trans-85.6-45.1-176.200000111.8S16 I136 E138S16-A18 PolarHBondContact O-N 2.93Å; S16-A18 VanDerWaalsContact O-N 3.1Å; A18-I136 PolarHBondContact N-O 2.92Å; A18-E138 HydrophobicContact CB-CB 4.06Å; A18-E138 HydrophobicContact CB-CG 3.56Å
19N86.6Confident80Confident78 Ų7876.5 Ų76.542%0.41738%0.383SS..EExtended strand (participates in β ladder)trans-154.5163.4-177.8-162.81.4000111.7I136N19-I136 HydrophobicContact CB-CB 4.4Å; N19-I136 HydrophobicContact CB-CD1 4.11Å; N19-I136 PolarHBondContact N-O 2.87Å; N19-I136 PolarHBondContact O-N 2.86Å
20K88.7Confident80.5Confident72 Ų7273.1 Ų73.131%0.31338%0.378SS..EExtended strand (participates in β ladder)trans-130.3132.5174.5-66.6-176.4173.8-1530110.4L17 F22 E133 I134L17-K20 VanDerWaalsContact CD1-CE 3.46Å; L17-K20 HydrophobicContact CD1-CG 4.24Å; L17-K20 HydrophobicContact CD2-CD 4.32Å; L17-K20 HydrophobicContact CD2-CG 4.03Å; K20-F22 HydrophobicContact CB-CE2 3.87Å; K20-F22 HydrophobicContact CB-CZ 3.92Å; K20-F22 HydrophobicContact CD-CZ 4.25Å; K20-E133 WeakPolarHBondContact CE-OE1 3.44Å; K20-E133 IonicContact NZ-OE1 3.84Å; K20-E133 PolarHBondContact NZ-OE1 3.08Å; K20-E133 IonicContact NZ-OE2 2.67Å; K20-I134 WeakPolarHBondContact CA-O 3.38Å
21V90.8Very high81Confident10 Ų1075 Ų756%0.06140%0.396CS..EExtended strand (participates in β ladder)trans-111.8135.9177.1-1780000109I23 P40 E42 L43 I134 I136V21-I23 HydrophobicContact CG1-CD1 4.22Å; V21-P40 HydrophobicContact CG1-CB 3.42Å; V21-P40 VanDerWaalsContact CG1-CB 3.42Å; V21-P40 HydrophobicContact CG1-CG 3.48Å; V21-P40 VanDerWaalsContact CG1-CG 3.48Å; V21-E42 HydrophobicContact CG2-CB 3.79Å; V21-E42 HydrophobicContact CG2-CG 4.33Å; V21-L43 HydrophobicContact CG1-CD1 4.43Å; V21-L43 HydrophobicContact CG2-CD2 4.36Å; V21-L43 HydrophobicContact CG2-CG 4.36Å; V21-I134 HydrophobicContact CB-CB 4.45Å; V21-I134 PolarHBondContact N-O 3.5Å; V21-I134 PolarHBondContact O-N 2.82Å; V21-I136 HydrophobicContact CG2-CD1 3.88Å
22F90.8Very high81.6Confident103 Ų10375.4 Ų75.445%0.45240%0.4SS..EExtended strand (participates in β ladder)trans-119.2117.3-177.2-60.5-82.2000110.4K20 V131 I132 E133K20-F22 HydrophobicContact CB-CE2 3.87Å; K20-F22 HydrophobicContact CB-CZ 3.92Å; K20-F22 HydrophobicContact CD-CZ 4.25Å; F22-V131 HydrophobicContact CD1-CG2 4.14Å; F22-I132 WeakPolarHBondContact CA-O 3.37Å; F22-E133 HydrophobicContact CD1-CB 4.21Å; F22-E133 HydrophobicContact CE1-CB 4.12Å; F22-E133 HydrophobicContact CE1-CG 4.08Å; F22-E133 WeakPolarHBondContact CE1-OE2 3.36Å
23I90.9Very high82.4Confident7 Ų768.8 Ų68.84%0.03638%0.375CS..EExtended strand (participates in β ladder)trans-94.8114.6174.5-57.969.6000106.5V21 F35 Q36 P40 F52 V131 I132 I134V21-I23 HydrophobicContact CG1-CD1 4.22Å; I23-F35 HydrophobicContact CG2-CB 4.3Å; I23-Q36 HydrophobicContact CG2-CB 4.39Å; I23-Q36 WeakPolarHBondContact CG2-O 3.39Å; I23-P40 HydrophobicContact CG1-CG 4.48Å; I23-F52 HydrophobicContact CD1-CE2 4.32Å; I23-F52 HydrophobicContact CD1-CZ 4.47Å; I23-F52 HydrophobicContact CG1-CE2 4.12Å; I23-F52 HydrophobicContact CG1-CZ 3.81Å; I23-V131 CarbonylContact O-C 3.54Å; I23-V131 WeakPolarHBondContact O-CA 3.17Å; I23-I132 HydrophobicContact CB-CB 4.11Å; I23-I132 HydrophobicContact CD1-CB 4.35Å; I23-I132 PolarHBondContact N-O 2.79Å; I23-I132 PolarHBondContact O-N 2.87Å; I23-I134 HydrophobicContact CD1-CD1 3.69Å; I23-I134 HydrophobicContact CD1-CG1 3.85Å
24Q89.9Confident83.5Confident124 Ų12463.8 Ų63.858%0.57935%0.351SS*.EExtended strand (participates in β ladder)trans-74.2150.5-176.7-65.1-17533.600111.7Q36Q24-Q36 WeakPolarHBondContact O-CG 3.27Å; Q24-Q36 PolarHBondContact O-N 3.01Å
25R90.2Very high84.6Confident37 Ų3761 Ų6114%0.1433%0.332CS..BIsolated β-bridgetrans-61141.7166.7-167.8176.8174.5170.8-3.2110.5Y27 T31 T32 C33 K34 F35 Q36 M129 R130R25-Y27 HydrophobicContact CB-CE2 4.01Å; R25-Y27 HydrophobicContact CG-CE1 4.35Å; R25-Y27 HydrophobicContact CG-CE2 4.4Å; R25-T31 VanDerWaalsContact NH2-C 3.3Å; R25-T31 PolarHBondContact NH2-O 3.29Å; R25-T32 PolarHBondContact NE-O 2.57Å; R25-T32 PolarHBondContact NH2-O 3.49Å; R25-C33 VanDerWaalsContact NH2-N 3.19Å; R25-K34 CarbonylContact C-O 3.5Å; R25-K34 WeakPolarHBondContact CA-O 3.5Å; R25-K34 WeakPolarHBondContact CG-O 3.07Å; R25-F35 HydrophobicContact CB-CD1 4.49Å; R25-Q36 PolarHBondContact O-NE2 3.48Å; R25-M129 WeakPolarHBondContact CD-O 3.37Å; R25-R130 VanDerWaalsContact CB-O 3.27Å; R25-R130 WeakPolarHBondContact CB-O 2.97Å; R25-R130 PolarHBondContact N-O 2.97Å
26D88.7Confident85.4Confident30 Ų3063.9 Ų63.916%0.1634%0.343CS..PPolyproline II helixtrans-92.2117170.7-178.17000108.9S28 K34 Q36D26-S28 WeakPolarHBondContact OD1-CB 3.25Å; D26-S28 PolarHBondContact OD1-N 2.81Å; D26-S28 PolarHBondContact OD1-OG 3.02Å; D26-K34 HydrophobicContact CB-CB 4.45Å; D26-K34 HydrophobicContact CB-CD 4.39Å; D26-K34 HydrophobicContact CB-CG 4.3Å; D26-K34 PolarHBondContact N-O 3.28Å; D26-K34 IonicContact OD2-NZ 3.81Å; D26-Q36 HydrophobicContact CB-CG 4.03Å
27Y84.8Confident85.7Confident138 Ų13864.5 Ų64.554%0.54135%0.345SS..  trans-98.14179.4-66.6-79.3000113R25 E29 G30R25-Y27 HydrophobicContact CB-CE2 4.01Å; R25-Y27 HydrophobicContact CG-CE1 4.35Å; R25-Y27 HydrophobicContact CG-CE2 4.4Å; Y27-E29 PolarHBondContact O-N 2.9Å; Y27-G30 PolarHBondContact O-N 3.42Å; Y27-G30 VanDerWaalsContact O-N 3.09Å
28S84.8Confident85.9Confident107 Ų10768.6 Ų68.675%0.74836%0.359SS*.THydrogen-bonded Turntrans-62.5-30.2-175.4-49.10000112.8D26D26-S28 WeakPolarHBondContact OD1-CB 3.25Å; D26-S28 PolarHBondContact OD1-N 2.81Å; D26-S28 PolarHBondContact OD1-OG 3.02Å
29E77.3Confident86Confident125 Ų12568.1 Ų68.158%0.58435%0.349SS*.THydrogen-bonded Turntrans-97.318.3179.4-68.3174.3-16900112.7Y27 K34Y27-E29 PolarHBondContact O-N 2.9Å; E29-K34 IonicContact OE1-NZ 2.93Å; E29-K34 PolarHBondContact OE1-NZ 3.45Å; E29-K34 WeakPolarHBondContact OE2-CD 3.34Å; E29-K34 IonicContact OE2-NZ 2.81Å; E29-K34 PolarHBondContact OE2-NZ 2.65Å
30G77.8Confident85.9Confident39 Ų3965.2 Ų65.240%0.40233%0.334SS..SBendtrans87.7-132.2175.900000113.6Y27 T32Y27-G30 PolarHBondContact O-N 3.42Å; Y27-G30 VanDerWaalsContact O-N 3.09Å; G30-T32 VanDerWaalsContact C-N 3.29Å; G30-T32 PolarHBondContact O-N 3.45Å
31T76.4Confident85.6Confident134 Ų13466 Ų6682%0.82235%0.348SS*.SBendtrans-85.32.1-172.955.30000114R25R25-T31 VanDerWaalsContact NH2-C 3.3Å; R25-T31 PolarHBondContact NH2-O 3.29Å
32T79.9Confident85.2Confident41 Ų4169.9 Ų69.925%0.25237%0.366SS..SBendtrans-73.2138.4-178.1-68.50000112.4R25 G30 K34 E67R25-T32 PolarHBondContact NE-O 2.57Å; R25-T32 PolarHBondContact NH2-O 3.49Å; G30-T32 VanDerWaalsContact C-N 3.29Å; G30-T32 PolarHBondContact O-N 3.45Å; T32-K34 PolarHBondContact O-N 3.13Å; T32-K34 VanDerWaalsContact O-N 3.15Å; T32-E67 WeakPolarHBondContact CA-OE1 3.42Å; T32-E67 WeakPolarHBondContact CA-OE2 3.43Å; T32-E67 WeakPolarHBondContact CB-OE2 3.33Å; T32-E67 WeakPolarHBondContact CG2-OE2 3.36Å; T32-E67 PolarHBondContact OG1-OE2 3.21Å
33C83.6Confident84.8Confident1 Ų165 Ų651%0.00734%0.344CS..  trans-76.6100.7179.1-174.40000110.3R25 Y63 E67 M129R25-C33 VanDerWaalsContact NH2-N 3.19Å; C33-Y63 HydrophobicContact CB-CD1 4.14Å; C33-Y63 HydrophobicContact CB-CG 4.2Å; C33-Y63 WeakPolarHBondContact O-CB 3.38Å; C33-E67 PolarHBondContact N-OE1 2.71Å; C33-M129 HydrophobicContact CB-CE 3.47Å; C33-M129 VanDerWaalsContact CB-CE 3.47Å; C33-M129 WeakPolarHBondContact SG-CE 3.33Å
34K88.1Confident84.4Confident50 Ų5071.6 Ų71.622%0.21738%0.375CS..  trans-137.5140179.4-174.8-177.4179.8-168.10109.6R25 D26 E29 T32R25-K34 CarbonylContact C-O 3.5Å; R25-K34 WeakPolarHBondContact CA-O 3.5Å; R25-K34 WeakPolarHBondContact CG-O 3.07Å; D26-K34 HydrophobicContact CB-CB 4.45Å; D26-K34 HydrophobicContact CB-CD 4.39Å; D26-K34 HydrophobicContact CB-CG 4.3Å; D26-K34 PolarHBondContact N-O 3.28Å; D26-K34 IonicContact OD2-NZ 3.81Å; E29-K34 IonicContact OE1-NZ 2.93Å; E29-K34 PolarHBondContact OE1-NZ 3.45Å; E29-K34 WeakPolarHBondContact OE2-CD 3.34Å; E29-K34 IonicContact OE2-NZ 2.81Å; E29-K34 PolarHBondContact OE2-NZ 2.65Å; T32-K34 PolarHBondContact O-N 3.13Å; T32-K34 VanDerWaalsContact O-N 3.15Å
35F90.4Very high83.9Confident1 Ų170.7 Ų70.70%0.00438%0.382CS..BIsolated β-bridgetrans-107.2147.3177.5-60.5-79.6000111I23 R25 V56 N60 Y63 P124 I132I23-F35 HydrophobicContact CG2-CB 4.3Å; R25-F35 HydrophobicContact CB-CD1 4.49Å; F35-V56 HydrophobicContact CB-CG1 4.2Å; F35-N60 PolarHBondContact N-OD1 2.66Å; F35-N60 PolarHBondContact O-ND2 2.91Å; F35-Y63 HydrophobicContact CD2-CD2 4.42Å; F35-Y63 HydrophobicContact CD2-CE2 4.38Å; F35-Y63 AromaticContact CE2-CD2 3.86Å; F35-Y63 HydrophobicContact CE2-CD2 3.86Å; F35-Y63 AromaticContact CE2-CE2 3.56Å; F35-Y63 HydrophobicContact CE2-CE2 3.56Å; F35-Y63 HydrophobicContact CZ-CE2 4.46Å; F35-P124 HydrophobicContact CE1-CB 4.28Å; F35-P124 HydrophobicContact CE2-CB 4.29Å; F35-P124 HydrophobicContact CE2-CG 4.23Å; F35-P124 HydrophobicContact CZ-CB 3.59Å; F35-P124 HydrophobicContact CZ-CG 3.93Å; F35-I132 HydrophobicContact CB-CD1 3.67Å; F35-I132 HydrophobicContact CB-CG1 4.32Å; F35-I132 HydrophobicContact CD1-CD1 3.95Å; F35-I132 HydrophobicContact CD1-CG1 3.62Å; F35-I132 HydrophobicContact CD2-CD1 3.71Å; F35-I132 HydrophobicContact CD2-CG1 3.94Å; F35-I132 HydrophobicContact CE1-CG1 3.84Å; F35-I132 HydrophobicContact CE2-CD1 4.36Å; F35-I132 HydrophobicContact CE2-CG1 4.15Å; F35-I132 HydrophobicContact CG-CD1 3.48Å; F35-I132 VanDerWaalsContact CG-CD1 3.48Å; F35-I132 HydrophobicContact CG-CG1 3.67Å; F35-I132 HydrophobicContact CZ-CG1 4.1Å
