A0A087XXU7_POEFO Loading...

ADP-ribosylation factor-like 10

AlphaFold DB , UniProt , Accession A0A087XXU7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 223 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
1M61.1Low75.3Confident215 Ų215120.5 Ų120.5100%1.05963%0.627SS**  0-29.70-76.1176.6117.300114.4
2V68.5Low75.7Confident103 Ų103117.8 Ų117.862%0.62462%0.62SS**Hα-helixtrans-68.3-39.8-179.31790000113.3L4 R5 H6V2-L4 PolarHBondContact O-N 3.14Å; V2-R5 WeakPolarHBondContact O-CB 3.4Å; V2-R5 PolarHBondContact O-N 3.34Å; V2-H6 WeakPolarHBondContact CG1-NE2 3.43Å; V2-H6 PolarHBondContact O-CD2 3.46Å; V2-H6 PolarHBondContact O-N 3.37Å
3L70.1Confident76.6Confident133 Ų133113.2 Ų113.270%0.69661%0.609SS**Hα-helixtrans-62.2-42.3-178-149.884.5000113.4R5 H6 I7L3-R5 VanDerWaalsContact C-N 3.28Å; L3-R5 PolarHBondContact O-N 3.17Å; L3-H6 PolarHBondContact O-N 2.98Å; L3-I7 HydrophobicContact CG-CD1 4.48Å; L3-I7 WeakPolarHBondContact O-CG1 3.38Å; L3-I7 PolarHBondContact O-N 2.95Å; L3-I7 VanDerWaalsContact O-N 3.14Å
4L70.9Confident77.4Confident136 Ų136108.6 Ų108.671%0.71260%0.595SS**Hα-helixtrans-63.6-33.4176.8-89.1106000112.5V2 I7 S8V2-L4 PolarHBondContact O-N 3.14Å; L4-I7 PolarHBondContact O-N 3.28Å; L4-S8 WeakPolarHBondContact O-CB 3.41Å; L4-S8 PolarHBondContact O-N 3.43Å
5R72.5Confident78.3Confident187 Ų187107.8 Ų107.871%0.70659%0.594SS**Hα-helixtrans-68.4-40.6179.2-165.9175.2177.1-176-1.5111.2V2 L3 S8 I9V2-R5 WeakPolarHBondContact O-CB 3.4Å; V2-R5 PolarHBondContact O-N 3.34Å; L3-R5 VanDerWaalsContact C-N 3.28Å; L3-R5 PolarHBondContact O-N 3.17Å; R5-S8 PolarHBondContact O-N 3.47Å; R5-I9 HydrophobicContact CG-CD1 4.14Å; R5-I9 WeakPolarHBondContact O-CD1 3.38Å; R5-I9 WeakPolarHBondContact O-CG1 3.44Å; R5-I9 PolarHBondContact O-N 3.06Å
6H79Confident79Confident120 Ų120104.7 Ų104.756%0.55659%0.587SS**Hα-helixtrans-67.8-38.5175.5-68.8-66.5000112.7V2 L3 I9 A10V2-H6 WeakPolarHBondContact CG1-NE2 3.43Å; V2-H6 PolarHBondContact O-CD2 3.46Å; V2-H6 PolarHBondContact O-N 3.37Å; L3-H6 PolarHBondContact O-N 2.98Å; H6-I9 PolarHBondContact O-N 3.31Å; H6-A10 WeakPolarHBondContact O-CB 3.22Å; H6-A10 PolarHBondContact O-N 3.02Å
7I80.6Confident79.7Confident96 Ų96102.1 Ų102.149%0.49258%0.582SS.*Hα-helixtrans-64.9-43.5176.1-64.8164.2000110.5L3 L4 A10 L11L3-I7 HydrophobicContact CG-CD1 4.48Å; L3-I7 WeakPolarHBondContact O-CG1 3.38Å; L3-I7 PolarHBondContact O-N 2.95Å; L3-I7 VanDerWaalsContact O-N 3.14Å; L4-I7 PolarHBondContact O-N 3.28Å; I7-A10 PolarHBondContact O-N 3.46Å; I7-L11 HydrophobicContact CG2-CD1 4.46Å; I7-L11 WeakPolarHBondContact O-CB 3.46Å; I7-L11 PolarHBondContact O-N 2.93Å
8S78.3Confident80.3Confident70 Ų70103.4 Ų103.449%0.4959%0.586SS.*Hα-helixtrans-63.9-40.5178-179.40000112.8L4 R5 L11 T12L4-S8 WeakPolarHBondContact O-CB 3.41Å; L4-S8 PolarHBondContact O-N 3.43Å; R5-S8 PolarHBondContact O-N 3.47Å; S8-L11 PolarHBondContact O-N 3.05Å; S8-T12 WeakPolarHBondContact O-CG2 3.36Å; S8-T12 PolarHBondContact O-N 3.43Å; S8-T12 PolarHBondContact O-OG1 3.14Å
9I81.8Confident80.7Confident94 Ų94100.2 Ų100.248%0.48258%0.578SS.*Hα-helixtrans-66.4-41.4175.2-66.4164.2000110.9R5 H6 L11 T12 A13R5-I9 HydrophobicContact CG-CD1 4.14Å; R5-I9 WeakPolarHBondContact O-CD1 3.38Å; R5-I9 WeakPolarHBondContact O-CG1 3.44Å; R5-I9 PolarHBondContact O-N 3.06Å; H6-I9 PolarHBondContact O-N 3.31Å; I9-L11 VanDerWaalsContact C-N 3.34Å; I9-L11 PolarHBondContact O-N 2.96Å; I9-T12 WeakPolarHBondContact CA-OG1 3.34Å; I9-T12 PolarHBondContact O-OG1 2.78Å; I9-A13 WeakPolarHBondContact O-CB 3.44Å; I9-A13 PolarHBondContact O-N 3.47Å
10A83.3Confident81.1Confident61 Ų6198.6 Ų98.650%0.50457%0.573SS.*Hα-helixtrans-64-39.7176.900000112.1H6 I7 A14H6-A10 WeakPolarHBondContact O-CB 3.22Å; H6-A10 PolarHBondContact O-N 3.02Å; I7-A10 PolarHBondContact O-N 3.46Å; A10-A14 WeakPolarHBondContact O-CB 3.43Å; A10-A14 PolarHBondContact O-N 3.39Å
11L82.1Confident81.6Confident110 Ų11096.7 Ų96.758%0.57657%0.569SS**Hα-helixtrans-68.1-43.1179.8-129.5138.6000112I7 S8 I9 A14 V15I7-L11 HydrophobicContact CG2-CD1 4.46Å; I7-L11 WeakPolarHBondContact O-CB 3.46Å; I7-L11 PolarHBondContact O-N 2.93Å; S8-L11 PolarHBondContact O-N 3.05Å; I9-L11 VanDerWaalsContact C-N 3.34Å; I9-L11 PolarHBondContact O-N 2.96Å; L11-A14 PolarHBondContact O-N 2.98Å; L11-V15 WeakPolarHBondContact O-CG2 3.23Å; L11-V15 PolarHBondContact O-N 2.97Å
12T80.8Confident83Confident88 Ų8891.6 Ų91.654%0.5455%0.545SS..Hα-helixtrans-65.8-40.8176.546.80000112.1S8 I9 V15 A16S8-T12 WeakPolarHBondContact O-CG2 3.36Å; S8-T12 PolarHBondContact O-N 3.43Å; S8-T12 PolarHBondContact O-OG1 3.14Å; I9-T12 WeakPolarHBondContact CA-OG1 3.34Å; I9-T12 PolarHBondContact O-OG1 2.78Å; T12-V15 PolarHBondContact O-N 2.95Å; T12-A16 PolarHBondContact O-N 3.06Å
13A86.4Confident83.9Confident58 Ų5893.7 Ų93.748%0.47955%0.546SS..Hα-helixtrans-62.9-41.7174.200000112.1I9 A16 A17I9-A13 WeakPolarHBondContact O-CB 3.44Å; I9-A13 PolarHBondContact O-N 3.47Å; A13-A16 PolarHBondContact O-N 3.35Å; A13-A17 WeakPolarHBondContact O-CB 3.38Å; A13-A17 PolarHBondContact O-N 3.36Å
14A88.7Confident84.7Confident50 Ų5092.8 Ų92.841%0.41354%0.541SS..Hα-helixtrans-64.2-42.8177.800000112.3A10 L11 A17 L18A10-A14 WeakPolarHBondContact O-CB 3.43Å; A10-A14 PolarHBondContact O-N 3.39Å; L11-A14 PolarHBondContact O-N 2.98Å; A14-A17 PolarHBondContact O-N 2.92Å; A14-L18 WeakPolarHBondContact O-CB 3.38Å; A14-L18 VanDerWaalsContact O-CG 3.32Å; A14-L18 WeakPolarHBondContact O-CG 3.48Å; A14-L18 PolarHBondContact O-N 2.95Å