36Q89.1Confident83.5Confident72 Ų7273 Ų7334%0.33639%0.391SS..  trans-63.3140175.6-65.91762700110.2I23 Q24 R25 D26 K38I23-Q36 HydrophobicContact CG2-CB 4.39Å; I23-Q36 WeakPolarHBondContact CG2-O 3.39Å; Q24-Q36 WeakPolarHBondContact O-CG 3.27Å; Q24-Q36 PolarHBondContact O-N 3.01Å; R25-Q36 PolarHBondContact O-NE2 3.48Å; D26-Q36 HydrophobicContact CB-CG 4.03Å; Q36-K38 VanDerWaalsContact C-N 3.29Å
37T86.1Confident83.4Confident61 Ų6172 Ų7237%0.37439%0.386SS..  trans-92.511175.656.30000112.5F39 V56 K57T37-F39 PolarHBondContact O-N 2.79Å; T37-V56 HydrophobicContact CG2-CG1 3.96Å; T37-K57 HydrophobicContact CG2-CG 4.41Å
38K86.4Confident83.6Confident164 Ų16471.6 Ų71.671%0.71339%0.389SS*.PPolyproline II helixtrans-64.3120.6178.5-175-178.8178.6-175.80109.2Q36 P40Q36-K38 VanDerWaalsContact C-N 3.29Å; K38-P40 WeakPolarHBondContact O-CD 3.48Å
39F84.2Confident83.8Confident37 Ų3770.2 Ų70.216%0.16237%0.372CS..PPolyproline II helixtrans-71.6124.8179.8-170.3-99.8000111T37 L43 E44 I47 L49 F52T37-F39 PolarHBondContact O-N 2.79Å; F39-L43 HydrophobicContact CE2-CB 4.36Å; F39-L43 HydrophobicContact CZ-CB 3.97Å; F39-E44 VanDerWaalsContact CE1-CA 3.44Å; F39-E44 HydrophobicContact CE1-CB 3.73Å; F39-E44 HydrophobicContact CE1-CG 4.13Å; F39-E44 HydrophobicContact CZ-CB 4.47Å; F39-I47 HydrophobicContact CE2-CG2 4.19Å; F39-I47 HydrophobicContact CZ-CG2 4.3Å; F39-L49 HydrophobicContact CB-CD1 3.91Å; F39-L49 HydrophobicContact CB-CG 4.17Å; F39-L49 HydrophobicContact CD1-CD1 4.28Å; F39-L49 HydrophobicContact CD2-CB 4.06Å; F39-L49 HydrophobicContact CD2-CD1 4.43Å; F39-L49 HydrophobicContact CD2-CG 3.98Å; F39-L49 HydrophobicContact CE2-CB 4.17Å; F39-L49 HydrophobicContact CG-CB 4.33Å; F39-L49 HydrophobicContact CG-CD1 3.96Å; F39-L49 HydrophobicContact CG-CG 4.01Å; F39-F52 HydrophobicContact CD2-CB 3.94Å; F39-F52 AromaticContact CD2-CD1 3.52Å; F39-F52 HydrophobicContact CD2-CD1 3.52Å; F39-F52 HydrophobicContact CD2-CE1 4.18Å; F39-F52 AromaticContact CD2-CG 3.81Å; F39-F52 HydrophobicContact CD2-CG 3.81Å; F39-F52 HydrophobicContact CE2-CB 3.76Å; F39-F52 HydrophobicContact CE2-CD1 4.18Å; F39-F52 AromaticContact CE2-CG 3.99Å; F39-F52 HydrophobicContact CE2-CG 3.99Å
40P85.4Confident84.3Confident17 Ų1767.9 Ų67.911%0.1137%0.367CS..PPolyproline II helixtrans-75.9131.5176.1-11.928.2000111.3V21 I23 K38 E42 L43 F52V21-P40 HydrophobicContact CG1-CB 3.42Å; V21-P40 VanDerWaalsContact CG1-CB 3.42Å; V21-P40 HydrophobicContact CG1-CG 3.48Å; V21-P40 VanDerWaalsContact CG1-CG 3.48Å; I23-P40 HydrophobicContact CG1-CG 4.48Å; K38-P40 WeakPolarHBondContact O-CD 3.48Å; P40-E42 WeakPolarHBondContact CB-OE2 3.41Å; P40-E42 PolarHBondContact O-N 3.02Å; P40-L43 HydrophobicContact CB-CD1 4.28Å; P40-L43 HydrophobicContact CB-CG 4.25Å; P40-L43 HydrophobicContact CG-CD1 3.78Å; P40-L43 HydrophobicContact CG-CG 4.29Å; P40-L43 PolarHBondContact O-N 2.94Å; P40-F52 HydrophobicContact CG-CZ 4.34Å
41S82.4Confident84.8Confident87 Ų8767.9 Ų67.961%0.60836%0.357SS*.G310 helixtrans-59.7-28.3178.937.90000113.3L43 E44S41-L43 PolarHBondContact O-N 3.21Å; S41-E44 WeakPolarHBondContact O-CB 3.1Å; S41-E44 PolarHBondContact O-N 3.39Å
42E82.4Confident85.5Confident93 Ų9361.5 Ų61.544%0.43532%0.318SS..G310 helixtrans-66.7-21.7178-58.982.8174.900112.6V21 P40 I136V21-E42 HydrophobicContact CG2-CB 3.79Å; V21-E42 HydrophobicContact CG2-CG 4.33Å; P40-E42 WeakPolarHBondContact CB-OE2 3.41Å; P40-E42 PolarHBondContact O-N 3.02Å; E42-I136 HydrophobicContact CB-CD1 4.41Å
43L82.1Confident86Confident0 Ų062.1 Ų62.10%032%0.318CS..G310 helixtrans-94.7-11.1-179.9-64.8-177.8000113.1V21 F39 P40 S41 S45 R46 I47 F52 L119 I134 I136V21-L43 HydrophobicContact CG1-CD1 4.43Å; V21-L43 HydrophobicContact CG2-CD2 4.36Å; V21-L43 HydrophobicContact CG2-CG 4.36Å; F39-L43 HydrophobicContact CE2-CB 4.36Å; F39-L43 HydrophobicContact CZ-CB 3.97Å; P40-L43 HydrophobicContact CB-CD1 4.28Å; P40-L43 HydrophobicContact CB-CG 4.25Å; P40-L43 HydrophobicContact CG-CD1 3.78Å; P40-L43 HydrophobicContact CG-CG 4.29Å; P40-L43 PolarHBondContact O-N 2.94Å; S41-L43 PolarHBondContact O-N 3.21Å; L43-S45 VanDerWaalsContact C-N 3.25Å; L43-S45 PolarHBondContact O-N 2.87Å; L43-R46 PolarHBondContact O-N 2.74Å; L43-I47 HydrophobicContact CB-CG2 3.91Å; L43-I47 PolarHBondContact O-N 3.34Å; L43-F52 HydrophobicContact CD1-CD2 4.27Å; L43-F52 HydrophobicContact CD1-CE2 4.18Å; L43-L119 HydrophobicContact CD2-CD1 4.22Å; L43-L119 HydrophobicContact CD2-CD2 3.79Å; L43-I134 HydrophobicContact CD1-CD1 3.76Å; L43-I134 HydrophobicContact CD1-CG2 4.49Å; L43-I134 HydrophobicContact CD2-CG2 4.14Å; L43-I136 HydrophobicContact CD2-CD1 4.13Å; L43-I136 HydrophobicContact CD2-CG1 4.31Å
44E81.9Confident86.4Confident146 Ų14667.8 Ų67.868%0.68235%0.345SS*.THydrogen-bonded Turntrans-58.4-35.5-175.3-163168.9-157.200113.4F39 S41 R46F39-E44 VanDerWaalsContact CE1-CA 3.44Å; F39-E44 HydrophobicContact CE1-CB 3.73Å; F39-E44 HydrophobicContact CE1-CG 4.13Å; F39-E44 HydrophobicContact CZ-CB 4.47Å; S41-E44 WeakPolarHBondContact O-CB 3.1Å; S41-E44 PolarHBondContact O-N 3.39Å; E44-R46 VanDerWaalsContact C-N 3.33Å
45S80.8Confident86.6Confident104 Ų10465.6 Ų65.673%0.72734%0.335SS*.THydrogen-bonded Turntrans-82.2-7.9178.861.60000114.2L43L43-S45 VanDerWaalsContact C-N 3.25Å; L43-S45 PolarHBondContact O-N 2.87Å
46R80.4Confident86.6Confident87 Ų8765.7 Ų65.733%0.32834%0.336SS..THydrogen-bonded Turntrans-119.4-32.5-169.4-61.6-65.1-171.4133.21.1113.6L43 E44 R117 L119 E138L43-R46 PolarHBondContact O-N 2.74Å; E44-R46 VanDerWaalsContact C-N 3.33Å; R46-R117 VanDerWaalsContact O-CD 3.25Å; R46-R117 WeakPolarHBondContact O-CD 3.34Å; R46-L119 HydrophobicContact CB-CD1 4Å; R46-L119 HydrophobicContact CB-CD2 4.27Å; R46-L119 HydrophobicContact CB-CG 4.34Å; R46-E138 IonicContact NH2-OE1 2.66Å; R46-E138 PolarHBondContact NH2-OE1 3Å
47I88.1Confident86.8Confident8 Ų867 Ų674%0.04134%0.341CS..SBendtrans-140.4146.3-178.8-170.6169.4000110.8F39 L43 L51 I113 Y114 L119F39-I47 HydrophobicContact CE2-CG2 4.19Å; F39-I47 HydrophobicContact CZ-CG2 4.3Å; L43-I47 HydrophobicContact CB-CG2 3.91Å; L43-I47 PolarHBondContact O-N 3.34Å; I47-L51 HydrophobicContact CD1-CB 4.43Å; I47-L51 HydrophobicContact CD1-CD2 4.1Å; I47-L51 HydrophobicContact CD1-CG 4.32Å; I47-L51 HydrophobicContact CG1-CB 4.26Å; I47-L51 HydrophobicContact CG1-CD2 4.06Å; I47-I113 HydrophobicContact CD1-CG2 4.03Å; I47-Y114 HydrophobicContact CD1-CD1 4.04Å; I47-Y114 HydrophobicContact CD1-CE1 3.37Å; I47-Y114 HydrophobicContact CD1-CE2 4.19Å; I47-Y114 VanDerWaalsContact CD1-CZ 3.44Å; I47-L119 HydrophobicContact CB-CD1 4.1Å; I47-L119 HydrophobicContact CG2-CD1 4.2Å
48E88.9Confident87.1Confident130 Ų13065.7 Ų65.761%0.60733%0.333SS*.  trans-69.2139.6174.8-161.3-175.9151.300110.9T50 L51 F52E48-T50 VanDerWaalsContact C-N 3.25Å; E48-T50 WeakPolarHBondContact CG-OG1 3.38Å; E48-T50 PolarHBondContact O-N 3.25Å; E48-T50 PolarHBondContact OE1-OG1 2.79Å; E48-L51 HydrophobicContact CB-CB 4.4Å; E48-L51 PolarHBondContact O-N 2.85Å; E48-F52 PolarHBondContact O-N 2.83Å; E48-F52 VanDerWaalsContact O-N 3.13Å
49L88.4Confident87.3Confident78 Ų7858 Ų5841%0.40830%0.299SS..Hα-helixtrans-56.5-40.6179.3-179.5153000112.1F39 L51 F52 E53F39-L49 HydrophobicContact CB-CD1 3.91Å; F39-L49 HydrophobicContact CB-CG 4.17Å; F39-L49 HydrophobicContact CD1-CD1 4.28Å; F39-L49 HydrophobicContact CD2-CB 4.06Å; F39-L49 HydrophobicContact CD2-CD1 4.43Å; F39-L49 HydrophobicContact CD2-CG 3.98Å; F39-L49 HydrophobicContact CE2-CB 4.17Å; F39-L49 HydrophobicContact CG-CB 4.33Å; F39-L49 HydrophobicContact CG-CD1 3.96Å; F39-L49 HydrophobicContact CG-CG 4.01Å; L49-L51 PolarHBondContact O-N 2.8Å; L49-F52 PolarHBondContact O-N 3.45Å; L49-E53 HydrophobicContact CD2-CG 3.99Å; L49-E53 WeakPolarHBondContact CD2-OE1 3.45Å; L49-E53 WeakPolarHBondContact O-CB 3.44Å; L49-E53 WeakPolarHBondContact O-CG 3.44Å; L49-E53 PolarHBondContact O-N 3.09Å
50T87.4Confident87.6Confident76 Ų7657 Ų5747%0.46630%0.296SS..Hα-helixtrans-59.6-45.1179.555.70000111.8E48 E53 E54E48-T50 VanDerWaalsContact C-N 3.25Å; E48-T50 WeakPolarHBondContact CG-OG1 3.38Å; E48-T50 PolarHBondContact O-N 3.25Å; E48-T50 PolarHBondContact OE1-OG1 2.79Å; T50-E53 PolarHBondContact O-N 2.85Å; T50-E54 WeakPolarHBondContact O-CB 3.43Å; T50-E54 PolarHBondContact O-N 3.29Å
51L88.7Confident87.9Confident38 Ų3861.3 Ų61.320%0.19932%0.318CS..Hα-helixtrans-69.6-40.4-178.2-166.565.9000112.1I47 E48 L49 T55 I113I47-L51 HydrophobicContact CD1-CB 4.43Å; I47-L51 HydrophobicContact CD1-CD2 4.1Å; I47-L51 HydrophobicContact CD1-CG 4.32Å; I47-L51 HydrophobicContact CG1-CB 4.26Å; I47-L51 HydrophobicContact CG1-CD2 4.06Å; E48-L51 HydrophobicContact CB-CB 4.4Å; E48-L51 PolarHBondContact O-N 2.85Å; L49-L51 PolarHBondContact O-N 2.8Å; L51-T55 WeakPolarHBondContact O-CB 3.42Å; L51-T55 PolarHBondContact O-N 2.98Å; L51-T55 PolarHBondContact O-OG1 3.05Å; L51-I113 HydrophobicContact CD1-CD1 3.89Å; L51-I113 HydrophobicContact CD2-CB 4.36Å; L51-I113 HydrophobicContact CD2-CD1 4.14Å; L51-I113 HydrophobicContact CD2-CG1 4.13Å; L51-I113 HydrophobicContact CD2-CG2 3.3Å; L51-I113 HydrophobicContact CG-CD1 4.27Å; L51-I113 HydrophobicContact CG-CG2 4.12Å