15V89.8Confident85.5Confident96 Ų9688.9 Ų88.958%0.58253%0.528SS*.Hα-helixtrans-63.6-41.8176.6172.30000111.2L11 T12 L18 G19L11-V15 WeakPolarHBondContact O-CG2 3.23Å; L11-V15 PolarHBondContact O-N 2.97Å; T12-V15 PolarHBondContact O-N 2.95Å; V15-L18 PolarHBondContact O-N 3.5Å; V15-G19 PolarHBondContact O-N 3.37Å
16A90Very high86Confident58 Ų5884.9 Ų84.948%0.47952%0.52SS..Hα-helixtrans-65-41.8177.700000112.3T12 A13 G19 S20T12-A16 PolarHBondContact O-N 3.06Å; A13-A16 PolarHBondContact O-N 3.35Å; A16-G19 PolarHBondContact O-N 2.98Å; A16-S20 WeakPolarHBondContact O-CB 3.47Å; A16-S20 PolarHBondContact O-N 3.43Å; A16-S20 PolarHBondContact O-OG 2.98Å
17A90.9Very high86.1Confident61 Ų6183.5 Ų83.550%0.50452%0.517SS..Hα-helixtrans-64.2-46.1176.800000111.8A13 A14 S20 A21A13-A17 WeakPolarHBondContact O-CB 3.38Å; A13-A17 PolarHBondContact O-N 3.36Å; A14-A17 PolarHBondContact O-N 2.92Å; A17-S20 PolarHBondContact O-N 3.5Å; A17-A21 WeakPolarHBondContact O-CB 3.4Å; A17-A21 PolarHBondContact O-N 2.77Å
18L90.8Very high86.2Confident126 Ų12685.3 Ų85.366%0.6652%0.519SS*.Hα-helixtrans-64.8-41.3177.4-71.5171.7000112.1A14 V15 A21 L22A14-L18 WeakPolarHBondContact O-CB 3.38Å; A14-L18 VanDerWaalsContact O-CG 3.32Å; A14-L18 WeakPolarHBondContact O-CG 3.48Å; A14-L18 PolarHBondContact O-N 2.95Å; V15-L18 PolarHBondContact O-N 3.5Å; L18-A21 PolarHBondContact O-N 3.3Å; L18-L22 WeakPolarHBondContact O-CB 3.32Å; L18-L22 PolarHBondContact O-N 3.43Å
19G87.9Confident86.3Confident41 Ų4187.5 Ų87.542%0.42352%0.52SS..Hα-helixtrans-62.4-42.317600000112.5V15 A16 L22 F23V15-G19 PolarHBondContact O-N 3.37Å; A16-G19 PolarHBondContact O-N 2.98Å; G19-L22 PolarHBondContact O-N 3.37Å; G19-F23 WeakPolarHBondContact O-CB 3.26Å; G19-F23 PolarHBondContact O-N 3.33Å
20S88.7Confident85.7Confident69 Ų6990.2 Ų90.248%0.48353%0.525SS..Hα-helixtrans-66.9-43.6177.8-570000111.7A16 A17 L22 F23 I24A16-S20 WeakPolarHBondContact O-CB 3.47Å; A16-S20 PolarHBondContact O-N 3.43Å; A16-S20 PolarHBondContact O-OG 2.98Å; A17-S20 PolarHBondContact O-N 3.5Å; S20-L22 PolarHBondContact O-N 2.97Å; S20-F23 PolarHBondContact O-N 3.02Å; S20-I24 WeakPolarHBondContact O-CB 3.45Å; S20-I24 WeakPolarHBondContact O-CD1 3.36Å; S20-I24 VanDerWaalsContact O-CG1 3.23Å; S20-I24 WeakPolarHBondContact O-CG1 3.37Å; S20-I24 PolarHBondContact O-N 3.16Å
21A91.7Very high84.8Confident59 Ų5994.9 Ų94.949%0.48853%0.534SS..Hα-helixtrans-62.6-42.5176.400000111.7A17 L18 I24 A25A17-A21 WeakPolarHBondContact O-CB 3.4Å; A17-A21 PolarHBondContact O-N 2.77Å; L18-A21 PolarHBondContact O-N 3.3Å; A21-I24 PolarHBondContact O-N 3.36Å; A21-A25 VanDerWaalsContact O-CB 3.28Å; A21-A25 WeakPolarHBondContact O-CB 3.05Å; A21-A25 PolarHBondContact O-N 2.87Å
22L90.2Very high83.9Confident108 Ų10898.6 Ų98.657%0.56554%0.54SS*.Hα-helixtrans-66-42.5176.5-173.966.6000111.6L18 G19 S20 A25 L26L18-L22 WeakPolarHBondContact O-CB 3.32Å; L18-L22 PolarHBondContact O-N 3.43Å; G19-L22 PolarHBondContact O-N 3.37Å; S20-L22 PolarHBondContact O-N 2.97Å; L22-A25 PolarHBondContact O-N 3.15Å; L22-L26 HydrophobicContact CD1-CD1 3.94Å; L22-L26 HydrophobicContact CG-CD1 3.9Å; L22-L26 WeakPolarHBondContact O-CB 3.49Å; L22-L26 PolarHBondContact O-N 3.29Å
23F86.8Confident82.9Confident147 Ų147104 Ų10465%0.64555%0.55SS**Hα-helixtrans-63.4-42.5176.8-176.8-99.4000111.9G19 S20 N27G19-F23 WeakPolarHBondContact O-CB 3.26Å; G19-F23 PolarHBondContact O-N 3.33Å; S20-F23 PolarHBondContact O-N 3.02Å; F23-N27 WeakPolarHBondContact O-CB 3.17Å; F23-N27 PolarHBondContact O-N 3.38Å
24I87.1Confident81.6Confident114 Ų114105.2 Ų105.259%0.58555%0.552SS**Hα-helixtrans-64.4-44174.9-67.2164.7000110.4S20 A21 N27 Y28S20-I24 WeakPolarHBondContact O-CB 3.45Å; S20-I24 WeakPolarHBondContact O-CD1 3.36Å; S20-I24 VanDerWaalsContact O-CG1 3.23Å; S20-I24 WeakPolarHBondContact O-CG1 3.37Å; S20-I24 PolarHBondContact O-N 3.16Å; A21-I24 PolarHBondContact O-N 3.36Å; I24-N27 PolarHBondContact O-N 3.37Å; I24-Y28 WeakPolarHBondContact O-CB 3.33Å; I24-Y28 PolarHBondContact O-N 2.98Å
25A88.3Confident79.3Confident54 Ų54111.2 Ų111.245%0.44656%0.564SS.*Hα-helixtrans-65.1-43.3178.100000112.1A21 L22 Y28 F29A21-A25 VanDerWaalsContact O-CB 3.28Å; A21-A25 WeakPolarHBondContact O-CB 3.05Å; A21-A25 PolarHBondContact O-N 2.87Å; L22-A25 PolarHBondContact O-N 3.15Å; A25-Y28 PolarHBondContact O-N 2.9Å; A25-F29 VanDerWaalsContact O-CB 3.24Å; A25-F29 WeakPolarHBondContact O-CB 3.15Å; A25-F29 PolarHBondContact O-N 3.02Å
26L82.8Confident77.1Confident102 Ų102110.3 Ų110.353%0.53456%0.562SS.*Hα-helixtrans-64.1-45.9174.8-112.6117.3000110.7L22 Y28 F29 Y30L22-L26 HydrophobicContact CD1-CD1 3.94Å; L22-L26 HydrophobicContact CG-CD1 3.9Å; L22-L26 WeakPolarHBondContact O-CB 3.49Å; L22-L26 PolarHBondContact O-N 3.29Å; L26-Y28 VanDerWaalsContact C-N 3.34Å; L26-Y28 PolarHBondContact O-N 3.48Å; L26-F29 PolarHBondContact O-N 2.82Å; L26-Y30 WeakPolarHBondContact O-CB 3.2Å; L26-Y30 PolarHBondContact O-N 2.76Å
27N81.9Confident75Confident91 Ų91111.3 Ų111.349%0.48756%0.563SS.*Hα-helixtrans-66-38.1179.2-164.317.6000111.1F23 I24 K31F23-N27 WeakPolarHBondContact O-CB 3.17Å; F23-N27 PolarHBondContact O-N 3.38Å; I24-N27 PolarHBondContact O-N 3.37Å; N27-K31 WeakPolarHBondContact O-CB 3.28Å; N27-K31 PolarHBondContact O-N 3.28Å