52F90.3Very high88.2Confident1 Ų158.9 Ų58.90%0.00430%0.296CS..Hα-helixtrans-62.5-50173.1170.6-93.9000111I23 F39 P40 L43 E48 L49 E54 T55 V56 I134I23-F52 HydrophobicContact CD1-CE2 4.32Å; I23-F52 HydrophobicContact CD1-CZ 4.47Å; I23-F52 HydrophobicContact CG1-CE2 4.12Å; I23-F52 HydrophobicContact CG1-CZ 3.81Å; F39-F52 HydrophobicContact CD2-CB 3.94Å; F39-F52 AromaticContact CD2-CD1 3.52Å; F39-F52 HydrophobicContact CD2-CD1 3.52Å; F39-F52 HydrophobicContact CD2-CE1 4.18Å; F39-F52 AromaticContact CD2-CG 3.81Å; F39-F52 HydrophobicContact CD2-CG 3.81Å; F39-F52 HydrophobicContact CE2-CB 3.76Å; F39-F52 HydrophobicContact CE2-CD1 4.18Å; F39-F52 AromaticContact CE2-CG 3.99Å; F39-F52 HydrophobicContact CE2-CG 3.99Å; P40-F52 HydrophobicContact CG-CZ 4.34Å; L43-F52 HydrophobicContact CD1-CD2 4.27Å; L43-F52 HydrophobicContact CD1-CE2 4.18Å; E48-F52 PolarHBondContact O-N 2.83Å; E48-F52 VanDerWaalsContact O-N 3.13Å; L49-F52 PolarHBondContact O-N 3.45Å; F52-E54 VanDerWaalsContact C-N 3.3Å; F52-E54 PolarHBondContact O-N 2.75Å; F52-T55 WeakPolarHBondContact O-CB 3.46Å; F52-T55 PolarHBondContact O-N 3.19Å; F52-V56 HydrophobicContact CD1-CG2 4.35Å; F52-V56 HydrophobicContact CD2-CG2 4.29Å; F52-V56 HydrophobicContact CE1-CG2 3.94Å; F52-V56 HydrophobicContact CE2-CG2 3.86Å; F52-V56 HydrophobicContact CZ-CG2 3.68Å; F52-V56 WeakPolarHBondContact O-CG2 3.43Å; F52-V56 PolarHBondContact O-N 3.47Å; F52-I134 HydrophobicContact CD2-CD1 4.36Å; F52-I134 HydrophobicContact CE2-CD1 3.91Å
53E90.5Very high88.4Confident54 Ų5454.4 Ų54.425%0.25228%0.275SS..Hα-helixtrans-59.3-42.6178.8-80-165.1-17700112L49 T50 T55 V56 K57L49-E53 HydrophobicContact CD2-CG 3.99Å; L49-E53 WeakPolarHBondContact CD2-OE1 3.45Å; L49-E53 WeakPolarHBondContact O-CB 3.44Å; L49-E53 WeakPolarHBondContact O-CG 3.44Å; L49-E53 PolarHBondContact O-N 3.09Å; T50-E53 PolarHBondContact O-N 2.85Å; E53-T55 VanDerWaalsContact C-N 3.34Å; E53-V56 PolarHBondContact O-N 2.67Å; E53-K57 VanDerWaalsContact O-CB 3.24Å; E53-K57 WeakPolarHBondContact O-CB 3.46Å; E53-K57 WeakPolarHBondContact O-CD 3.34Å; E53-K57 WeakPolarHBondContact O-CG 3.49Å; E53-K57 PolarHBondContact O-N 3.47Å; E53-K57 IonicContact OE2-NZ 3.97Å; E53-K57 PolarHBondContact OE2-NZ 2.73Å
54E92Very high88.6Confident120 Ų12056.6 Ų56.656%0.56129%0.294SS*.Hα-helixtrans-62.4-42.6177.2-172-179.717800111.4T50 F52 K57 T58T50-E54 WeakPolarHBondContact O-CB 3.43Å; T50-E54 PolarHBondContact O-N 3.29Å; F52-E54 VanDerWaalsContact C-N 3.3Å; F52-E54 PolarHBondContact O-N 2.75Å; E54-K57 PolarHBondContact O-N 3.48Å; E54-T58 VanDerWaalsContact O-CB 3.28Å; E54-T58 WeakPolarHBondContact O-CB 3.43Å; E54-T58 PolarHBondContact O-N 2.83Å; E54-T58 PolarHBondContact O-OG1 2.95Å
55T91.8Very high88.6Confident3 Ų353.6 Ų53.62%0.01828%0.279CS..Hα-helixtrans-60.3-50.1176.1-54.10000110.8L51 F52 E53 T58 L59 Y105 Q109 Y114 I121L51-T55 WeakPolarHBondContact O-CB 3.42Å; L51-T55 PolarHBondContact O-N 2.98Å; L51-T55 PolarHBondContact O-OG1 3.05Å; F52-T55 WeakPolarHBondContact O-CB 3.46Å; F52-T55 PolarHBondContact O-N 3.19Å; E53-T55 VanDerWaalsContact C-N 3.34Å; T55-T58 PolarHBondContact O-N 2.96Å; T55-L59 HydrophobicContact CG2-CD1 4.33Å; T55-L59 WeakPolarHBondContact O-CG 3.45Å; T55-L59 PolarHBondContact O-N 3.41Å; T55-Y105 HydrophobicContact CG2-CE1 4.26Å; T55-Q109 HydrophobicContact CG2-CG 4.33Å; T55-Y114 WeakPolarHBondContact CB-OH 3.46Å; T55-Y114 HydrophobicContact CG2-CE2 4.24Å; T55-Y114 PolarHBondContact OG1-OH 3.04Å; T55-I121 HydrophobicContact CG2-CD1 4.11Å
56V91.6Very high88.6Confident3 Ų348.7 Ų48.72%0.01825%0.245CC..Hα-helixtrans-66.7-41.2-178.8177.40000111.4F35 T37 F52 E53 T58 L59 N60 I132F35-V56 HydrophobicContact CB-CG1 4.2Å; T37-V56 HydrophobicContact CG2-CG1 3.96Å; F52-V56 HydrophobicContact CD1-CG2 4.35Å; F52-V56 HydrophobicContact CD2-CG2 4.29Å; F52-V56 HydrophobicContact CE1-CG2 3.94Å; F52-V56 HydrophobicContact CE2-CG2 3.86Å; F52-V56 HydrophobicContact CZ-CG2 3.68Å; F52-V56 WeakPolarHBondContact O-CG2 3.43Å; F52-V56 PolarHBondContact O-N 3.47Å; E53-V56 PolarHBondContact O-N 2.67Å; V56-T58 VanDerWaalsContact C-N 3.34Å; V56-T58 PolarHBondContact O-N 2.94Å; V56-L59 PolarHBondContact O-N 3.18Å; V56-N60 WeakPolarHBondContact O-CB 3.5Å; V56-N60 VanDerWaalsContact O-CG 3.23Å; V56-N60 PolarHBondContact O-N 2.77Å; V56-N60 PolarHBondContact O-ND2 3.41Å; V56-I132 HydrophobicContact CG2-CD1 4.46Å
57K92.3Very high88.3Confident100 Ų10047.2 Ų47.244%0.43524%0.242SC..Hα-helixtrans-61-43.5174.6-77167.8-178158.20111.2T37 E53 E54 N60 N61T37-K57 HydrophobicContact CG2-CG 4.41Å; E53-K57 VanDerWaalsContact O-CB 3.24Å; E53-K57 WeakPolarHBondContact O-CB 3.46Å; E53-K57 WeakPolarHBondContact O-CD 3.34Å; E53-K57 WeakPolarHBondContact O-CG 3.49Å; E53-K57 PolarHBondContact O-N 3.47Å; E53-K57 IonicContact OE2-NZ 3.97Å; E53-K57 PolarHBondContact OE2-NZ 2.73Å; E54-K57 PolarHBondContact O-N 3.48Å; K57-N60 PolarHBondContact O-N 2.81Å; K57-N61 VanDerWaalsContact O-CG 3.27Å; K57-N61 PolarHBondContact O-N 3.1Å; K57-N61 PolarHBondContact O-ND2 2.96Å
58T92.3Very high87.5Confident34 Ų3455.1 Ų55.121%0.20928%0.276CS..Hα-helixtrans-65.2-42.9178.2-58.50000111.6E54 T55 V56 N61 F62 Y105E54-T58 VanDerWaalsContact O-CB 3.28Å; E54-T58 WeakPolarHBondContact O-CB 3.43Å; E54-T58 PolarHBondContact O-N 2.83Å; E54-T58 PolarHBondContact O-OG1 2.95Å; T55-T58 PolarHBondContact O-N 2.96Å; V56-T58 VanDerWaalsContact C-N 3.34Å; V56-T58 PolarHBondContact O-N 2.94Å; T58-N61 WeakPolarHBondContact O-CB 3.23Å; T58-N61 PolarHBondContact O-N 3.17Å; T58-F62 HydrophobicContact CG2-CD2 4.11Å; T58-F62 HydrophobicContact CG2-CE2 3.54Å; T58-F62 HydrophobicContact CG2-CZ 3.97Å; T58-F62 WeakPolarHBondContact O-CD2 3.37Å; T58-F62 PolarHBondContact O-N 3.3Å; T58-Y105 WeakPolarHBondContact CB-OH 3.37Å; T58-Y105 HydrophobicContact CG2-CE1 4.02Å; T58-Y105 HydrophobicContact CG2-CE2 3.91Å
59L90.9Very high86.1Confident1 Ų152 Ų521%0.00526%0.263CS..Hα-helixtrans-59.3-49.3173.1-74.7172.8000111.6T55 V56 N61 F62 Y63 I102 Y105 I106 I132T55-L59 HydrophobicContact CG2-CD1 4.33Å; T55-L59 WeakPolarHBondContact O-CG 3.45Å; T55-L59 PolarHBondContact O-N 3.41Å; V56-L59 PolarHBondContact O-N 3.18Å; L59-N61 VanDerWaalsContact C-N 3.26Å; L59-N61 PolarHBondContact O-N 2.75Å; L59-F62 PolarHBondContact O-N 3.38Å; L59-F62 VanDerWaalsContact O-N 3.09Å; L59-Y63 HydrophobicContact CB-CE2 4.49Å; L59-Y63 WeakPolarHBondContact O-CD2 3.26Å; L59-Y63 PolarHBondContact O-N 2.94Å; L59-I102 HydrophobicContact CD2-CG2 3.84Å; L59-Y105 HydrophobicContact CD2-CD1 3.81Å; L59-Y105 HydrophobicContact CD2-CE1 4.09Å; L59-Y105 HydrophobicContact CG-CD1 4.36Å; L59-Y105 HydrophobicContact CG-CE1 4.12Å; L59-I106 HydrophobicContact CD2-CD1 4.05Å; L59-I106 HydrophobicContact CD2-CG1 3.76Å; L59-I132 HydrophobicContact CD1-CD1 4.1Å
60N91.3Very high84.7Confident17 Ų1750 Ų509%0.09126%0.261CS..Hα-helixtrans-57.2-40.4177-73.5-16.2000111.8F35 V56 K57 Y63 A64F35-N60 PolarHBondContact N-OD1 2.66Å; F35-N60 PolarHBondContact O-ND2 2.91Å; V56-N60 WeakPolarHBondContact O-CB 3.5Å; V56-N60 VanDerWaalsContact O-CG 3.23Å; V56-N60 PolarHBondContact O-N 2.77Å; V56-N60 PolarHBondContact O-ND2 3.41Å; K57-N60 PolarHBondContact O-N 2.81Å; N60-Y63 PolarHBondContact O-N 3.14Å; N60-A64 WeakPolarHBondContact O-CB 3.2Å; N60-A64 PolarHBondContact O-N 3Å
61N90.8Very high83.2Confident108 Ų10848.5 Ų48.558%0.57826%0.261SS*.Hα-helixtrans-63.7-41.7175.5-73.3-23.3000112.3K57 T58 L59 A64 E65K57-N61 VanDerWaalsContact O-CG 3.27Å; K57-N61 PolarHBondContact O-N 3.1Å; K57-N61 PolarHBondContact O-ND2 2.96Å; T58-N61 WeakPolarHBondContact O-CB 3.23Å; T58-N61 PolarHBondContact O-N 3.17Å; L59-N61 VanDerWaalsContact C-N 3.26Å; L59-N61 PolarHBondContact O-N 2.75Å; N61-A64 PolarHBondContact O-N 3.09Å; N61-E65 WeakPolarHBondContact O-CB 3.24Å; N61-E65 PolarHBondContact O-N 3.22Å
62F89Confident81.4Confident35 Ų3553.9 Ų53.915%0.15429%0.285CS..Hα-helixtrans-65.3-39.1175.6-69.7-44.1000112.6T58 L59 E65 A66 K101 I102 Y105T58-F62 HydrophobicContact CG2-CD2 4.11Å; T58-F62 HydrophobicContact CG2-CE2 3.54Å; T58-F62 HydrophobicContact CG2-CZ 3.97Å; T58-F62 WeakPolarHBondContact O-CD2 3.37Å; T58-F62 PolarHBondContact O-N 3.3Å; L59-F62 PolarHBondContact O-N 3.38Å; L59-F62 VanDerWaalsContact O-N 3.09Å; F62-E65 PolarHBondContact O-N 3.29Å; F62-A66 WeakPolarHBondContact O-CB 3.48Å; F62-A66 PolarHBondContact O-N 3.06Å; F62-K101 HydrophobicContact CE1-CD 4.44Å; F62-I102 HydrophobicContact CB-CD1 3.9Å; F62-I102 HydrophobicContact CB-CG1 3.57Å; F62-I102 HydrophobicContact CD2-CG1 4.35Å; F62-I102 HydrophobicContact CG-CG1 4.2Å; F62-Y105 HydrophobicContact CD2-CD1 4.35Å; F62-Y105 HydrophobicContact CD2-CG 4.43Å; F62-Y105 AromaticContact CE2-CD1 3.93Å; F62-Y105 HydrophobicContact CE2-CD1 3.93Å; F62-Y105 AromaticContact CE2-CD2 3.93Å; F62-Y105 HydrophobicContact CE2-CD2 3.93Å; F62-Y105 HydrophobicContact CE2-CE1 4.41Å; F62-Y105 HydrophobicContact CE2-CE2 4.41Å; F62-Y105 AromaticContact CE2-CG 3.67Å; F62-Y105 HydrophobicContact CE2-CG 3.67Å
63Y86.6Confident79.7Confident0 Ų055.3 Ų55.30%030%0.295CS..Hα-helixtrans-67.8-39.5174.9-75-67.6000112.1C33 F35 L59 N60 E65 A66 E67 L99 I102 M129C33-Y63 HydrophobicContact CB-CD1 4.14Å; C33-Y63 HydrophobicContact CB-CG 4.2Å; C33-Y63 WeakPolarHBondContact O-CB 3.38Å; F35-Y63 HydrophobicContact CD2-CD2 4.42Å; F35-Y63 HydrophobicContact CD2-CE2 4.38Å; F35-Y63 AromaticContact CE2-CD2 3.86Å; F35-Y63 HydrophobicContact CE2-CD2 3.86Å; F35-Y63 AromaticContact CE2-CE2 3.56Å; F35-Y63 HydrophobicContact CE2-CE2 3.56Å; F35-Y63 HydrophobicContact CZ-CE2 4.46Å; L59-Y63 HydrophobicContact CB-CE2 4.49Å; L59-Y63 WeakPolarHBondContact O-CD2 3.26Å; L59-Y63 PolarHBondContact O-N 2.94Å; N60-Y63 PolarHBondContact O-N 3.14Å; Y63-E65 VanDerWaalsContact C-N 3.34Å; Y63-E65 PolarHBondContact O-N 2.97Å; Y63-A66 WeakPolarHBondContact O-CB 3.4Å; Y63-A66 PolarHBondContact O-N 3.41Å; Y63-E67 PolarHBondContact O-N 2.78Å; Y63-L99 HydrophobicContact CE1-CD2 4.24Å; Y63-I102 HydrophobicContact CD1-CD1 3.74Å; Y63-I102 HydrophobicContact CD2-CD1 4.4Å; Y63-I102 HydrophobicContact CE1-CD1 3.64Å; Y63-I102 HydrophobicContact CE2-CD1 4.28Å; Y63-I102 HydrophobicContact CE2-CG2 4.21Å; Y63-I102 HydrophobicContact CG-CD1 4.13Å; Y63-M129 HydrophobicContact CD1-CE 4.01Å; Y63-M129 HydrophobicContact CE1-CE 3.91Å
64A85.9Confident77.8Confident46 Ų4660.9 Ų60.938%0.3832%0.315SS..Hα-helixtrans-63.4-39.6173.400000112.2N60 N61 E67 K68N60-A64 WeakPolarHBondContact O-CB 3.2Å; N60-A64 PolarHBondContact O-N 3Å; N61-A64 PolarHBondContact O-N 3.09Å; A64-E67 PolarHBondContact O-N 3.43Å; A64-K68 WeakPolarHBondContact O-CB 3.49Å; A64-K68 PolarHBondContact O-N 3.13Å
65E83.1Confident75.7Confident82 Ų8261.1 Ų61.138%0.38332%0.32SS..Hα-helixtrans-60.8-45.5172.9-170.2-173.8174.400110.5N61 F62 Y63 E67 K68 I69 K101N61-E65 WeakPolarHBondContact O-CB 3.24Å; N61-E65 PolarHBondContact O-N 3.22Å; F62-E65 PolarHBondContact O-N 3.29Å; Y63-E65 VanDerWaalsContact C-N 3.34Å; Y63-E65 PolarHBondContact O-N 2.97Å; E65-E67 VanDerWaalsContact C-N 3.3Å; E65-E67 PolarHBondContact O-N 2.68Å; E65-K68 PolarHBondContact O-N 2.88Å; E65-I69 HydrophobicContact CG-CD1 3.88Å; E65-I69 WeakPolarHBondContact O-CD1 3.45Å; E65-I69 VanDerWaalsContact O-CG1 3.22Å; E65-I69 WeakPolarHBondContact O-CG1 3.46Å; E65-I69 PolarHBondContact O-N 3.1Å; E65-I69 VanDerWaalsContact O-N 3.13Å; E65-K101 IonicContact OE1-NZ 3.28Å; E65-K101 IonicContact OE2-NZ 2.65Å; E65-K101 PolarHBondContact OE2-NZ 3.41Å
66A79.7Confident73.9Confident2 Ų266.7 Ų66.72%0.01735%0.346CS..Hα-helixtrans-58.3-41.517800000112.3F62 Y63 G70 Y95 V98F62-A66 WeakPolarHBondContact O-CB 3.48Å; F62-A66 PolarHBondContact O-N 3.06Å; Y63-A66 WeakPolarHBondContact O-CB 3.4Å; Y63-A66 PolarHBondContact O-N 3.41Å; A66-G70 PolarHBondContact O-N 2.79Å; A66-Y95 HydrophobicContact CB-CD2 4Å; A66-Y95 HydrophobicContact CB-CE2 3.67Å; A66-V98 HydrophobicContact CB-CB 4.1Å; A66-V98 HydrophobicContact CB-CG1 3.61Å
67E75.7Confident72Confident55 Ų5567.5 Ų67.526%0.25735%0.354SS..Hα-helixtrans-74.9-39.2-179.7-72.7-170.3-17400113.8T32 C33 Y63 A64 E65 I69 G70 G71T32-E67 WeakPolarHBondContact CA-OE1 3.42Å; T32-E67 WeakPolarHBondContact CA-OE2 3.43Å; T32-E67 WeakPolarHBondContact CB-OE2 3.33Å; T32-E67 WeakPolarHBondContact CG2-OE2 3.36Å; T32-E67 PolarHBondContact OG1-OE2 3.21Å; C33-E67 PolarHBondContact N-OE1 2.71Å; Y63-E67 PolarHBondContact O-N 2.78Å; A64-E67 PolarHBondContact O-N 3.43Å; E65-E67 VanDerWaalsContact C-N 3.3Å; E65-E67 PolarHBondContact O-N 2.68Å; E67-I69 PolarHBondContact O-N 2.82Å; E67-G70 WeakPolarHBondContact O-CA 3.32Å; E67-G70 PolarHBondContact O-N 2.94Å; E67-G70 VanDerWaalsContact O-N 3.09Å; E67-G71 PolarHBondContact O-N 2.73Å
68K69.6Low70.1Confident174 Ų17466.4 Ų66.476%0.75736%0.358SS*.Hα-helixtrans-62.1-36.9176.2-164.6178.4-176.7-179.20111.5A64 E65A64-K68 WeakPolarHBondContact O-CB 3.49Å; A64-K68 PolarHBondContact O-N 3.13Å; E65-K68 PolarHBondContact O-N 2.88Å
69I60.8Low68.2Low66 Ų6671.2 Ų71.234%0.33838%0.382SS..Hα-helixtrans-72-35.4174.7-64.6167.3000111.1E65 E67 S73E65-I69 HydrophobicContact CG-CD1 3.88Å; E65-I69 WeakPolarHBondContact O-CD1 3.45Å; E65-I69 VanDerWaalsContact O-CG1 3.22Å; E65-I69 WeakPolarHBondContact O-CG1 3.46Å; E65-I69 PolarHBondContact O-N 3.1Å; E65-I69 VanDerWaalsContact O-N 3.13Å; E67-I69 PolarHBondContact O-N 2.82Å; I69-S73 PolarHBondContact O-N 3.15Å; I69-S73 PolarHBondContact O-OG 3.38Å
70G58.5Low66.2Low34 Ų3472.8 Ų72.835%0.35140%0.395SS..Hα-helixtrans-64.3-41.5174.600000113.6A66 E67 S73 Y74A66-G70 PolarHBondContact O-N 2.79Å; E67-G70 WeakPolarHBondContact O-CA 3.32Å; E67-G70 PolarHBondContact O-N 2.94Å; E67-G70 VanDerWaalsContact O-N 3.09Å; G70-S73 PolarHBondContact O-N 3.36Å; G70-Y74 PolarHBondContact O-N 3.28Å; G70-Y74 VanDerWaalsContact O-N 3.1Å
71G55Low64.3Low46 Ų4676.2 Ų76.247%0.47442%0.42SS..Hα-helixtrans-65.3-39.5-179.800000114.2E67 Y74E67-G71 PolarHBondContact O-N 2.73Å; G71-Y74 PolarHBondContact O-N 2.62Å
72Q51.2Low62.6Low150 Ų15075.3 Ų75.370%0.70143%0.427SS*.Hα-helixtrans-68.5-36.1173.6-75-85.7-45.600112Y74Q72-Y74 VanDerWaalsContact C-N 3.28Å; Q72-Y74 PolarHBondContact O-N 2.9Å
73S54.3Low61.2Low32 Ų3278.5 Ų78.522%0.22445%0.449CS..Hα-helixtrans-73.3-16.6178.3-55.80000113.2I69 G70 G77 R94I69-S73 PolarHBondContact O-N 3.15Å; I69-S73 PolarHBondContact O-OG 3.38Å; G70-S73 PolarHBondContact O-N 3.36Å; S73-G77 WeakPolarHBondContact O-CA 3.27Å; S73-G77 PolarHBondContact O-N 3.43Å; S73-R94 PolarHBondContact OG-NH2 2.85Å
74Y50.6Low59.9Low170 Ų17081.5 Ų81.567%0.66747%0.474SS*.Hα-helixtrans-70-36.3177.8-148.1-92.1000112G70 G71 Q72 G77 C78G70-Y74 PolarHBondContact O-N 3.28Å; G70-Y74 VanDerWaalsContact O-N 3.1Å; G71-Y74 PolarHBondContact O-N 2.62Å; Q72-Y74 VanDerWaalsContact C-N 3.28Å; Q72-Y74 PolarHBondContact O-N 2.9Å; Y74-G77 CarbonylContact O-C 3.6Å; Y74-G77 PolarHBondContact O-N 3.48Å; Y74-C78 PolarHBondContact O-N 3.34Å; Y74-C78 PolarHBondContact O-SG 3.16Å; Y74-C78 VanDerWaalsContact O-SG 3.37Å
75L49.6Very low58.4Low126 Ų12688.6 Ų88.666%0.6649%0.493SS*.Hα-helixtrans-71.7-38.6175.1-71.8168.8000112G77 L79L75-G77 VanDerWaalsContact C-N 3.28Å; L75-L79 PolarHBondContact O-N 3.27Å
76E52.6Low57Low120 Ų12090.8 Ų90.856%0.56151%0.506SS*.Hα-helixtrans-63.5-35.8166.7-78.8-172.7140.900111.5L79 A80 R94E76-L79 WeakPolarHBondContact O-CB 3.44Å; E76-L79 PolarHBondContact O-N 2.93Å; E76-A80 PolarHBondContact O-N 2.87Å; E76-R94 IonicContact OE2-NH2 3.23Å; E76-R94 PolarHBondContact OE2-NH2 3.43Å
77G53.1Low55.5Low19 Ų1992 Ų9220%0.19651%0.512CS..Hα-helixtrans-67.3-37.6179.300000113.3S73 Y74 L75 L79 A80 C81 I87S73-G77 WeakPolarHBondContact O-CA 3.27Å; S73-G77 PolarHBondContact O-N 3.43Å; Y74-G77 CarbonylContact O-C 3.6Å; Y74-G77 PolarHBondContact O-N 3.48Å; L75-G77 VanDerWaalsContact C-N 3.28Å; G77-L79 VanDerWaalsContact C-N 3.31Å; G77-L79 PolarHBondContact O-N 3.32Å; G77-A80 PolarHBondContact O-N 3.36Å; G77-C81 PolarHBondContact O-N 3.09Å; G77-I87 WeakPolarHBondContact O-CD1 3.48Å
78C51.4Low54.2Low77 Ų7797.1 Ų97.152%0.5253%0.534SS..Hα-helixtrans-63.2-36.3171-70.90000112.3Y74Y74-C78 PolarHBondContact O-N 3.34Å; Y74-C78 PolarHBondContact O-SG 3.16Å; Y74-C78 VanDerWaalsContact O-SG 3.37Å
79L51.4Low53.3Low136 Ų13694.7 Ų94.771%0.71253%0.528SS*.Hα-helixtrans-68.8-33.3173.8-90.4154.6000112.7L75 E76 G77L75-L79 PolarHBondContact O-N 3.27Å; E76-L79 WeakPolarHBondContact O-CB 3.44Å; E76-L79 PolarHBondContact O-N 2.93Å; G77-L79 VanDerWaalsContact C-N 3.31Å; G77-L79 PolarHBondContact O-N 3.32Å
80A50.7Low52.7Low34 Ų3495.7 Ų95.728%0.28154%0.54SS..Hα-helixtrans-84-21.4177.100000113.9E76 G77 A82 T83 I87E76-A80 PolarHBondContact O-N 2.87Å; G77-A80 PolarHBondContact O-N 3.36Å; A80-A82 PolarHBondContact O-N 3.37Å; A80-T83 PolarHBondContact O-N 2.89Å; A80-T83 VanDerWaalsContact O-N 3.08Å; A80-T83 PolarHBondContact O-OG1 3.37Å; A80-I87 HydrophobicContact CB-CD1 3.41Å; A80-I87 VanDerWaalsContact CB-CD1 3.41Å; A80-I87 HydrophobicContact CB-CG1 3.86Å
81C49.8Very low52.1Low89 Ų89100.8 Ų100.860%0.60156%0.557SS**Hα-helixtrans-64.6-26.3172.2-93.40000111.7G77 T83 I87G77-C81 PolarHBondContact O-N 3.09Å; C81-T83 PolarHBondContact O-N 2.96Å; C81-I87 HydrophobicContact CB-CD1 4.48Å
82A55.3Low51.8Low89 Ų89104.1 Ų104.174%0.73656%0.56SS**THydrogen-bonded Turntrans-66.7-13.9173.500000113.5A80A80-A82 PolarHBondContact O-N 3.37Å
83T60.5Low51.9Low101 Ų10199.9 Ų99.962%0.6254%0.544SS*.THydrogen-bonded Turntrans-111.519.4-175.560.90000115.4A80 C81A80-T83 PolarHBondContact O-N 2.89Å; A80-T83 VanDerWaalsContact O-N 3.08Å; A80-T83 PolarHBondContact O-OG1 3.37Å; C81-T83 PolarHBondContact O-N 2.96Å
84A60Low52.1Low63 Ų63104.2 Ų104.252%0.52156%0.556SS.*  trans67.192.9161.100000118L86A84-L86 VanDerWaalsContact C-N 3.32Å; A84-L86 PolarHBondContact O-N 3.48Å; A84-L86 VanDerWaalsContact O-N 3.1Å
85Y53.6Low53Low196 Ų196100.3 Ų100.377%0.76954%0.54SS*.SBendtrans72.3-14.8163.4-58.3-80.8000119I87Y85-I87 PolarHBondContact O-N 2.92Å
86L52.8Low54Low128 Ų12897.6 Ų97.667%0.6752%0.524SS*.THydrogen-bonded Turntrans-66.8-17.5172.3-10886000113.7A84 F88 L89 C90A84-L86 VanDerWaalsContact C-N 3.32Å; A84-L86 PolarHBondContact O-N 3.48Å; A84-L86 VanDerWaalsContact O-N 3.1Å; L86-F88 VanDerWaalsContact C-N 3.29Å; L86-F88 PolarHBondContact O-N 3.32Å; L86-L89 PolarHBondContact O-N 2.88Å; L86-C90 PolarHBondContact O-N 3Å
87I49.5Very low55.1Low27 Ų2798.4 Ų98.414%0.13853%0.526CS..Hα-helixtrans-68.5-27.2-176.2-143.1170.1000113.6G77 A80 C81 Y85 L89 C90 M91G77-I87 WeakPolarHBondContact O-CD1 3.48Å; A80-I87 HydrophobicContact CB-CD1 3.41Å; A80-I87 VanDerWaalsContact CB-CD1 3.41Å; A80-I87 HydrophobicContact CB-CG1 3.86Å; C81-I87 HydrophobicContact CB-CD1 4.48Å; Y85-I87 PolarHBondContact O-N 2.92Å; I87-L89 VanDerWaalsContact C-N 3.25Å; I87-L89 PolarHBondContact O-N 3.47Å; I87-C90 PolarHBondContact O-N 3.38Å; I87-C90 VanDerWaalsContact O-N 3.11Å; I87-M91 WeakPolarHBondContact O-CG 3.09Å; I87-M91 PolarHBondContact O-N 2.76Å