28Y81.3Confident72.9Confident135 Ų135114.3 Ų114.353%0.52957%0.567SS.*Hα-helixtrans-64.3-43.8173.2-175.4-101.1000112I24 A25 L26 R32I24-Y28 WeakPolarHBondContact O-CB 3.33Å; I24-Y28 PolarHBondContact O-N 2.98Å; A25-Y28 PolarHBondContact O-N 2.9Å; L26-Y28 VanDerWaalsContact C-N 3.34Å; L26-Y28 PolarHBondContact O-N 3.48Å; Y28-R32 WeakPolarHBondContact O-CB 3.35Å; Y28-R32 PolarHBondContact O-N 2.91Å; Y28-R32 PolarHBondContact OH-NE 3.48Å; Y28-R32 VanDerWaalsContact OH-NE 3.16Å; Y28-R32 PolarHBondContact OH-NH2 2.79Å
29F80.5Confident70.9Confident116 Ų116111.7 Ų111.751%0.50956%0.564SS.*Hα-helixtrans-67.8-41.5177.6-169.5-95.7000112.1A25 L26 R32 R33A25-F29 VanDerWaalsContact O-CB 3.24Å; A25-F29 WeakPolarHBondContact O-CB 3.15Å; A25-F29 PolarHBondContact O-N 3.02Å; L26-F29 PolarHBondContact O-N 2.82Å; F29-R32 PolarHBondContact O-N 3.45Å; F29-R33 HydrophobicContact CE1-CG 4.44Å; F29-R33 PolarHBondContact O-N 3.45Å
30Y70.1Confident68.8Low151 Ų151113 Ų11359%0.59257%0.57SS**Hα-helixtrans-69.3-41.6178.4-147.5-91000111.2L26 R32 R33 V34L26-Y30 WeakPolarHBondContact O-CB 3.2Å; L26-Y30 PolarHBondContact O-N 2.76Å; Y30-R32 VanDerWaalsContact C-N 3.31Å; Y30-R32 PolarHBondContact O-N 2.93Å; Y30-R33 PolarHBondContact O-N 2.83Å; Y30-R33 VanDerWaalsContact O-N 3.16Å; Y30-V34 HydrophobicContact CD1-CB 4.38Å; Y30-V34 HydrophobicContact CD1-CG2 3.92Å; Y30-V34 HydrophobicContact CE1-CB 4.42Å; Y30-V34 HydrophobicContact CE1-CG2 3.75Å; Y30-V34 WeakPolarHBondContact O-CB 3.42Å; Y30-V34 PolarHBondContact O-N 3.42Å
31K64.6Low66.8Low159 Ų159119.3 Ų119.369%0.69159%0.585SS**Hα-helixtrans-65.4-32.3174.5-163.7172.9-173.1-178.10112.2N27N27-K31 WeakPolarHBondContact O-CB 3.28Å; N27-K31 PolarHBondContact O-N 3.28Å
32R62.2Low64.8Low188 Ų188121.1 Ų121.171%0.70959%0.593SS**Hα-helixtrans-72.7-31.2170.6-85.2-170165.7-155-4.2114Y28 F29 Y30Y28-R32 WeakPolarHBondContact O-CB 3.35Å; Y28-R32 PolarHBondContact O-N 2.91Å; Y28-R32 PolarHBondContact OH-NE 3.48Å; Y28-R32 VanDerWaalsContact OH-NE 3.16Å; Y28-R32 PolarHBondContact OH-NH2 2.79Å; F29-R32 PolarHBondContact O-N 3.45Å; Y30-R32 VanDerWaalsContact C-N 3.31Å; Y30-R32 PolarHBondContact O-N 2.93Å
33R59.5Low62.4Low200 Ų200121.2 Ų121.276%0.75560%0.598SS**Hα-helixtrans-84.5-26.2179.1-97.7-170.1174.8177-0.4114.4F29 Y30F29-R33 HydrophobicContact CE1-CG 4.44Å; F29-R33 PolarHBondContact O-N 3.45Å; Y30-R33 PolarHBondContact O-N 2.83Å; Y30-R33 VanDerWaalsContact O-N 3.16Å
34V59.2Low60.2Low84 Ų84120.3 Ų120.351%0.50960%0.599SS.*Hα-helixtrans-111.9-4.6-166.4177.80000115.2Y30Y30-V34 HydrophobicContact CD1-CB 4.38Å; Y30-V34 HydrophobicContact CD1-CG2 3.92Å; Y30-V34 HydrophobicContact CE1-CB 4.42Å; Y30-V34 HydrophobicContact CE1-CG2 3.75Å; Y30-V34 WeakPolarHBondContact O-CB 3.42Å; Y30-V34 PolarHBondContact O-N 3.42Å
35W42Very low58.4Low176 Ų176120.2 Ų120.267%0.66760%0.604SS**  trans-151.8102.8173.8-151.7-76000115.9
36S42.2Very low56.6Low78 Ų78123.4 Ų123.455%0.54561%0.609SS.*  -165.784.1111.448.70000111Q38S36-Q38 PolarHBondContact O-N 2.82Å; S36-Q38 VanDerWaalsContact O-N 3.16Å
37P46.2Very low54.9Low78 Ų78128.3 Ų128.351%0.50663%0.629SS.*G310 helixtrans-60.8-14.7164.6-2234000113.1A39 Y41P37-A39 PolarHBondContact O-N 2.75Å; P37-Y41 WeakPolarHBondContact O-CD2 3.24Å
38Q48Very low53.5Low125 Ų125129.4 Ų129.458%0.58463%0.632SS**G310 helixtrans-76.9-18.1-171.8-71.2147.7-18.500114.7S36S36-Q38 PolarHBondContact O-N 2.82Å; S36-Q38 VanDerWaalsContact O-N 3.16Å
39A46.9Very low52.2Low71 Ų71130 Ų13059%0.58764%0.64SS**G310 helixtrans-86.4-17178.600000113.6P37 T43P37-A39 PolarHBondContact O-N 2.75Å; A39-T43 PolarHBondContact O-OG1 3.28Å
40A44.6Very low51.1Low68 Ų68133.8 Ų133.856%0.56266%0.659SS**THydrogen-bonded Turntrans-99.6-13.3-179.200000113.5
41Y47.4Very low50.9Low202 Ų202132.3 Ų132.379%0.79265%0.652SS**SBendtrans-88.5-11.6174-89.1-91000113.6P37P37-Y41 WeakPolarHBondContact O-CD2 3.24Å
42C49.5Very low51.7Low96 Ų96130.3 Ų130.365%0.64965%0.645SS**SBendtrans-105.31.6-176.3-640000114.5
43T40Very low52.9Low111 Ų111126.9 Ų126.968%0.68164%0.635SS**SBendtrans-116.17.3-179.2310000113.7A39A39-T43 PolarHBondContact O-OG1 3.28Å
44I40.7Very low54.3Low127 Ų127119.9 Ų119.965%0.65161%0.609SS**  trans-95.349.3153.5-44.1171.4000106.8E46I44-E46 HydrophobicContact CG2-CG 4.01Å; I44-E46 PolarHBondContact O-N 2.79Å
45T48Very low55.9Low113 Ų113118 Ų11869%0.69360%0.595SS**  trans-78.490.314246.90000102.9E47T45-E47 PolarHBondContact O-N 3.32Å
46E50.2Low58.5Low121 Ų121109.7 Ų109.757%0.56556%0.563SS**  trans-38.9130.3158.1-74.7152.715500106.8I44 E48I44-E46 HydrophobicContact CG2-CG 4.01Å; I44-E46 PolarHBondContact O-N 2.79Å; E46-E48 HydrophobicContact CB-CB 4.05Å; E46-E48 HydrophobicContact CB-CG 3.76Å; E46-E48 PolarHBondContact O-N 2.89Å
47E47.1Very low61.1Low204 Ų204106 Ų10695%0.95354%0.537SS*.  trans-62.851.1149.3-62.7175.5151.800108.4T45 E49T45-E47 PolarHBondContact O-N 3.32Å; E47-E49 PolarHBondContact O-N 3.48Å
48E53Low63.6Low115 Ų115102.3 Ų102.354%0.53751%0.513SS..  trans-64.1114.4151.8-87.5-174.9171.900102.9E46 E50E46-E48 HydrophobicContact CB-CB 4.05Å; E46-E48 HydrophobicContact CB-CG 3.76Å; E46-E48 PolarHBondContact O-N 2.89Å; E48-E50 PolarHBondContact O-N 3.43Å