88F47.5Very low56.4Low162 Ų16298.4 Ų98.471%0.71152%0.522SS*.Hα-helixtrans-63.4-32.8175.4-87.5-80.8000111.6L86L86-F88 VanDerWaalsContact C-N 3.29Å; L86-F88 PolarHBondContact O-N 3.32Å
89L50.5Low57.9Low124 Ų12496 Ų9665%0.64950%0.504SS*.Hα-helixtrans-75.5-25.8173.6-80.8159.6000113.3L86 I87 T93L86-L89 PolarHBondContact O-N 2.88Å; I87-L89 VanDerWaalsContact C-N 3.25Å; I87-L89 PolarHBondContact O-N 3.47Å; L89-T93 WeakPolarHBondContact O-CG2 3.19Å
90C48.6Very low59.4Low87 Ų8795.8 Ų95.859%0.58850%0.497SS*.Hα-helixtrans-87.4-30.9-179.2-95.20000113.3L86 I87 E92 T93L86-C90 PolarHBondContact O-N 3Å; I87-C90 PolarHBondContact O-N 3.38Å; I87-C90 VanDerWaalsContact O-N 3.11Å; C90-E92 PolarHBondContact O-N 3.46Å; C90-T93 PolarHBondContact O-N 3.13Å; C90-T93 PolarHBondContact O-OG1 2.88Å
91M45.7Very low61.2Low140 Ų14098.6 Ų98.669%0.6950%0.503SS*.Hα-helixtrans-63.5-27.8174.4-70.3-15078.600112.4I87 T93I87-M91 WeakPolarHBondContact O-CG 3.09Å; I87-M91 PolarHBondContact O-N 2.76Å; M91-T93 PolarHBondContact O-N 3.23Å; M91-T93 VanDerWaalsContact O-N 3.12Å
92E48.6Very low63.1Low117 Ų11794.3 Ų94.355%0.54747%0.474SS..THydrogen-bonded Turntrans-70.12176.8-150.3170.214800114.1C90 E96C90-E92 PolarHBondContact O-N 3.46Å; E92-E96 WeakPolarHBondContact CG-OE1 3.15Å; E92-E96 WeakPolarHBondContact O-CG 3.07Å
93T53.6Low64.7Low60 Ų6091.8 Ų91.837%0.36845%0.453SS..THydrogen-bonded Turntrans-127-5.4-163.468.40000118.1L89 C90 M91 K97L89-T93 WeakPolarHBondContact O-CG2 3.19Å; C90-T93 PolarHBondContact O-N 3.13Å; C90-T93 PolarHBondContact O-OG1 2.88Å; M91-T93 PolarHBondContact O-N 3.23Å; M91-T93 VanDerWaalsContact O-N 3.12Å; T93-K97 WeakPolarHBondContact O-CD 3.21Å; T93-K97 WeakPolarHBondContact O-CE 3.13Å; T93-K97 VanDerWaalsContact O-CG 3.25Å; T93-K97 WeakPolarHBondContact O-CG 3.2Å; T93-K97 PolarHBondContact O-NZ 3.38Å
94R59.6Low66.2Low124 Ų12493 Ų9347%0.46845%0.45SS..THydrogen-bonded Turntrans-120.7-44.8178.2-65.1-139.8-69.3-145.7-2.7114.5S73 E76 E96 K97 V98S73-R94 PolarHBondContact OG-NH2 2.85Å; E76-R94 IonicContact OE2-NH2 3.23Å; E76-R94 PolarHBondContact OE2-NH2 3.43Å; R94-E96 VanDerWaalsContact C-N 3.34Å; R94-K97 PolarHBondContact O-N 2.87Å; R94-V98 PolarHBondContact O-N 3.07Å
95Y68.1Low67.7Low88 Ų8891.8 Ų91.835%0.34543%0.432SS..Hα-helixtrans-63.3-44.1171.6-172.1-110.6000110.5A66 K97 V98 L99 M129A66-Y95 HydrophobicContact CB-CD2 4Å; A66-Y95 HydrophobicContact CB-CE2 3.67Å; Y95-K97 PolarHBondContact O-N 3.36Å; Y95-V98 PolarHBondContact O-N 3.05Å; Y95-L99 HydrophobicContact CD1-CD1 3.52Å; Y95-L99 HydrophobicContact CD1-CD2 4.37Å; Y95-L99 HydrophobicContact CD1-CG 3.88Å; Y95-L99 HydrophobicContact CE1-CD1 3.44Å; Y95-L99 VanDerWaalsContact CE1-CD1 3.44Å; Y95-L99 HydrophobicContact CE1-CD2 3.75Å; Y95-L99 HydrophobicContact CE1-CG 3.76Å; Y95-L99 HydrophobicContact CG-CG 4.49Å; Y95-L99 WeakPolarHBondContact O-CG 3.41Å; Y95-L99 PolarHBondContact O-N 3.23Å; Y95-M129 WeakPolarHBondContact OH-CE 3.47Å
96E71.6Confident69.5Low69 Ų6982.8 Ų82.832%0.32240%0.397SS..Hα-helixtrans-55.7-35.2173.4-72.6-156.717300114.3E92 R94 V98 L99 K100E92-E96 WeakPolarHBondContact CG-OE1 3.15Å; E92-E96 WeakPolarHBondContact O-CG 3.07Å; R94-E96 VanDerWaalsContact C-N 3.34Å; E96-V98 VanDerWaalsContact C-N 3.33Å; E96-L99 PolarHBondContact O-N 3.49Å; E96-K100 WeakPolarHBondContact O-CB 3.36Å; E96-K100 VanDerWaalsContact O-CG 3.23Å; E96-K100 WeakPolarHBondContact O-CG 3.38Å; E96-K100 PolarHBondContact O-N 3.38Å; E96-K100 IonicContact OE2-NZ 3.11Å; E96-K100 PolarHBondContact OE2-NZ 3.32Å; E96-K100 VanDerWaalsContact OE2-NZ 3.11Å
97K75.5Confident71.3Confident137 Ų13779 Ų7960%0.59638%0.376SS*.Hα-helixtrans-66-39.6177.8-73.8176.7-177.2163.20111.2T93 R94 Y95 K100 K101T93-K97 WeakPolarHBondContact O-CD 3.21Å; T93-K97 WeakPolarHBondContact O-CE 3.13Å; T93-K97 VanDerWaalsContact O-CG 3.25Å; T93-K97 WeakPolarHBondContact O-CG 3.2Å; T93-K97 PolarHBondContact O-NZ 3.38Å; R94-K97 PolarHBondContact O-N 2.87Å; Y95-K97 PolarHBondContact O-N 3.36Å; K97-K100 PolarHBondContact O-N 2.97Å; K97-K101 PolarHBondContact O-N 3.01Å
98V79.7Confident73.3Confident18 Ų1880.6 Ų80.611%0.10938%0.383CS..Hα-helixtrans-71.2-40.2175.7-174.40000110.4A66 R94 Y95 E96 K100 K101 I102A66-V98 HydrophobicContact CB-CB 4.1Å; A66-V98 HydrophobicContact CB-CG1 3.61Å; R94-V98 PolarHBondContact O-N 3.07Å; Y95-V98 PolarHBondContact O-N 3.05Å; E96-V98 VanDerWaalsContact C-N 3.33Å; V98-K100 VanDerWaalsContact C-N 3.33Å; V98-K100 PolarHBondContact O-N 3.38Å; V98-K101 WeakPolarHBondContact O-CA 3.03Å; V98-K101 VanDerWaalsContact O-CB 3.31Å; V98-K101 WeakPolarHBondContact O-CB 3.43Å; V98-K101 PolarHBondContact O-N 2.91Å; V98-K101 VanDerWaalsContact O-N 3.09Å; V98-I102 HydrophobicContact CG1-CD1 4.28Å; V98-I102 WeakPolarHBondContact O-CG1 3.38Å; V98-I102 PolarHBondContact O-N 3.2Å
99L82.5Confident75.4Confident26 Ų2674.1 Ų74.114%0.13636%0.355CS..Hα-helixtrans-60-42172.7-65.5179.1000112Y63 Y95 E96 K101 I102 A103 I125Y63-L99 HydrophobicContact CE1-CD2 4.24Å; Y95-L99 HydrophobicContact CD1-CD1 3.52Å; Y95-L99 HydrophobicContact CD1-CD2 4.37Å; Y95-L99 HydrophobicContact CD1-CG 3.88Å; Y95-L99 HydrophobicContact CE1-CD1 3.44Å; Y95-L99 VanDerWaalsContact CE1-CD1 3.44Å; Y95-L99 HydrophobicContact CE1-CD2 3.75Å; Y95-L99 HydrophobicContact CE1-CG 3.76Å; Y95-L99 HydrophobicContact CG-CG 4.49Å; Y95-L99 WeakPolarHBondContact O-CG 3.41Å; Y95-L99 PolarHBondContact O-N 3.23Å; E96-L99 PolarHBondContact O-N 3.49Å; L99-K101 VanDerWaalsContact C-N 3.31Å; L99-K101 PolarHBondContact O-N 3.3Å; L99-I102 HydrophobicContact CD2-CD1 4.45Å; L99-I102 WeakPolarHBondContact O-CB 3.35Å; L99-I102 PolarHBondContact O-N 2.95Å; L99-I102 VanDerWaalsContact O-N 3.15Å; L99-A103 WeakPolarHBondContact O-CB 3.32Å; L99-A103 PolarHBondContact O-N 3.39Å; L99-I125 HydrophobicContact CB-CD1 3.71Å; L99-I125 HydrophobicContact CD1-CD1 4.01Å; L99-I125 HydrophobicContact CD2-CD1 3.56Å; L99-I125 HydrophobicContact CD2-CG1 4.04Å; L99-I125 HydrophobicContact CG-CD1 3.94Å
100K84.3Confident77.3Confident133 Ų13368.6 Ų68.658%0.57833%0.326SS*.Hα-helixtrans-61.8-37.6173.4-75.9165.7-178.5155.80111.8E96 K97 V98 K104E96-K100 WeakPolarHBondContact O-CB 3.36Å; E96-K100 VanDerWaalsContact O-CG 3.23Å; E96-K100 WeakPolarHBondContact O-CG 3.38Å; E96-K100 PolarHBondContact O-N 3.38Å; E96-K100 IonicContact OE2-NZ 3.11Å; E96-K100 PolarHBondContact OE2-NZ 3.32Å; E96-K100 VanDerWaalsContact OE2-NZ 3.11Å; K97-K100 PolarHBondContact O-N 2.97Å; V98-K100 VanDerWaalsContact C-N 3.33Å; V98-K100 PolarHBondContact O-N 3.38Å; K100-K104 WeakPolarHBondContact O-CB 3.41Å; K100-K104 PolarHBondContact O-N 3.02Å
101K87.8Confident79.2Confident92 Ų9266.9 Ų66.940%0.431%0.309SS..Hα-helixtrans-63.7-41.6173.3-176.6-173.5175.5-167.90111.2F62 E65 K97 V98 L99 K104 Y105F62-K101 HydrophobicContact CE1-CD 4.44Å; E65-K101 IonicContact OE1-NZ 3.28Å; E65-K101 IonicContact OE2-NZ 2.65Å; E65-K101 PolarHBondContact OE2-NZ 3.41Å; K97-K101 PolarHBondContact O-N 3.01Å; V98-K101 WeakPolarHBondContact O-CA 3.03Å; V98-K101 VanDerWaalsContact O-CB 3.31Å; V98-K101 WeakPolarHBondContact O-CB 3.43Å; V98-K101 PolarHBondContact O-N 2.91Å; V98-K101 VanDerWaalsContact O-N 3.09Å; L99-K101 VanDerWaalsContact C-N 3.31Å; L99-K101 PolarHBondContact O-N 3.3Å; K101-K104 PolarHBondContact O-N 2.89Å; K101-Y105 PolarHBondContact O-N 3.2Å
102I90.1Very high81.2Confident0 Ų066.8 Ų66.80%031%0.305CS..Hα-helixtrans-65-49.4176.1-66.5165.1000110.7L59 F62 Y63 V98 L99 K104 Y105 I106L59-I102 HydrophobicContact CD2-CG2 3.84Å; F62-I102 HydrophobicContact CB-CD1 3.9Å; F62-I102 HydrophobicContact CB-CG1 3.57Å; F62-I102 HydrophobicContact CD2-CG1 4.35Å; F62-I102 HydrophobicContact CG-CG1 4.2Å; Y63-I102 HydrophobicContact CD1-CD1 3.74Å; Y63-I102 HydrophobicContact CD2-CD1 4.4Å; Y63-I102 HydrophobicContact CE1-CD1 3.64Å; Y63-I102 HydrophobicContact CE2-CD1 4.28Å; Y63-I102 HydrophobicContact CE2-CG2 4.21Å; Y63-I102 HydrophobicContact CG-CD1 4.13Å; V98-I102 HydrophobicContact CG1-CD1 4.28Å; V98-I102 WeakPolarHBondContact O-CG1 3.38Å; V98-I102 PolarHBondContact O-N 3.2Å; L99-I102 HydrophobicContact CD2-CD1 4.45Å; L99-I102 WeakPolarHBondContact O-CB 3.35Å; L99-I102 PolarHBondContact O-N 2.95Å; L99-I102 VanDerWaalsContact O-N 3.15Å; I102-K104 VanDerWaalsContact C-N 3.27Å; I102-K104 PolarHBondContact O-N 2.87Å; I102-Y105 WeakPolarHBondContact O-CB 3.47Å; I102-Y105 PolarHBondContact O-N 3.38Å; I102-I106 HydrophobicContact CG2-CD1 3.89Å; I102-I106 HydrophobicContact CG2-CG1 4.37Å; I102-I106 WeakPolarHBondContact O-CG1 3.35Å; I102-I106 PolarHBondContact O-N 2.94Å
103A89.6Confident83.1Confident35 Ų3562.5 Ų62.529%0.28929%0.285SS..Hα-helixtrans-55.9-44.1177.100000111.4L99 I106 Q107 D123L99-A103 WeakPolarHBondContact O-CB 3.32Å; L99-A103 PolarHBondContact O-N 3.39Å; A103-I106 PolarHBondContact O-N 2.89Å; A103-Q107 WeakPolarHBondContact O-CB 3.45Å; A103-Q107 PolarHBondContact O-N 3.48Å; A103-D123 WeakPolarHBondContact CB-OD2 3.48Å