49E53.9Low66Low148 Ų14896.3 Ų96.369%0.69249%0.485SS*.  trans-38.1119.6153.8-77.5176.8139.800106.4E47 R51E47-E49 PolarHBondContact O-N 3.48Å; E49-R51 HydrophobicContact CB-CG 4.31Å; E49-R51 PolarHBondContact O-N 2.99Å; E49-R51 IonicContact OE2-NE 3.17Å; E49-R51 IonicContact OE2-NH2 3.59Å
50E58.7Low68.4Low195 Ų19593 Ų9391%0.91146%0.457SS*.  trans-6477.1172.5-80.9-166.2157.700107.4E48 E52E48-E50 PolarHBondContact O-N 3.43Å; E50-E52 PolarHBondContact O-N 3.37Å
51R65Low71Confident119 Ų11990.1 Ų90.145%0.44943%0.433SS..PPolyproline II helixtrans-61.8126.7170.9-71.3-174.6175.7-166.6-1.5105.2E49 K53E49-R51 HydrophobicContact CB-CG 4.31Å; E49-R51 PolarHBondContact O-N 2.99Å; E49-R51 IonicContact OE2-NE 3.17Å; E49-R51 IonicContact OE2-NH2 3.59Å; R51-K53 WeakPolarHBondContact O-CG 3.47Å; R51-K53 PolarHBondContact O-N 2.99Å
52E81.3Confident73.3Confident117 Ų11783.2 Ų83.255%0.54741%0.41SS..PPolyproline II helixtrans-53.2120.7-178.8-69.1-170.8170.500109.3E50 R54 C101 Q102E50-E52 PolarHBondContact O-N 3.37Å; E52-R54 IonicContact OE2-CZ 3.44Å; E52-R54 IonicContact OE2-NE 3.37Å; E52-R54 PolarHBondContact OE2-NE 3Å; E52-R54 IonicContact OE2-NH2 2.76Å; E52-R54 PolarHBondContact OE2-NH2 3.29Å; E52-C101 HydrophobicContact CB-CB 4.43Å; E52-C101 WeakPolarHBondContact O-CA 3.33Å; E52-C101 WeakPolarHBondContact O-CB 3.43Å; E52-Q102 PolarHBondContact O-N 2.85Å
53K86.9Confident75.5Confident117 Ų11781 Ų8151%0.50940%0.403SS..EExtended strand (participates in β ladder)trans-91.4122.6178.1-60.7-172.7179.7179.40108.8R51 Q102R51-K53 WeakPolarHBondContact O-CG 3.47Å; R51-K53 PolarHBondContact O-N 2.99Å; K53-Q102 VanDerWaalsContact CE-OE1 3.26Å; K53-Q102 HydrophobicContact CG-CB 4.31Å
54R89.8Confident78.1Confident53 Ų5375.9 Ų75.920%0.237%0.372CS..EExtended strand (participates in β ladder)trans-118.5109.6-176.3-59.9-69.4-172.9133.815.3109.6E52 C101 Q102 L103 D104 V223E52-R54 IonicContact OE2-CZ 3.44Å; E52-R54 IonicContact OE2-NE 3.37Å; E52-R54 PolarHBondContact OE2-NE 3Å; E52-R54 IonicContact OE2-NH2 2.76Å; E52-R54 PolarHBondContact OE2-NH2 3.29Å; R54-C101 HydrophobicContact CG-CB 4.49Å; R54-Q102 PolarHBondContact N-O 3.32Å; R54-L103 HydrophobicContact CB-CD2 4.09Å; R54-D104 PolarHBondContact O-N 2.97Å; R54-V223 HydrophobicContact CB-CG2 4.13Å; R54-V223 HydrophobicContact CG-CB 4.47Å; R54-V223 HydrophobicContact CG-CG1 3.61Å; R54-V223 HydrophobicContact CG-CG2 3.96Å; R54-V223 PolarHBondContact NH1-O 3.34Å; R54-V223 PolarHBondContact NH2-O 3.38Å
55Q93.6Very high80.6Confident45 Ų4570.5 Ų70.521%0.2135%0.348CS..EExtended strand (participates in β ladder)trans-77.5127.2176.6177.7169.39300111.7D104 R124 H126Q55-D104 CarbonylContact C-O 3.58Å; Q55-D104 WeakPolarHBondContact CA-O 3.3Å; Q55-R124 WeakPolarHBondContact CB-O 3.41Å; Q55-R124 PolarHBondContact OE1-O 3.26Å; Q55-H126 PolarHBondContact N-ND1 3.11Å; Q55-H126 WeakPolarHBondContact O-CB 3.47Å; Q55-H126 PolarHBondContact O-N 3.03Å
56I95.3Very high82.8Confident1 Ų165.5 Ų65.51%0.00532%0.316CS..EExtended strand (participates in β ladder)trans-114.7123.2176-59.6153.3000108.2L103 D104 F105 L106 I127 V129 I219I56-L103 HydrophobicContact CD1-CB 3.9Å; I56-L103 HydrophobicContact CD1-CD1 4.39Å; I56-L103 HydrophobicContact CD1-CD2 4.14Å; I56-L103 HydrophobicContact CD1-CG 4.36Å; I56-D104 PolarHBondContact N-O 3.33Å; I56-F105 HydrophobicContact CB-CD1 4.01Å; I56-F105 HydrophobicContact CB-CE1 4.23Å; I56-F105 HydrophobicContact CB-CG 4.41Å; I56-F105 HydrophobicContact CD1-CD1 4.12Å; I56-F105 HydrophobicContact CD1-CD2 4.19Å; I56-F105 HydrophobicContact CD1-CE1 3.67Å; I56-F105 HydrophobicContact CD1-CE2 3.72Å; I56-F105 HydrophobicContact CD1-CG 4.37Å; I56-F105 HydrophobicContact CD1-CZ 3.45Å; I56-F105 VanDerWaalsContact CD1-CZ 3.45Å; I56-F105 HydrophobicContact CG2-CD1 3.8Å; I56-F105 HydrophobicContact CG2-CE1 3.87Å; I56-F105 CarbonylContact O-C 3.57Å; I56-F105 WeakPolarHBondContact O-CA 3.39Å; I56-L106 PolarHBondContact O-N 3.15Å; I56-I127 WeakPolarHBondContact CA-O 3.46Å; I56-V129 HydrophobicContact CG2-CB 4.45Å; I56-V129 HydrophobicContact CG2-CG2 3.62Å; I56-I219 HydrophobicContact CD1-CD1 4.12Å; I56-I219 HydrophobicContact CD1-CG2 3.67Å; I56-I219 HydrophobicContact CG1-CG2 4.32Å
57L97.6Very high84.7Confident0 Ų060.7 Ų60.70%030%0.296CS..EExtended strand (participates in β ladder)trans-96.2127.3178.6-170.369.1000109.7L59 L106 I108 Y121 L122 T125 I127 L128 V129L57-L59 HydrophobicContact CD1-CD2 4.33Å; L57-L59 HydrophobicContact CD2-CD1 3.64Å; L57-L59 HydrophobicContact CD2-CD2 4.18Å; L57-L59 HydrophobicContact CD2-CG 3.88Å; L57-L59 HydrophobicContact CG-CD1 4.19Å; L57-L59 HydrophobicContact CG-CD2 4Å; L57-L59 HydrophobicContact CG-CG 3.84Å; L57-L106 HydrophobicContact CD1-CB 4.19Å; L57-L106 HydrophobicContact CD1-CD2 3.92Å; L57-L106 HydrophobicContact CD1-CG 4.02Å; L57-I108 HydrophobicContact CD1-CG1 3.97Å; L57-Y121 HydrophobicContact CD1-CG 4.35Å; L57-L122 HydrophobicContact CD2-CD2 3.82Å; L57-L122 HydrophobicContact CD2-CG 4.47Å; L57-T125 HydrophobicContact CB-CG2 3.41Å; L57-T125 VanDerWaalsContact CB-CG2 3.41Å; L57-T125 WeakPolarHBondContact CB-OG1 3.36Å; L57-I127 PolarHBondContact N-O 3.42Å; L57-L128 HydrophobicContact CB-CD1 4.42Å; L57-L128 HydrophobicContact CD2-CD1 4.41Å; L57-V129 PolarHBondContact O-N 3.14Å