104K91Very high84.8Confident128 Ų12859.7 Ų59.756%0.55727%0.268SS*.Hα-helixtrans-62.4-44.2175.1-168.6-174.4-179.6-162.70112.1K100 K101 I102 Q107 E108K100-K104 WeakPolarHBondContact O-CB 3.41Å; K100-K104 PolarHBondContact O-N 3.02Å; K101-K104 PolarHBondContact O-N 2.89Å; I102-K104 VanDerWaalsContact C-N 3.27Å; I102-K104 PolarHBondContact O-N 2.87Å; K104-Q107 PolarHBondContact O-N 3.42Å; K104-E108 WeakPolarHBondContact CE-OE1 3.47Å; K104-E108 IonicContact NZ-OE1 3.7Å; K104-E108 WeakPolarHBondContact O-CG 3.43Å; K104-E108 PolarHBondContact O-N 2.83Å
105Y92.3Very high86.1Confident36 Ų3654 Ų5414%0.14125%0.248CC..Hα-helixtrans-61.2-45.7176.4173.6-100.4000111.9T55 T58 L59 F62 K101 I102 Q107 E108 Q109T55-Y105 HydrophobicContact CG2-CE1 4.26Å; T58-Y105 WeakPolarHBondContact CB-OH 3.37Å; T58-Y105 HydrophobicContact CG2-CE1 4.02Å; T58-Y105 HydrophobicContact CG2-CE2 3.91Å; L59-Y105 HydrophobicContact CD2-CD1 3.81Å; L59-Y105 HydrophobicContact CD2-CE1 4.09Å; L59-Y105 HydrophobicContact CG-CD1 4.36Å; L59-Y105 HydrophobicContact CG-CE1 4.12Å; F62-Y105 HydrophobicContact CD2-CD1 4.35Å; F62-Y105 HydrophobicContact CD2-CG 4.43Å; F62-Y105 AromaticContact CE2-CD1 3.93Å; F62-Y105 HydrophobicContact CE2-CD1 3.93Å; F62-Y105 AromaticContact CE2-CD2 3.93Å; F62-Y105 HydrophobicContact CE2-CD2 3.93Å; F62-Y105 HydrophobicContact CE2-CE1 4.41Å; F62-Y105 HydrophobicContact CE2-CE2 4.41Å; F62-Y105 AromaticContact CE2-CG 3.67Å; F62-Y105 HydrophobicContact CE2-CG 3.67Å; K101-Y105 PolarHBondContact O-N 3.2Å; I102-Y105 WeakPolarHBondContact O-CB 3.47Å; I102-Y105 PolarHBondContact O-N 3.38Å; Y105-Q107 VanDerWaalsContact C-N 3.28Å; Y105-Q107 PolarHBondContact O-N 3.39Å; Y105-E108 PolarHBondContact O-N 2.87Å; Y105-Q109 HydrophobicContact CD1-CG 4.14Å; Y105-Q109 HydrophobicContact CD2-CG 4.27Å; Y105-Q109 HydrophobicContact CE1-CG 3.69Å; Y105-Q109 HydrophobicContact CE2-CG 3.83Å; Y105-Q109 HydrophobicContact CG-CG 4.42Å; Y105-Q109 WeakPolarHBondContact O-CG 3.23Å; Y105-Q109 PolarHBondContact O-N 3.41Å
106I91.6Very high86.9Confident7 Ų754.3 Ų54.34%0.03626%0.261CS..Hα-helixtrans-58.5-43.8176.4-68.5172.9000110.5L59 I102 A103 Q109 N110 I121 D123L59-I106 HydrophobicContact CD2-CD1 4.05Å; L59-I106 HydrophobicContact CD2-CG1 3.76Å; I102-I106 HydrophobicContact CG2-CD1 3.89Å; I102-I106 HydrophobicContact CG2-CG1 4.37Å; I102-I106 WeakPolarHBondContact O-CG1 3.35Å; I102-I106 PolarHBondContact O-N 2.94Å; A103-I106 PolarHBondContact O-N 2.89Å; I106-Q109 PolarHBondContact O-N 3.04Å; I106-N110 WeakPolarHBondContact O-CB 3.28Å; I106-N110 PolarHBondContact O-N 2.81Å; I106-N110 PolarHBondContact O-ND2 3.1Å; I106-I121 HydrophobicContact CG2-CB 3.95Å; I106-I121 HydrophobicContact CG2-CG2 3.7Å; I106-D123 HydrophobicContact CD1-CB 4.4Å
107Q89.9Confident87.6Confident49 Ų4955.9 Ų55.923%0.22926%0.264CS..Hα-helixtrans-61-48.3176.1178.8166.29.200111.9A103 K104 Y105 Q109 N110 E111A103-Q107 WeakPolarHBondContact O-CB 3.45Å; A103-Q107 PolarHBondContact O-N 3.48Å; K104-Q107 PolarHBondContact O-N 3.42Å; Y105-Q107 VanDerWaalsContact C-N 3.28Å; Y105-Q107 PolarHBondContact O-N 3.39Å; Q107-Q109 VanDerWaalsContact C-N 3.31Å; Q107-Q109 PolarHBondContact O-N 3.15Å; Q107-N110 WeakPolarHBondContact O-CB 3.4Å; Q107-N110 PolarHBondContact O-N 3.43Å; Q107-N110 VanDerWaalsContact O-N 3.16Å; Q107-E111 HydrophobicContact CG-CG 4.47Å; Q107-E111 VanDerWaalsContact CG-OE1 3.25Å; Q107-E111 WeakPolarHBondContact CG-OE1 3.38Å; Q107-E111 PolarHBondContact NE2-OE1 3.42Å; Q107-E111 WeakPolarHBondContact O-CG 3.39Å; Q107-E111 PolarHBondContact O-N 3.26Å
108E91.6Very high88.1Confident61 Ų6149.9 Ų49.929%0.28524%0.241SC..Hα-helixtrans-61.8-38.8178.3-73-179.2-159.200112.3K104 Y105 E111 K112K104-E108 WeakPolarHBondContact CE-OE1 3.47Å; K104-E108 IonicContact NZ-OE1 3.7Å; K104-E108 WeakPolarHBondContact O-CG 3.43Å; K104-E108 PolarHBondContact O-N 2.83Å; Y105-E108 PolarHBondContact O-N 2.87Å; E108-E111 PolarHBondContact O-N 3.09Å; E108-K112 WeakPolarHBondContact O-CB 3.46Å; E108-K112 WeakPolarHBondContact O-CG 3.46Å; E108-K112 PolarHBondContact O-N 3.36Å; E108-K112 IonicContact OE2-NZ 3.83Å
109Q90.9Very high88.6Confident26 Ų2649.1 Ų49.112%0.12124%0.236CC..Hα-helixtrans-65.6-43.7174.2-69-57.1-57.700111T55 Y105 I106 Q107 E111 K112 I113 Y114T55-Q109 HydrophobicContact CG2-CG 4.33Å; Y105-Q109 HydrophobicContact CD1-CG 4.14Å; Y105-Q109 HydrophobicContact CD2-CG 4.27Å; Y105-Q109 HydrophobicContact CE1-CG 3.69Å; Y105-Q109 HydrophobicContact CE2-CG 3.83Å; Y105-Q109 HydrophobicContact CG-CG 4.42Å; Y105-Q109 WeakPolarHBondContact O-CG 3.23Å; Y105-Q109 PolarHBondContact O-N 3.41Å; I106-Q109 PolarHBondContact O-N 3.04Å; Q107-Q109 VanDerWaalsContact C-N 3.31Å; Q107-Q109 PolarHBondContact O-N 3.15Å; Q109-E111 VanDerWaalsContact C-N 3.33Å; Q109-E111 PolarHBondContact O-N 3.03Å; Q109-K112 PolarHBondContact O-N 2.91Å; Q109-I113 WeakPolarHBondContact O-CA 3.4Å; Q109-I113 WeakPolarHBondContact O-CB 3.25Å; Q109-I113 PolarHBondContact O-N 3.09Å; Q109-Y114 HydrophobicContact CB-CD2 4.14Å; Q109-Y114 HydrophobicContact CB-CE2 4.11Å; Q109-Y114 WeakPolarHBondContact O-CD2 3.37Å; Q109-Y114 PolarHBondContact O-N 3.38Å; Q109-Y114 VanDerWaalsContact O-N 3.14Å
110N91.2Very high89Confident8 Ų848.2 Ų48.24%0.04323%0.231CC..Iπ-helixtrans-56.9-48.5175.3-80.1-25.9000111.3L8 I106 Q107 Y114 A115 L120 I121L8-N110 HydrophobicContact CD1-CB 4.42Å; L8-N110 HydrophobicContact CD2-CB 4.22Å; I106-N110 WeakPolarHBondContact O-CB 3.28Å; I106-N110 PolarHBondContact O-N 2.81Å; I106-N110 PolarHBondContact O-ND2 3.1Å; Q107-N110 WeakPolarHBondContact O-CB 3.4Å; Q107-N110 PolarHBondContact O-N 3.43Å; Q107-N110 VanDerWaalsContact O-N 3.16Å; N110-Y114 PolarHBondContact O-N 2.9Å; N110-A115 WeakPolarHBondContact O-CA 3.49Å; N110-A115 WeakPolarHBondContact O-CB 3.48Å; N110-A115 PolarHBondContact O-N 2.75Å; N110-L120 HydrophobicContact CB-CD1 4.17Å; N110-I121 PolarHBondContact ND2-O 3.37Å; N110-I121 WeakPolarHBondContact OD1-CB 3.48Å; N110-I121 PolarHBondContact OD1-N 3.11Å
111E87.7Confident89.3Confident51 Ų5142.2 Ų42.224%0.23821%0.206CC..Iπ-helixtrans-67.5-43.5-177.8-69.5169.5-175.700112.7L8 Q107 E108 Q109L8-E111 HydrophobicContact CD1-CG 4.23Å; L8-E111 HydrophobicContact CG-CG 4.43Å; Q107-E111 HydrophobicContact CG-CG 4.47Å; Q107-E111 VanDerWaalsContact CG-OE1 3.25Å; Q107-E111 WeakPolarHBondContact CG-OE1 3.38Å; Q107-E111 PolarHBondContact NE2-OE1 3.42Å; Q107-E111 WeakPolarHBondContact O-CG 3.39Å; Q107-E111 PolarHBondContact O-N 3.26Å; E108-E111 PolarHBondContact O-N 3.09Å; Q109-E111 VanDerWaalsContact C-N 3.33Å; Q109-E111 PolarHBondContact O-N 3.03Å
112K88.1Confident89.4Confident138 Ų13838.4 Ų38.460%0.619%0.19SC*.Iπ-helixtrans-82.5-33.8-173.7-68.5173.4-177.8166.40113.7E108 Q109E108-K112 WeakPolarHBondContact O-CB 3.46Å; E108-K112 WeakPolarHBondContact O-CG 3.46Å; E108-K112 PolarHBondContact O-N 3.36Å; E108-K112 IonicContact OE2-NZ 3.83Å; Q109-K112 PolarHBondContact O-N 2.91Å
113I88.9Confident89.3Confident26 Ų2639.6 Ų39.613%0.13320%0.196CC..Iπ-helixtrans-122.1-55.7-166.4-71.5158.3000111.7I47 L51 Q109 R117I47-I113 HydrophobicContact CD1-CG2 4.03Å; L51-I113 HydrophobicContact CD1-CD1 3.89Å; L51-I113 HydrophobicContact CD2-CB 4.36Å; L51-I113 HydrophobicContact CD2-CD1 4.14Å; L51-I113 HydrophobicContact CD2-CG1 4.13Å; L51-I113 HydrophobicContact CD2-CG2 3.3Å; L51-I113 HydrophobicContact CG-CD1 4.27Å; L51-I113 HydrophobicContact CG-CG2 4.12Å; Q109-I113 WeakPolarHBondContact O-CA 3.4Å; Q109-I113 WeakPolarHBondContact O-CB 3.25Å; Q109-I113 PolarHBondContact O-N 3.09Å; I113-R117 VanDerWaalsContact O-CD 3.23Å; I113-R117 WeakPolarHBondContact O-CD 3.36Å; I113-R117 WeakPolarHBondContact O-CG 3.37Å; I113-R117 PolarHBondContact O-NH1 3.4Å
114Y88.4Confident89.3Confident1 Ų138 Ų380%0.00418%0.183CC..Iπ-helixtrans-81.7-44.1-165.8-67.1-100.9000112.5I47 T55 Q109 N110 R117 G118 L119 I121I47-Y114 HydrophobicContact CD1-CD1 4.04Å; I47-Y114 HydrophobicContact CD1-CE1 3.37Å; I47-Y114 HydrophobicContact CD1-CE2 4.19Å; I47-Y114 VanDerWaalsContact CD1-CZ 3.44Å; T55-Y114 WeakPolarHBondContact CB-OH 3.46Å; T55-Y114 HydrophobicContact CG2-CE2 4.24Å; T55-Y114 PolarHBondContact OG1-OH 3.04Å; Q109-Y114 HydrophobicContact CB-CD2 4.14Å; Q109-Y114 HydrophobicContact CB-CE2 4.11Å; Q109-Y114 WeakPolarHBondContact O-CD2 3.37Å; Q109-Y114 PolarHBondContact O-N 3.38Å; Q109-Y114 VanDerWaalsContact O-N 3.14Å; N110-Y114 PolarHBondContact O-N 2.9Å; Y114-R117 CarbonylContact O-C 3.54Å; Y114-R117 WeakPolarHBondContact O-CA 3.47Å; Y114-R117 WeakPolarHBondContact O-CB 3.38Å; Y114-R117 PolarHBondContact O-N 3.49Å; Y114-G118 PolarHBondContact O-N 2.98Å; Y114-L119 CarbonylContact C-O 3.53Å; Y114-L119 WeakPolarHBondContact CB-O 3.35Å; Y114-L119 HydrophobicContact CD1-CB 3.83Å; Y114-L119 HydrophobicContact CD1-CD1 3.94Å; Y114-L119 HydrophobicContact CG-CB 4.31Å; Y114-L119 WeakPolarHBondContact O-CA 3.41Å; Y114-L119 WeakPolarHBondContact O-CB 3.23Å; Y114-L119 PolarHBondContact O-N 2.99Å; Y114-L119 VanDerWaalsContact O-O 3.07Å; Y114-I121 HydrophobicContact CD1-CD1 4Å; Y114-I121 HydrophobicContact CD1-CG1 3.92Å; Y114-I121 HydrophobicContact CD2-CD1 3.81Å; Y114-I121 HydrophobicContact CD2-CG1 4.35Å; Y114-I121 HydrophobicContact CE1-CD1 3.69Å; Y114-I121 HydrophobicContact CE1-CG1 3.99Å; Y114-I121 HydrophobicContact CE2-CD1 3.52Å; Y114-I121 HydrophobicContact CE2-CG1 4.45Å; Y114-I121 HydrophobicContact CG-CD1 4.07Å; Y114-I121 HydrophobicContact CG-CG1 4.13Å; Y114-I121 VanDerWaalsContact CZ-CD1 3.47Å
115A88.2Confident89Confident5 Ų534.8 Ų34.84%0.04117%0.171CC..G310 helixtrans-60.9-44.9-177.900000113.4L8 L11 N110 R117 G118 L119L8-A115 HydrophobicContact CD2-CB 3.58Å; L11-A115 HydrophobicContact CD1-CB 3.57Å; L11-A115 WeakPolarHBondContact CD1-O 3.43Å; N110-A115 WeakPolarHBondContact O-CA 3.49Å; N110-A115 WeakPolarHBondContact O-CB 3.48Å; N110-A115 PolarHBondContact O-N 2.75Å; A115-R117 PolarHBondContact O-N 3.13Å; A115-G118 PolarHBondContact O-N 3.28Å; A115-L119 WeakPolarHBondContact CA-O 3.46Å; A115-L119 PolarHBondContact N-O 3.32Å
116P84.9Confident88.5Confident95 Ų9539.9 Ų39.962%0.61720%0.196SC*.G310 helixtrans-60.1-19.4173.7-23.734.3000114.2
117R85.4Confident88.2Confident102 Ų10244 Ų4439%0.38521%0.212SC..G310 helixtrans-97.93.9179.1-65.3169170.281.2-0.3112.7R46 I113 Y114 A115 L119R46-R117 VanDerWaalsContact O-CD 3.25Å; R46-R117 WeakPolarHBondContact O-CD 3.34Å; I113-R117 VanDerWaalsContact O-CD 3.23Å; I113-R117 WeakPolarHBondContact O-CD 3.36Å; I113-R117 WeakPolarHBondContact O-CG 3.37Å; I113-R117 PolarHBondContact O-NH1 3.4Å; Y114-R117 CarbonylContact O-C 3.54Å; Y114-R117 WeakPolarHBondContact O-CA 3.47Å; Y114-R117 WeakPolarHBondContact O-CB 3.38Å; Y114-R117 PolarHBondContact O-N 3.49Å; A115-R117 PolarHBondContact O-N 3.13Å; R117-L119 VanDerWaalsContact C-N 3.3Å; R117-L119 HydrophobicContact CB-CD1 4.38Å; R117-L119 HydrophobicContact CB-CG 4.32Å
118G86.4Confident87.9Confident11 Ų1144 Ų4411%0.11323%0.225CC..THydrogen-bonded Turntrans72.322.9-174.800000113.2Y114 A115 Y137Y114-G118 PolarHBondContact O-N 2.98Å; A115-G118 PolarHBondContact O-N 3.28Å; G118-Y137 PolarHBondContact O-N 3.23Å
119L89.1Confident87.5Confident1 Ų142.7 Ų42.71%0.00522%0.219CC..EExtended strand (participates in β ladder)trans-110.1147.4179.2-58.7177.1000110.2L43 R46 I47 Y114 A115 R117 I134 S135 I136L43-L119 HydrophobicContact CD2-CD1 4.22Å; L43-L119 HydrophobicContact CD2-CD2 3.79Å; R46-L119 HydrophobicContact CB-CD1 4Å; R46-L119 HydrophobicContact CB-CD2 4.27Å; R46-L119 HydrophobicContact CB-CG 4.34Å; I47-L119 HydrophobicContact CB-CD1 4.1Å; I47-L119 HydrophobicContact CG2-CD1 4.2Å; Y114-L119 CarbonylContact C-O 3.53Å; Y114-L119 WeakPolarHBondContact CB-O 3.35Å; Y114-L119 HydrophobicContact CD1-CB 3.83Å; Y114-L119 HydrophobicContact CD1-CD1 3.94Å; Y114-L119 HydrophobicContact CG-CB 4.31Å; Y114-L119 WeakPolarHBondContact O-CA 3.41Å; Y114-L119 WeakPolarHBondContact O-CB 3.23Å; Y114-L119 PolarHBondContact O-N 2.99Å; Y114-L119 VanDerWaalsContact O-O 3.07Å; A115-L119 WeakPolarHBondContact CA-O 3.46Å; A115-L119 PolarHBondContact N-O 3.32Å; R117-L119 VanDerWaalsContact C-N 3.3Å; R117-L119 HydrophobicContact CB-CD1 4.38Å; R117-L119 HydrophobicContact CB-CG 4.32Å; L119-I134 HydrophobicContact CB-CG2 4.35Å; L119-I134 HydrophobicContact CD2-CG2 4.35Å; L119-S135 CarbonylContact C-O 3.53Å; L119-S135 WeakPolarHBondContact CA-O 3.01Å; L119-I136 HydrophobicContact CD2-CB 4.31Å; L119-I136 HydrophobicContact CD2-CG1 3.66Å; L119-I136 HydrophobicContact CD2-CG2 4.35Å
120L91Very high87.2Confident8 Ų849.6 Ų49.64%0.04224%0.244CC..EExtended strand (participates in β ladder)trans-140.8116.2174.2-170.674000110.8L8 R12 N110 I134 S135 Y137L8-L120 HydrophobicContact CD1-CD1 4.48Å; L8-L120 HydrophobicContact CD2-CD1 3.77Å; R12-L120 HydrophobicContact CG-CD2 4.44Å; R12-L120 VanDerWaalsContact NE-CD2 3.35Å; N110-L120 HydrophobicContact CB-CD1 4.17Å; L120-I134 WeakPolarHBondContact O-CA 3.42Å; L120-S135 PolarHBondContact N-O 3.22Å; L120-S135 PolarHBondContact O-N 3.38Å; L120-Y137 HydrophobicContact CB-CD2 4.37Å; L120-Y137 HydrophobicContact CB-CE2 3.79Å; L120-Y137 HydrophobicContact CD2-CE2 4.14Å
121I91.7Very high87.2Confident7 Ų750.7 Ų50.74%0.03625%0.25CS..EExtended strand (participates in β ladder)trans-76.7127.3169.6-58.7176.2000108.7T55 I106 N110 Y114 I132 I134T55-I121 HydrophobicContact CG2-CD1 4.11Å; I106-I121 HydrophobicContact CG2-CB 3.95Å; I106-I121 HydrophobicContact CG2-CG2 3.7Å; N110-I121 PolarHBondContact ND2-O 3.37Å; N110-I121 WeakPolarHBondContact OD1-CB 3.48Å; N110-I121 PolarHBondContact OD1-N 3.11Å; Y114-I121 HydrophobicContact CD1-CD1 4Å; Y114-I121 HydrophobicContact CD1-CG1 3.92Å; Y114-I121 HydrophobicContact CD2-CD1 3.81Å; Y114-I121 HydrophobicContact CD2-CG1 4.35Å; Y114-I121 HydrophobicContact CE1-CD1 3.69Å; Y114-I121 HydrophobicContact CE1-CG1 3.99Å; Y114-I121 HydrophobicContact CE2-CD1 3.52Å; Y114-I121 HydrophobicContact CE2-CG1 4.45Å; Y114-I121 HydrophobicContact CG-CD1 4.07Å; Y114-I121 HydrophobicContact CG-CG1 4.13Å; Y114-I121 VanDerWaalsContact CZ-CD1 3.47Å; I121-I132 HydrophobicContact CG2-CG2 3.82Å; I121-I134 HydrophobicContact CG1-CD1 4.39Å; I121-I134 HydrophobicContact CG1-CG1 4.21Å
122T89.9Confident87.3Confident12 Ų1248.4 Ų48.47%0.07424%0.24CC..EExtended strand (participates in β ladder)trans-93.6140.3169.4-53.60000109.3P124 E126 E133T122-P124 WeakPolarHBondContact O-CD 3.47Å; T122-E126 HydrophobicContact CG2-CB 4.47Å; T122-E126 WeakPolarHBondContact CG2-OE2 3.4Å; T122-E133 PolarHBondContact N-O 2.86Å
123D88.3Confident87.5Confident24 Ų2442 Ų4213%0.12821%0.212CC..PPolyproline II helixtrans-57.3124.4178.8-168.2-33.5000110.3A103 I106 I125 E126A103-D123 WeakPolarHBondContact CB-OD2 3.48Å; I106-D123 HydrophobicContact CD1-CB 4.4Å; D123-I125 PolarHBondContact O-N 2.9Å; D123-I125 VanDerWaalsContact O-N 3.1Å; D123-I125 WeakPolarHBondContact OD1-CB 3.37Å; D123-I125 WeakPolarHBondContact OD1-CD1 3.05Å; D123-I125 VanDerWaalsContact OD1-CG1 3.23Å; D123-I125 WeakPolarHBondContact OD1-CG1 3.21Å; D123-I125 PolarHBondContact OD1-N 3.22Å; D123-E126 HydrophobicContact CB-CG 4.39Å; D123-E126 WeakPolarHBondContact O-CB 3.22Å; D123-E126 PolarHBondContact O-N 2.78Å; D123-E126 VanDerWaalsContact O-N 3.09Å
124P87.9Confident87.6Confident1 Ų140.9 Ų40.91%0.00621%0.206CC..G310 helixtrans-56.2-26.3177.7-27.236.8000113.7F35 T122 E126 R127 G128 M129 I132F35-P124 HydrophobicContact CE1-CB 4.28Å; F35-P124 HydrophobicContact CE2-CB 4.29Å; F35-P124 HydrophobicContact CE2-CG 4.23Å; F35-P124 HydrophobicContact CZ-CB 3.59Å; F35-P124 HydrophobicContact CZ-CG 3.93Å; T122-P124 WeakPolarHBondContact O-CD 3.47Å; P124-E126 VanDerWaalsContact C-N 3.29Å; P124-E126 PolarHBondContact O-N 3.12Å; P124-R127 CarbonylContact O-C 3.35Å; P124-R127 WeakPolarHBondContact O-CA 3.49Å; P124-R127 PolarHBondContact O-N 3.25Å; P124-G128 PolarHBondContact O-N 3.07Å; P124-M129 VanDerWaalsContact O-CA 3.26Å; P124-M129 WeakPolarHBondContact O-CA 3.31Å; P124-M129 PolarHBondContact O-N 3.26Å; P124-I132 HydrophobicContact CG-CB 4.45Å; P124-I132 HydrophobicContact CG-CG1 3.77Å
125I85.5Confident87.7Confident62 Ų6241 Ų4132%0.31821%0.207SC..G310 helixtrans-60.2-40.5177.9-61.5164.1000110.9L99 D123 R127 G128 M129L99-I125 HydrophobicContact CB-CD1 3.71Å; L99-I125 HydrophobicContact CD1-CD1 4.01Å; L99-I125 HydrophobicContact CD2-CD1 3.56Å; L99-I125 HydrophobicContact CD2-CG1 4.04Å; L99-I125 HydrophobicContact CG-CD1 3.94Å; D123-I125 PolarHBondContact O-N 2.9Å; D123-I125 VanDerWaalsContact O-N 3.1Å; D123-I125 WeakPolarHBondContact OD1-CB 3.37Å; D123-I125 WeakPolarHBondContact OD1-CD1 3.05Å; D123-I125 VanDerWaalsContact OD1-CG1 3.23Å; D123-I125 WeakPolarHBondContact OD1-CG1 3.21Å; D123-I125 PolarHBondContact OD1-N 3.22Å; I125-R127 PolarHBondContact O-N 3.24Å; I125-G128 PolarHBondContact O-N 3.23Å; I125-M129 HydrophobicContact CG1-CG 4.34Å
126E82.9Confident87.8Confident143 Ų14341.2 Ų41.267%0.66821%0.208SC*.G310 helixtrans-62-18.1176.4-64.5-176.1-166.500112.2T122 D123 P124T122-E126 HydrophobicContact CG2-CB 4.47Å; T122-E126 WeakPolarHBondContact CG2-OE2 3.4Å; D123-E126 HydrophobicContact CB-CG 4.39Å; D123-E126 WeakPolarHBondContact O-CB 3.22Å; D123-E126 PolarHBondContact O-N 2.78Å; D123-E126 VanDerWaalsContact O-N 3.09Å; P124-E126 VanDerWaalsContact C-N 3.29Å; P124-E126 PolarHBondContact O-N 3.12Å
127R84.5Confident87.9Confident94 Ų9437.9 Ų37.936%0.35518%0.183SC..G310 helixtrans-108.820.3176.8-58.5-54.2179.394.15.3113.4P124 I125 M129 R130 V131 E133P124-R127 CarbonylContact O-C 3.35Å; P124-R127 WeakPolarHBondContact O-CA 3.49Å; P124-R127 PolarHBondContact O-N 3.25Å; I125-R127 PolarHBondContact O-N 3.24Å; R127-M129 PolarHBondContact O-N 3.4Å; R127-R130 PolarHBondContact O-N 3.27Å; R127-V131 HydrophobicContact CB-CG2 3.88Å; R127-V131 HydrophobicContact CG-CG2 4.26Å; R127-E133 IonicContact CZ-OE1 3.43Å; R127-E133 IonicContact CZ-OE2 3.01Å; R127-E133 IonicContact NH1-OE2 3.47Å; R127-E133 PolarHBondContact NH1-OE2 2.97Å; R127-E133 IonicContact NH2-OE1 3.56Å; R127-E133 PolarHBondContact NH2-OE1 2.87Å; R127-E133 IonicContact NH2-OE2 2.79Å; R127-E133 PolarHBondContact NH2-OE2 3.11Å
128G83.6Confident87.8Confident49 Ų4937.5 Ų37.551%0.50519%0.185SC..THydrogen-bonded Turntrans63.526.4-179.900000113.1P124 I125 R130P124-G128 PolarHBondContact O-N 3.07Å; I125-G128 PolarHBondContact O-N 3.23Å; G128-R130 PolarHBondContact O-N 3.32Å; G128-R130 VanDerWaalsContact O-N 3.17Å
129M83.6Confident87.2Confident32 Ų3242 Ų4216%0.15821%0.207CC..THydrogen-bonded Turntrans60.521.3178.7-54.8167.654.300114.5R25 C33 Y63 Y95 P124 I125 R127R25-M129 WeakPolarHBondContact CD-O 3.37Å; C33-M129 HydrophobicContact CB-CE 3.47Å; C33-M129 VanDerWaalsContact CB-CE 3.47Å; C33-M129 WeakPolarHBondContact SG-CE 3.33Å; Y63-M129 HydrophobicContact CD1-CE 4.01Å; Y63-M129 HydrophobicContact CE1-CE 3.91Å; Y95-M129 WeakPolarHBondContact OH-CE 3.47Å; P124-M129 VanDerWaalsContact O-CA 3.26Å; P124-M129 WeakPolarHBondContact O-CA 3.31Å; P124-M129 PolarHBondContact O-N 3.26Å; I125-M129 HydrophobicContact CG1-CG 4.34Å; R127-M129 PolarHBondContact O-N 3.4Å