58V97.4Very high86.7Confident0 Ų053.1 Ų53.10%027%0.265CS..EExtended strand (participates in β ladder)trans-108.1107.7179.5-171.20000109.5K66 L70 F105 L106 E107 I108 V129 V131V58-K66 HydrophobicContact CG1-CB 4.03Å; V58-K66 HydrophobicContact CG1-CD 4.27Å; V58-K66 HydrophobicContact CG1-CG 4.04Å; V58-L70 HydrophobicContact CG2-CD2 4.19Å; V58-F105 HydrophobicContact CG2-CD1 3.94Å; V58-L106 PolarHBondContact N-O 3.16Å; V58-E107 HydrophobicContact CB-CB 4.23Å; V58-I108 PolarHBondContact O-N 3.48Å; V58-V129 WeakPolarHBondContact CA-O 3.34Å; V58-V129 HydrophobicContact CG1-CG1 4.5Å; V58-V129 HydrophobicContact CG2-CB 4.34Å; V58-V131 HydrophobicContact CG1-CG2 3.99Å
59L98.4Very high88.4Confident0 Ų047.6 Ų47.60%024%0.24CC..EExtended strand (participates in β ladder)trans-121.8171.8-179.5-57.2-177.6000111.6L57 K66 I108 W118 L128 V129 Y130 V131 L150L57-L59 HydrophobicContact CD1-CD2 4.33Å; L57-L59 HydrophobicContact CD2-CD1 3.64Å; L57-L59 HydrophobicContact CD2-CD2 4.18Å; L57-L59 HydrophobicContact CD2-CG 3.88Å; L57-L59 HydrophobicContact CG-CD1 4.19Å; L57-L59 HydrophobicContact CG-CD2 4Å; L57-L59 HydrophobicContact CG-CG 3.84Å; L59-K66 VanDerWaalsContact C-CD 3.48Å; L59-I108 HydrophobicContact CD2-CB 3.72Å; L59-I108 HydrophobicContact CD2-CG1 3.88Å; L59-W118 HydrophobicContact CB-CD2 4.48Å; L59-W118 HydrophobicContact CD1-CB 3.84Å; L59-W118 HydrophobicContact CD1-CD2 4.13Å; L59-W118 HydrophobicContact CD1-CE3 4.37Å; L59-W118 HydrophobicContact CD1-CG 3.97Å; L59-W118 HydrophobicContact CD2-CB 4.4Å; L59-W118 HydrophobicContact CD2-CD2 4.15Å; L59-W118 HydrophobicContact CD2-CG 3.88Å; L59-W118 HydrophobicContact CG-CG 4.49Å; L59-L128 HydrophobicContact CB-CD1 4Å; L59-L128 HydrophobicContact CD1-CD1 3.77Å; L59-L128 HydrophobicContact CG-CD1 3.81Å; L59-V129 PolarHBondContact N-O 3.37Å; L59-Y130 HydrophobicContact CB-CD2 4.16Å; L59-V131 PolarHBondContact O-N 3.34Å; L59-L150 HydrophobicContact CD1-CD1 3.6Å; L59-L150 HydrophobicContact CD1-CD2 4.07Å; L59-L150 HydrophobicContact CD1-CG 4.48Å
60G98.3Very high90Very high0 Ų040.6 Ų40.60%021%0.207CC..  trans140.5158.5-174.800000111.2K66 G110 W118 V131G60-K66 PolarHBondContact O-NZ 3.04Å; G60-G110 WeakPolarHBondContact O-CA 3.32Å; G60-W118 VanDerWaalsContact C-CH2 3.5Å; G60-W118 WeakPolarHBondContact O-CH2 3.44Å; G60-W118 VanDerWaalsContact O-CZ2 3.26Å; G60-W118 WeakPolarHBondContact O-CZ2 3.37Å; G60-V131 WeakPolarHBondContact CA-O 3.49Å
61L98.3Very high91.3Very high9 Ų934.7 Ų34.75%0.04718%0.179CC..  trans-58.8158.2-176.8-57.4-175.8000112.2G63 A64 K66 W118 R139 L142 A143 E146L61-G63 PolarHBondContact O-N 3.3Å; L61-A64 WeakPolarHBondContact O-CB 3.27Å; L61-A64 PolarHBondContact O-N 3.46Å; L61-A64 VanDerWaalsContact O-N 3.11Å; L61-K66 PolarHBondContact O-NZ 3.15Å; L61-W118 HydrophobicContact CD2-CH2 4.44Å; L61-R139 HydrophobicContact CD1-CB 3.94Å; L61-L142 HydrophobicContact CD1-CB 4.32Å; L61-L142 HydrophobicContact CD1-CD2 4.25Å; L61-L142 HydrophobicContact CD1-CG 4.18Å; L61-L142 HydrophobicContact CD2-CD2 4.45Å; L61-L142 HydrophobicContact CD2-CG 4.19Å; L61-A143 HydrophobicContact CD1-CB 3.86Å; L61-A143 HydrophobicContact CG-CB 4.17Å; L61-E146 HydrophobicContact CD2-CG 4.4Å
62D96.6Very high92Very high57 Ų5731 Ų3131%0.30518%0.178SC..THydrogen-bonded Turntrans-55.4139169.657.7-77.1000110.8A64 G110 R115 R139D62-A64 PolarHBondContact O-N 3.17Å; D62-G110 PolarHBondContact N-O 2.78Å; D62-G110 VanDerWaalsContact OD1-O 3.12Å; D62-R115 IonicContact OD1-CZ 3.29Å; D62-R115 IonicContact OD1-NH2 2.84Å; D62-R115 PolarHBondContact OD1-NH2 2.8Å; D62-R139 PolarHBondContact O-NH1 2.87Å; D62-R139 PolarHBondContact O-NH2 3.11Å; D62-R139 IonicContact OD1-NH1 3.96Å; D62-R139 IonicContact OD2-NH1 3.34Å; D62-R139 PolarHBondContact OD2-NH1 3.43Å
63G94.4Very high91.9Very high50 Ų5026.4 Ų26.452%0.51516%0.157SC..THydrogen-bonded Turntrans74.9-2-175.100000115.4L61 G65 K165L61-G63 PolarHBondContact O-N 3.3Å; G63-G65 PolarHBondContact O-N 3.16Å; G63-K165 VanDerWaalsContact O-CE 3.26Å; G63-K165 WeakPolarHBondContact O-CE 3.18Å; G63-K165 PolarHBondContact O-NZ 3.45Å
64A95.6Very high91.4Very high2 Ų222.8 Ų22.82%0.01715%0.145CC..SBendtrans-62.6-23.6178.100000114.4L61 D62 V131 N164L61-A64 WeakPolarHBondContact O-CB 3.27Å; L61-A64 PolarHBondContact O-N 3.46Å; L61-A64 VanDerWaalsContact O-N 3.11Å; D62-A64 PolarHBondContact O-N 3.17Å; A64-V131 HydrophobicContact CB-CB 4.45Å; A64-V131 HydrophobicContact CB-CG1 4.2Å; A64-V131 WeakPolarHBondContact CB-O 3.49Å; A64-N164 PolarHBondContact O-ND2 3.14Å
65G92.9Very high90.3Very high14 Ų1425.3 Ų25.314%0.14417%0.169CC..SBendtrans104.518.8177.400000115.6G63 S68 M69G63-G65 PolarHBondContact O-N 3.16Å; G65-S68 PolarHBondContact O-N 2.93Å; G65-M69 PolarHBondContact O-N 3.03Å
66K93.9Very high88.8Confident9 Ų925.8 Ų25.84%0.03919%0.186CC..Hα-helixtrans-50.8-56.4176.6-62.1-177.9-61.6-70.70113.5V58 L59 G60 L61 S68 M69 L70 E107 I108 V131V58-K66 HydrophobicContact CG1-CB 4.03Å; V58-K66 HydrophobicContact CG1-CD 4.27Å; V58-K66 HydrophobicContact CG1-CG 4.04Å; L59-K66 VanDerWaalsContact C-CD 3.48Å; G60-K66 PolarHBondContact O-NZ 3.04Å; L61-K66 PolarHBondContact O-NZ 3.15Å; K66-S68 VanDerWaalsContact C-N 3.28Å; K66-S68 PolarHBondContact O-N 3.14Å; K66-M69 WeakPolarHBondContact O-CB 3.44Å; K66-M69 PolarHBondContact O-N 3.03Å; K66-L70 PolarHBondContact O-N 3.18Å; K66-E107 HydrophobicContact CB-CG 4.2Å; K66-E107 VanDerWaalsContact CB-OE1 3.26Å; K66-E107 WeakPolarHBondContact CB-OE1 3.44Å; K66-I108 WeakPolarHBondContact CE-O 3.3Å; K66-V131 HydrophobicContact CG-CB 3.88Å; K66-V131 HydrophobicContact CG-CG2 3.93Å
67S91.6Very high86.4Confident19 Ų1934.6 Ų34.613%0.13323%0.227CC..Hα-helixtrans-63.6-35.7-178.7-28.50000112.2L70 Q71 T88 E107S67-L70 PolarHBondContact O-N 3.46Å; S67-Q71 VanDerWaalsContact O-CG 3.29Å; S67-Q71 WeakPolarHBondContact O-CG 3.34Å; S67-Q71 PolarHBondContact O-N 2.98Å; S67-T88 PolarHBondContact OG-OG1 2.99Å; S67-E107 WeakPolarHBondContact CA-OE2 3.37Å; S67-E107 WeakPolarHBondContact CB-OE2 3.48Å; S67-E107 PolarHBondContact N-OE1 3.36Å; S67-E107 VanDerWaalsContact N-OE1 3.08Å; S67-E107 PolarHBondContact OG-OE1 2.73Å; S67-E107 PolarHBondContact OG-OE2 3.49Å
68S88.6Confident84.1Confident45 Ų4537.9 Ų37.932%0.31525%0.25SC..Hα-helixtrans-68-39.3176.7-55.10000112G65 K66 Q71 G72G65-S68 PolarHBondContact O-N 2.93Å; K66-S68 VanDerWaalsContact C-N 3.28Å; K66-S68 PolarHBondContact O-N 3.14Å; S68-Q71 PolarHBondContact O-N 3.05Å; S68-G72 PolarHBondContact O-N 2.77Å
69M87.7Confident81.8Confident0 Ų040 Ų400%027%0.267CS..Hα-helixtrans-60.1-49.6172177.2-152.1168.300110.8G65 K66 Q71 G72 L73 V129 V131 L162 L199 L212 V215G65-M69 PolarHBondContact O-N 3.03Å; K66-M69 WeakPolarHBondContact O-CB 3.44Å; K66-M69 PolarHBondContact O-N 3.03Å; M69-Q71 PolarHBondContact O-N 3Å; M69-G72 WeakPolarHBondContact O-CA 3.46Å; M69-G72 PolarHBondContact O-N 2.98Å; M69-L73 HydrophobicContact CE-CD1 3.9Å; M69-L73 PolarHBondContact O-N 2.82Å; M69-L73 VanDerWaalsContact O-N 3.16Å; M69-V129 HydrophobicContact CE-CG1 4.1Å; M69-V129 HydrophobicContact SD-CG1 4.21Å; M69-V131 HydrophobicContact SD-CG2 4.04Å; M69-L162 HydrophobicContact CE-CD2 4.07Å; M69-L162 HydrophobicContact CG-CD2 4Å; M69-L162 HydrophobicContact SD-CD2 3.59Å; M69-L162 VanDerWaalsContact SD-CD2 3.59Å; M69-L199 HydrophobicContact CB-CD1 3.99Å; M69-L212 HydrophobicContact CE-CD2 4.36Å; M69-L212 HydrophobicContact CG-CD2 4.03Å; M69-V215 HydrophobicContact CE-CG1 3.95Å
70L88Confident79.1Confident0 Ų044.4 Ų44.40%030%0.303CS..Hα-helixtrans-59.9-44.7178.7-73.6-176.2000112V58 K66 S67 G72 L73 T74 M94 F105 E107V58-L70 HydrophobicContact CG2-CD2 4.19Å; K66-L70 PolarHBondContact O-N 3.18Å; S67-L70 PolarHBondContact O-N 3.46Å; L70-G72 PolarHBondContact O-N 3.06Å; L70-L73 HydrophobicContact CD2-CD1 4.36Å; L70-L73 WeakPolarHBondContact O-CB 3.39Å; L70-L73 PolarHBondContact O-N 3.3Å; L70-T74 PolarHBondContact O-N 3.17Å; L70-T74 PolarHBondContact O-OG1 2.86Å; L70-M94 HydrophobicContact CB-CE 3.78Å; L70-M94 HydrophobicContact CB-SD 4.24Å; L70-M94 HydrophobicContact CD2-SD 4.31Å; L70-M94 VanDerWaalsContact O-CE 3.22Å; L70-M94 WeakPolarHBondContact O-CE 3.33Å; L70-M94 VanDerWaalsContact O-SD 3.41Å; L70-F105 HydrophobicContact CD2-CB 3.78Å; L70-F105 HydrophobicContact CD2-CD1 3.72Å; L70-F105 HydrophobicContact CD2-CG 3.88Å; L70-E107 HydrophobicContact CD1-CB 3.54Å; L70-E107 HydrophobicContact CD1-CG 4.43Å
71Q86.1Confident76.8Confident71 Ų7152.8 Ų52.833%0.33234%0.34SS..Hα-helixtrans-59.2-33.6174.4-74.5171.78.700112.7S67 S68 M69 L73 T74 C85S67-Q71 VanDerWaalsContact O-CG 3.29Å; S67-Q71 WeakPolarHBondContact O-CG 3.34Å; S67-Q71 PolarHBondContact O-N 2.98Å; S68-Q71 PolarHBondContact O-N 3.05Å; M69-Q71 PolarHBondContact O-N 3Å; Q71-L73 VanDerWaalsContact C-N 3.3Å; Q71-T74 PolarHBondContact O-N 3.02Å; Q71-C85 PolarHBondContact NE2-SG 3.31Å; Q71-C85 PolarHBondContact OE1-SG 2.84Å; Q71-C85 VanDerWaalsContact OE1-SG 3.36Å
72G80Confident74.9Confident41 Ų4157.8 Ų57.842%0.42336%0.358SS..Hα-helixtrans-68.5-26.6174.800000114S68 M69 L70S68-G72 PolarHBondContact O-N 2.77Å; M69-G72 WeakPolarHBondContact O-CA 3.46Å; M69-G72 PolarHBondContact O-N 2.98Å; L70-G72 PolarHBondContact O-N 3.06Å
73L78.7Confident73.1Confident21 Ų2157.4 Ų57.411%0.1137%0.368CS..Hα-helixtrans-83-15.7176.8-72.2171.1000113.6M69 L70 Q71 P75 L96 F105 L212M69-L73 HydrophobicContact CE-CD1 3.9Å; M69-L73 PolarHBondContact O-N 2.82Å; M69-L73 VanDerWaalsContact O-N 3.16Å; L70-L73 HydrophobicContact CD2-CD1 4.36Å; L70-L73 WeakPolarHBondContact O-CB 3.39Å; L70-L73 PolarHBondContact O-N 3.3Å; Q71-L73 VanDerWaalsContact C-N 3.3Å; L73-P75 VanDerWaalsContact O-CD 3.31Å; L73-P75 WeakPolarHBondContact O-CD 3.39Å; L73-L96 HydrophobicContact CB-CD1 3.97Å; L73-F105 HydrophobicContact CD1-CE1 4.13Å; L73-F105 HydrophobicContact CD1-CZ 4.22Å; L73-L212 HydrophobicContact CD2-CB 3.7Å; L73-L212 HydrophobicContact CD2-CD1 4.11Å; L73-L212 HydrophobicContact CD2-CD2 3.82Å; L73-L212 HydrophobicContact CD2-CG 4.07Å; L73-L212 HydrophobicContact CG-CD1 4.3Å; L73-L212 HydrophobicContact CG-CD2 3.98Å
74T75.9Confident71.8Confident42 Ų4267 Ų6726%0.25839%0.388SS..SBendtrans-75.5121.1-178.5-50.50000110.7L70 Q71 M94L70-T74 PolarHBondContact O-N 3.17Å; L70-T74 PolarHBondContact O-OG1 2.86Å; Q71-T74 PolarHBondContact O-N 3.02Å; T74-M94 WeakPolarHBondContact OG1-CE 3.16Å
75P67.8Low71.1Confident106 Ų10668.9 Ų68.969%0.68840%0.401SS*.  trans-65.6140.8174.8-17.630.7000111.9L73L73-P75 VanDerWaalsContact O-CD 3.31Å; L73-P75 WeakPolarHBondContact O-CD 3.39Å
76G61.9Low70.8Confident55 Ų5578.8 Ų78.857%0.56743%0.434SS*.SBendtrans101-164167.900000117.3S78 A79G76-S78 PolarHBondContact O-N 3.26Å; G76-A79 WeakPolarHBondContact O-CB 3.45Å; G76-A79 PolarHBondContact O-N 3.15Å