130R85.1Confident85.9Confident172 Ų17250.5 Ų50.565%0.64924%0.239SC*.SBendtrans-87.6-27.4-179.2-61.4-175.7-175.6-175.60.4112.7R25 R127 G128R25-R130 VanDerWaalsContact CB-O 3.27Å; R25-R130 WeakPolarHBondContact CB-O 2.97Å; R25-R130 PolarHBondContact N-O 2.97Å; R127-R130 PolarHBondContact O-N 3.27Å; G128-R130 PolarHBondContact O-N 3.32Å; G128-R130 VanDerWaalsContact O-N 3.17Å
131V89.7Confident84.2Confident30 Ų3052.9 Ų52.918%0.18227%0.265CS..EExtended strand (participates in β ladder)trans-147.6150.8-176-62.20000110.8F22 I23 R127F22-V131 HydrophobicContact CD1-CG2 4.14Å; I23-V131 CarbonylContact O-C 3.54Å; I23-V131 WeakPolarHBondContact O-CA 3.17Å; R127-V131 HydrophobicContact CB-CG2 3.88Å; R127-V131 HydrophobicContact CG-CG2 4.26Å
132I91.2Very high82.4Confident3 Ų357 Ų572%0.01530%0.295CS..EExtended strand (participates in β ladder)trans-91.4122.7158-55.2165.5000106.5F22 I23 F35 V56 L59 I121 P124 I134F22-I132 WeakPolarHBondContact CA-O 3.37Å; I23-I132 HydrophobicContact CB-CB 4.11Å; I23-I132 HydrophobicContact CD1-CB 4.35Å; I23-I132 PolarHBondContact N-O 2.79Å; I23-I132 PolarHBondContact O-N 2.87Å; F35-I132 HydrophobicContact CB-CD1 3.67Å; F35-I132 HydrophobicContact CB-CG1 4.32Å; F35-I132 HydrophobicContact CD1-CD1 3.95Å; F35-I132 HydrophobicContact CD1-CG1 3.62Å; F35-I132 HydrophobicContact CD2-CD1 3.71Å; F35-I132 HydrophobicContact CD2-CG1 3.94Å; F35-I132 HydrophobicContact CE1-CG1 3.84Å; F35-I132 HydrophobicContact CE2-CD1 4.36Å; F35-I132 HydrophobicContact CE2-CG1 4.15Å; F35-I132 HydrophobicContact CG-CD1 3.48Å; F35-I132 VanDerWaalsContact CG-CD1 3.48Å; F35-I132 HydrophobicContact CG-CG1 3.67Å; F35-I132 HydrophobicContact CZ-CG1 4.1Å; V56-I132 HydrophobicContact CG2-CD1 4.46Å; L59-I132 HydrophobicContact CD1-CD1 4.1Å; I121-I132 HydrophobicContact CG2-CG2 3.82Å; P124-I132 HydrophobicContact CG-CB 4.45Å; P124-I132 HydrophobicContact CG-CG1 3.77Å; I132-I134 HydrophobicContact CG2-CG1 4.29Å
133E91.6Very high80.5Confident4 Ų461.9 Ų61.92%0.01933%0.329CS..EExtended strand (participates in β ladder)trans-95.3127.5172.1170.1168.9132.500109.8K20 F22 T122 R127 S135K20-E133 WeakPolarHBondContact CE-OE1 3.44Å; K20-E133 IonicContact NZ-OE1 3.84Å; K20-E133 PolarHBondContact NZ-OE1 3.08Å; K20-E133 IonicContact NZ-OE2 2.67Å; F22-E133 HydrophobicContact CD1-CB 4.21Å; F22-E133 HydrophobicContact CE1-CB 4.12Å; F22-E133 HydrophobicContact CE1-CG 4.08Å; F22-E133 WeakPolarHBondContact CE1-OE2 3.36Å; T122-E133 PolarHBondContact N-O 2.86Å; R127-E133 IonicContact CZ-OE1 3.43Å; R127-E133 IonicContact CZ-OE2 3.01Å; R127-E133 IonicContact NH1-OE2 3.47Å; R127-E133 PolarHBondContact NH1-OE2 2.97Å; R127-E133 IonicContact NH2-OE1 3.56Å; R127-E133 PolarHBondContact NH2-OE1 2.87Å; R127-E133 IonicContact NH2-OE2 2.79Å; R127-E133 PolarHBondContact NH2-OE2 3.11Å; E133-S135 PolarHBondContact OE1-OG 3.37Å
134I91.5Very high78.9Confident2 Ų264.2 Ų64.21%0.0136%0.359CS..EExtended strand (participates in β ladder)trans-115113.3170.9-54.2-174.4000107.7K20 V21 I23 L43 F52 L119 L120 I121 I132K20-I134 WeakPolarHBondContact CA-O 3.38Å; V21-I134 HydrophobicContact CB-CB 4.45Å; V21-I134 PolarHBondContact N-O 3.5Å; V21-I134 PolarHBondContact O-N 2.82Å; I23-I134 HydrophobicContact CD1-CD1 3.69Å; I23-I134 HydrophobicContact CD1-CG1 3.85Å; L43-I134 HydrophobicContact CD1-CD1 3.76Å; L43-I134 HydrophobicContact CD1-CG2 4.49Å; L43-I134 HydrophobicContact CD2-CG2 4.14Å; F52-I134 HydrophobicContact CD2-CD1 4.36Å; F52-I134 HydrophobicContact CE2-CD1 3.91Å; L119-I134 HydrophobicContact CB-CG2 4.35Å; L119-I134 HydrophobicContact CD2-CG2 4.35Å; L120-I134 WeakPolarHBondContact O-CA 3.42Å; I121-I134 HydrophobicContact CG1-CD1 4.39Å; I121-I134 HydrophobicContact CG1-CG1 4.21Å; I132-I134 HydrophobicContact CG2-CG1 4.29Å
135S90.6Very high77.1Confident3 Ų369.3 Ų69.32%0.02140%0.395CS..EExtended strand (participates in β ladder)trans-88.1133.9175-67.20000110.2L119 L120 E133L119-S135 CarbonylContact C-O 3.53Å; L119-S135 WeakPolarHBondContact CA-O 3.01Å; L120-S135 PolarHBondContact N-O 3.22Å; L120-S135 PolarHBondContact O-N 3.38Å; E133-S135 PolarHBondContact OE1-OG 3.37Å
136I90.2Very high75.5Confident11 Ų1171.7 Ų71.76%0.05642%0.417CS..EExtended strand (participates in β ladder)trans-104.8123.6176.4-57168.2000107.5A18 N19 V21 E42 L43 L119A18-I136 PolarHBondContact N-O 2.92Å; N19-I136 HydrophobicContact CB-CB 4.4Å; N19-I136 HydrophobicContact CB-CD1 4.11Å; N19-I136 PolarHBondContact N-O 2.87Å; N19-I136 PolarHBondContact O-N 2.86Å; V21-I136 HydrophobicContact CG2-CD1 3.88Å; E42-I136 HydrophobicContact CB-CD1 4.41Å; L43-I136 HydrophobicContact CD2-CD1 4.13Å; L43-I136 HydrophobicContact CD2-CG1 4.31Å; L119-I136 HydrophobicContact CD2-CB 4.31Å; L119-I136 HydrophobicContact CD2-CG1 3.66Å; L119-I136 HydrophobicContact CD2-CG2 4.35Å
137Y86.6Confident73.8Confident25 Ų2571 Ų7110%0.09843%0.428CS..EExtended strand (participates in β ladder)trans-108.7138.5179.1-69.6-90.4000110.3L11 R12 A15 S16 L17 G118 L120L11-Y137 HydrophobicContact CD2-CG 4.42Å; R12-Y137 HydrophobicContact CG-CE1 4.34Å; A15-Y137 HydrophobicContact CB-CD1 4.15Å; A15-Y137 HydrophobicContact CB-CG 4.39Å; S16-Y137 WeakPolarHBondContact O-CA 3.47Å; L17-Y137 HydrophobicContact CB-CD1 4.45Å; L17-Y137 HydrophobicContact CB-CE1 4.18Å; L17-Y137 HydrophobicContact CD1-CE1 4.31Å; G118-Y137 PolarHBondContact O-N 3.23Å; L120-Y137 HydrophobicContact CB-CD2 4.37Å; L120-Y137 HydrophobicContact CB-CE2 3.79Å; L120-Y137 HydrophobicContact CD2-CE2 4.14Å
138E82.7Confident72Confident93 Ų9370 Ų7044%0.43545%0.447SS..EExtended strand (participates in β ladder)trans-121.8140173.9-71.1-174.7162.500110.2A15 S16 A18 R46 R140A15-E138 CarbonylContact C-O 3.52Å; A15-E138 WeakPolarHBondContact CA-O 3.18Å; A15-E138 WeakPolarHBondContact CB-O 3.07Å; S16-E138 PolarHBondContact N-O 2.86Å; S16-E138 PolarHBondContact O-N 3.39Å; S16-E138 PolarHBondContact OG-O 3Å; A18-E138 HydrophobicContact CB-CB 4.06Å; A18-E138 HydrophobicContact CB-CG 3.56Å; R46-E138 IonicContact NH2-OE1 2.66Å; R46-E138 PolarHBondContact NH2-OE1 3Å; E138-R140 PolarHBondContact O-N 3.41Å
139D74.4Confident70.3Confident105 Ų10573.8 Ų73.856%0.56147%0.465SS*.EExtended strand (participates in β ladder)trans-62.9130177.4-172.2-90.1000110G141 S142D139-G141 PolarHBondContact O-N 3.21Å; D139-G141 WeakPolarHBondContact OD1-CA 3.25Å; D139-G141 PolarHBondContact OD1-N 2.87Å; D139-S142 PolarHBondContact O-N 3.45Å
140R62.4Low68.7Low181 Ų18177.6 Ų77.668%0.68350%0.495SS*.THydrogen-bonded Turntrans-61.7-4.1-178.2-82.5169.384.9-166.35.3113.6E138E138-R140 PolarHBondContact O-N 3.41Å
141G55.5Low67.1Low57 Ų5775 Ų7559%0.58850%0.503SS*.THydrogen-bonded Turntrans-84.5-8.9177.700000116.6D139D139-G141 PolarHBondContact O-N 3.21Å; D139-G141 WeakPolarHBondContact OD1-CA 3.25Å; D139-G141 PolarHBondContact OD1-N 2.87Å
142S52.1Low65.2Low94 Ų9480.2 Ų80.266%0.65754%0.535SS*.SBendtrans-98.5-12.4-170.4-59.80000115.9D139 G144D139-S142 PolarHBondContact O-N 3.45Å; S142-G144 PolarHBondContact O-N 3.41Å
143S51.6Low63.3Low114 Ų11485.9 Ų85.980%0.79758%0.575SS**THydrogen-bonded Turntrans-97.848.6-178.645.70000113.3
144G53.1Low61.1Low74 Ų7489.2 Ų89.276%0.76361%0.611SS**THydrogen-bonded Turntrans-152.45.8-17900000118S142S142-G144 PolarHBondContact O-N 3.41Å
145S50.3Low59.2Low108 Ų10894.8 Ų94.876%0.75565%0.65SS**  trans-115.369.4-178.842.40000112.4
146S51.9Low57.2Low112 Ų112101.6 Ų101.678%0.78369%0.692SS**  trans-157.187.4154.545.40000111.8
147S46.9Very low55.1Low129 Ų129105.3 Ų105.390%0.90272%0.724SS**SBend167.3123.7128.956.20000111.5
148G46.9Very low52.9Low73 Ų73119.6 Ų119.675%0.75378%0.778SS**  trans116.353.7147.300000117.7S150G148-S150 PolarHBondContact O-N 3.23Å; G148-S150 VanDerWaalsContact O-N 3.17Å
149S48Very low51.4Low127 Ų127121 Ų12189%0.88880%0.795SS**  trans-59.5110.9150.453.20000109.4
150S50Low50.2Low112 Ų112121.8 Ų121.878%0.78381%0.807SS**  trans-144.289.8152.855.50000109.4G148 V152G148-S150 PolarHBondContact O-N 3.23Å; G148-S150 VanDerWaalsContact O-N 3.17Å; S150-V152 PolarHBondContact O-N 3.1Å
151S51.2Low49.5Very low117 Ų117118.5 Ų118.582%0.81881%0.814SS**  trans-64.3115.815747.70000108.6
152V51Low49.1Very low141 Ų141122.1 Ų122.186%0.85583%0.827SS**  trans-128.699.4153.389.10000108.7S150S150-V152 PolarHBondContact O-N 3.1Å
153S51.5Low49Very low121 Ų121123.9 Ų123.985%0.84684%0.838SS**  trans-77.7123161.6-61.80000107.2
154G45.2Very low48.8Very low75 Ų75124.5 Ų124.577%0.77384%0.841SS**  trans-143.379.5-178.400000111.6
155S50.6Low48.5Very low118 Ų118128.1 Ų128.183%0.82585%0.846SS**  trans-3.6131.9161.6-48.50000120.9
156T49.8Very low48.3Very low147 Ų147129.7 Ų129.790%0.90285%0.853SS**  trans-50.7131.4151.3-44.20000112.1
157A45.2Very low48.1Very low89 Ų89131.2 Ų131.274%0.73686%0.859SS**  trans167.2108.3137.400000111.8
158R40.4Very low48.2Very low325 Ų325131.4 Ų131.4100%1.22686%0.855SS**  158.10125.9-87.1-177.7175.7-158.1-1.4111

Retrieved 158 of 158 residues in 139.5 ms (Link to these results)

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