77E45.5Very low70.7Confident186 Ų18683.9 Ų83.987%0.86947%0.468SS*.G310 helixtrans-59.6-12-170.2-71.1-174.8152.800115.4A79 A80E77-A79 PolarHBondContact O-N 3.16Å; E77-A80 WeakPolarHBondContact O-CB 3.24Å; E77-A80 PolarHBondContact O-N 3.41Å
78S48.4Very low70.7Confident69 Ų6984.7 Ų84.748%0.48347%0.472SS..G310 helixtrans-61.6-20.1168.4-67.10000112.9G76 A80 K81G76-S78 PolarHBondContact O-N 3.26Å; S78-A80 PolarHBondContact O-N 3Å; S78-K81 PolarHBondContact O-N 3.28Å; S78-K81 VanDerWaalsContact O-N 3.08Å
79A48.5Very low70.7Confident43 Ų4394.2 Ų94.236%0.35550%0.501SS..G310 helixtrans-63.2-18.9170.500000113.8G76 E77 R82G76-A79 WeakPolarHBondContact O-CB 3.45Å; G76-A79 PolarHBondContact O-N 3.15Å; E77-A79 PolarHBondContact O-N 3.16Å; A79-R82 PolarHBondContact O-NE 3.48Å
80A42.8Very low70.9Confident93 Ų9395.4 Ų95.477%0.76951%0.513SS*.G310 helixtrans-86.5-14.6175.100000113.1E77 S78 R82E77-A80 WeakPolarHBondContact O-CB 3.24Å; E77-A80 PolarHBondContact O-N 3.41Å; S78-A80 PolarHBondContact O-N 3Å; A80-R82 VanDerWaalsContact C-N 3.35Å
81K48.5Very low71.2Confident176 Ų176101.9 Ų101.977%0.76554%0.541SS*.  trans-97.437.6173.1-83.4-176.5179.7171.70112.3S78 G83S78-K81 PolarHBondContact O-N 3.28Å; S78-K81 VanDerWaalsContact O-N 3.08Å; K81-G83 PolarHBondContact O-N 2.85Å
82R58.9Low71.4Confident115 Ų115101.5 Ų101.543%0.43454%0.542SS..  trans-69.865167.6-78.1-172.7-92.2-161.5-16110.7A79 A80A79-R82 PolarHBondContact O-NE 3.48Å; A80-R82 VanDerWaalsContact C-N 3.35Å
83G58.8Low72Confident49 Ų49104.7 Ų104.751%0.50554%0.544SS..  trans-88.8165.3173.400000111.1K81 C85K81-G83 PolarHBondContact O-N 2.85Å; G83-C85 PolarHBondContact O-N 2.61Å
84R67.5Low72.5Confident251 Ų251105 Ų10595%0.94755%0.545SS*.  trans-59.3112175-165.4-177.7-78.3-139.20.5109.5R86R84-R86 PolarHBondContact O-N 2.86Å
85C81.1Confident73.2Confident41 Ų41105.3 Ų105.328%0.27755%0.549SS..PPolyproline II helixtrans-65.4132.3176.8-68.40000110.2Q71 G83Q71-C85 PolarHBondContact NE2-SG 3.31Å; Q71-C85 PolarHBondContact OE1-SG 2.84Å; Q71-C85 VanDerWaalsContact OE1-SG 3.36Å; G83-C85 PolarHBondContact O-N 2.61Å
86R87.5Confident74Confident223 Ų223101.1 Ų101.184%0.84252%0.521SS*.PPolyproline II helixtrans-78.3153.3171.3-68.4-176.4178.5-179.6-0.1109.6R84 T88R84-R86 PolarHBondContact O-N 2.86Å; R86-T88 PolarHBondContact O-N 2.82Å
87P90.6Very high75Confident116 Ų116104.4 Ų104.475%0.75353%0.526SS*.PPolyproline II helixtrans-56126.5174-25.334.6000111.9R89P87-R89 PolarHBondContact O-N 3.32Å
88T91.1Very high76.6Confident36 Ų3695.8 Ų95.822%0.22149%0.486CS..  trans-67.6113.6178.1-490000110.4S67 R86 E107 G109S67-T88 PolarHBondContact OG-OG1 2.99Å; R86-T88 PolarHBondContact O-N 2.82Å; T88-E107 PolarHBondContact OG1-OE1 3.2Å; T88-G109 WeakPolarHBondContact O-CA 3.4Å
89R88.6Confident77.7Confident245 Ų24598.4 Ų98.493%0.92550%0.501SS*.SBendtrans-99.173.8175.2-72.7-176.4160.7-172.6-5.9109.9P87P87-R89 PolarHBondContact O-N 3.32Å
90G92.5Very high79Confident24 Ų24100.6 Ų100.625%0.24751%0.514CS..SBendtrans134.7-122.5-175.600000110.9G109G90-G109 PolarHBondContact O-N 2.84Å
91F93.8Very high80.9Confident136 Ų13696.2 Ų96.260%0.59648%0.478SS*.EExtended strand (participates in β ladder)trans-136164.3179.364.2-88.9000111.8L106 E107 I108F91-L106 HydrophobicContact CB-CD1 4.12Å; F91-L106 HydrophobicContact CD2-CD1 4.02Å; F91-L106 HydrophobicContact CG-CD1 4.36Å; F91-E107 CarbonylContact C-O 3.58Å; F91-E107 WeakPolarHBondContact CA-O 3.33Å; F91-E107 VanDerWaalsContact CB-O 3.31Å; F91-E107 WeakPolarHBondContact CB-O 3.25Å; F91-I108 HydrophobicContact CB-CD1 3.6Å
92N91.9Very high82.7Confident64 Ų6489.8 Ų89.834%0.34245%0.45SS..EExtended strand (participates in β ladder)trans-133.6145.7172.3-179.326.2000108.6E107N92-E107 HydrophobicContact CB-CB 4.17Å; N92-E107 HydrophobicContact CB-CG 4.47Å; N92-E107 PolarHBondContact N-O 2.9Å; N92-E107 PolarHBondContact ND2-OE2 3.5Å; N92-E107 PolarHBondContact O-N 3.26Å
93F92.3Very high84.2Confident107 Ų10784.3 Ų84.347%0.46943%0.43SS..EExtended strand (participates in β ladder)trans-129.1134.6-176-179.3-96.3000110.3D104 F105F93-D104 HydrophobicContact CE2-CB 3.82Å; F93-D104 HydrophobicContact CZ-CB 3.97Å; F93-F105 WeakPolarHBondContact CA-O 3.42Å
94M89.4Confident85.8Confident28 Ų2883.1 Ų83.114%0.13841%0.412CS..EExtended strand (participates in β ladder)trans-142.1130.2178.6172.3-178.5-60.500109.5L70 T74 L96 F105L70-M94 HydrophobicContact CB-CE 3.78Å; L70-M94 HydrophobicContact CB-SD 4.24Å; L70-M94 HydrophobicContact CD2-SD 4.31Å; L70-M94 VanDerWaalsContact O-CE 3.22Å; L70-M94 WeakPolarHBondContact O-CE 3.33Å; L70-M94 VanDerWaalsContact O-SD 3.41Å; T74-M94 WeakPolarHBondContact OG1-CE 3.16Å; M94-L96 HydrophobicContact CG-CD2 4.46Å; M94-L96 HydrophobicContact CG-CG 4.37Å; M94-L96 HydrophobicContact SD-CD2 4.47Å; M94-L96 HydrophobicContact SD-CG 4.48Å; M94-F105 HydrophobicContact CB-CB 4.28Å; M94-F105 PolarHBondContact N-O 3.06Å; M94-F105 WeakPolarHBondContact O-CA 3.34Å; M94-F105 WeakPolarHBondContact O-CB 3.23Å; M94-F105 PolarHBondContact O-N 2.96Å
95S89.3Confident87Confident49 Ų4971.4 Ų71.434%0.34337%0.368SS..EExtended strand (participates in β ladder)trans-106.5137.2173.1-178.10000109.7Q102 L103 D104S95-Q102 WeakPolarHBondContact OG-CG 3.5Å; S95-Q102 PolarHBondContact OG-NE2 2.98Å; S95-L103 CarbonylContact C-O 3.57Å; S95-L103 WeakPolarHBondContact CA-O 3.5Å; S95-D104 PolarHBondContact OG-OD1 3.14Å
96L85.4Confident87.8Confident17 Ų1770.2 Ų70.29%0.08936%0.359CS..EExtended strand (participates in β ladder)trans-126.2126.9172.3-64.3177.5000109.4L73 M94 A98 L103 F105L73-L96 HydrophobicContact CB-CD1 3.97Å; M94-L96 HydrophobicContact CG-CD2 4.46Å; M94-L96 HydrophobicContact CG-CG 4.37Å; M94-L96 HydrophobicContact SD-CD2 4.47Å; M94-L96 HydrophobicContact SD-CG 4.48Å; L96-A98 PolarHBondContact O-N 3.19Å; L96-L103 PolarHBondContact N-O 3.48Å; L96-L103 PolarHBondContact O-N 2.9Å; L96-F105 HydrophobicContact CB-CE2 4.39Å; L96-F105 HydrophobicContact CD1-CD2 4.28Å; L96-F105 HydrophobicContact CD1-CE2 3.7Å; L96-F105 HydrophobicContact CD1-CZ 4.37Å; L96-F105 HydrophobicContact CG-CD2 4.45Å; L96-F105 HydrophobicContact CG-CE2 4.19Å
97D83.6Confident88.2Confident125 Ų12559.6 Ų59.667%0.66832%0.318SS*.EExtended strand (participates in β ladder)trans-79.8115.8174.6-67.4-38.1000109.6
98A77.6Confident88.5Confident4 Ų454.2 Ų54.23%0.03328%0.284CS..  trans-100.5159.6168.600000110.1L96 S100 C101 L103 L220L96-A98 PolarHBondContact O-N 3.19Å; A98-S100 PolarHBondContact O-N 3.15Å; A98-S100 VanDerWaalsContact O-N 3.11Å; A98-C101 CarbonylContact C-O 3.57Å; A98-C101 WeakPolarHBondContact CA-O 3.45Å; A98-C101 WeakPolarHBondContact CB-O 3.2Å; A98-C101 PolarHBondContact N-O 3.16Å; A98-C101 PolarHBondContact O-N 2.94Å; A98-C101 VanDerWaalsContact O-O 3.1Å; A98-L103 HydrophobicContact CB-CD1 4.31Å; A98-L103 HydrophobicContact CB-CG 4.34Å; A98-L220 HydrophobicContact CB-CD2 3.85Å
99P73.1Confident88.8Confident125 Ų12552.5 Ų52.581%0.81227%0.273SS*.SBendtrans-56.1-31.1-175.5-28.135.8000115.2
100S74.8Confident89.1Confident88 Ų8841 Ų4162%0.61523%0.231SC*.SBendtrans-109.9-16.5-175.253.40000115A98A98-S100 PolarHBondContact O-N 3.15Å; A98-S100 VanDerWaalsContact O-N 3.11Å
101C82.3Confident89.3Confident2 Ų241.1 Ų41.11%0.01423%0.232CC..SBendtrans-160.5162.1-172.663.90000111.5E52 R54 A98E52-C101 HydrophobicContact CB-CB 4.43Å; E52-C101 WeakPolarHBondContact O-CA 3.33Å; E52-C101 WeakPolarHBondContact O-CB 3.43Å; R54-C101 HydrophobicContact CG-CB 4.49Å; A98-C101 CarbonylContact C-O 3.57Å; A98-C101 WeakPolarHBondContact CA-O 3.45Å; A98-C101 WeakPolarHBondContact CB-O 3.2Å; A98-C101 PolarHBondContact N-O 3.16Å; A98-C101 PolarHBondContact O-N 2.94Å; A98-C101 VanDerWaalsContact O-O 3.1Å
102Q86.9Confident89.4Confident40 Ų4042 Ų4219%0.18724%0.238CC..EExtended strand (participates in β ladder)trans-95.5128171.6-174.4-177.6-11.800109.8E52 K53 R54 S95 D104E52-Q102 PolarHBondContact O-N 2.85Å; K53-Q102 VanDerWaalsContact CE-OE1 3.26Å; K53-Q102 HydrophobicContact CG-CB 4.31Å; R54-Q102 PolarHBondContact N-O 3.32Å; S95-Q102 WeakPolarHBondContact OG-CG 3.5Å; S95-Q102 PolarHBondContact OG-NE2 2.98Å; Q102-D104 PolarHBondContact NE2-OD1 3.25Å
103L89.4Confident89.5Confident1 Ų145 Ų451%0.00525%0.254CS..EExtended strand (participates in β ladder)trans-102.9113.6-179.5-59.4-177.5000110.7R54 I56 S95 L96 A98 F105 Q216 I219 L220R54-L103 HydrophobicContact CB-CD2 4.09Å; I56-L103 HydrophobicContact CD1-CB 3.9Å; I56-L103 HydrophobicContact CD1-CD1 4.39Å; I56-L103 HydrophobicContact CD1-CD2 4.14Å; I56-L103 HydrophobicContact CD1-CG 4.36Å; S95-L103 CarbonylContact C-O 3.57Å; S95-L103 WeakPolarHBondContact CA-O 3.5Å; L96-L103 PolarHBondContact N-O 3.48Å; L96-L103 PolarHBondContact O-N 2.9Å; A98-L103 HydrophobicContact CB-CD1 4.31Å; A98-L103 HydrophobicContact CB-CG 4.34Å; L103-F105 HydrophobicContact CB-CD2 4.46Å; L103-F105 HydrophobicContact CB-CE2 3.83Å; L103-Q216 HydrophobicContact CD1-CG 4.48Å; L103-I219 HydrophobicContact CD1-CG2 3.9Å; L103-I219 HydrophobicContact CD2-CG2 3.97Å; L103-L220 HydrophobicContact CD1-CD2 4.42Å
104D92.7Very high89.7Confident24 Ų2441.9 Ų41.913%0.12824%0.242CC..EExtended strand (participates in β ladder)trans-104100.7-177.3-80-13.2000110.6R54 Q55 I56 F93 S95 Q102R54-D104 PolarHBondContact O-N 2.97Å; Q55-D104 CarbonylContact C-O 3.58Å; Q55-D104 WeakPolarHBondContact CA-O 3.3Å; I56-D104 PolarHBondContact N-O 3.33Å; F93-D104 HydrophobicContact CE2-CB 3.82Å; F93-D104 HydrophobicContact CZ-CB 3.97Å; S95-D104 PolarHBondContact OG-OD1 3.14Å; Q102-D104 PolarHBondContact NE2-OD1 3.25Å
105F94.1Very high90Very high4 Ų441.5 Ų41.52%0.01824%0.239CC..EExtended strand (participates in β ladder)trans-83.8119.4177-65.8-99.3000111.1I56 V58 L70 L73 F93 M94 L96 L103 I219I56-F105 HydrophobicContact CB-CD1 4.01Å; I56-F105 HydrophobicContact CB-CE1 4.23Å; I56-F105 HydrophobicContact CB-CG 4.41Å; I56-F105 HydrophobicContact CD1-CD1 4.12Å; I56-F105 HydrophobicContact CD1-CD2 4.19Å; I56-F105 HydrophobicContact CD1-CE1 3.67Å; I56-F105 HydrophobicContact CD1-CE2 3.72Å; I56-F105 HydrophobicContact CD1-CG 4.37Å; I56-F105 HydrophobicContact CD1-CZ 3.45Å; I56-F105 VanDerWaalsContact CD1-CZ 3.45Å; I56-F105 HydrophobicContact CG2-CD1 3.8Å; I56-F105 HydrophobicContact CG2-CE1 3.87Å; I56-F105 CarbonylContact O-C 3.57Å; I56-F105 WeakPolarHBondContact O-CA 3.39Å; V58-F105 HydrophobicContact CG2-CD1 3.94Å; L70-F105 HydrophobicContact CD2-CB 3.78Å; L70-F105 HydrophobicContact CD2-CD1 3.72Å; L70-F105 HydrophobicContact CD2-CG 3.88Å; L73-F105 HydrophobicContact CD1-CE1 4.13Å; L73-F105 HydrophobicContact CD1-CZ 4.22Å; F93-F105 WeakPolarHBondContact CA-O 3.42Å; M94-F105 HydrophobicContact CB-CB 4.28Å; M94-F105 PolarHBondContact N-O 3.06Å; M94-F105 WeakPolarHBondContact O-CA 3.34Å; M94-F105 WeakPolarHBondContact O-CB 3.23Å; M94-F105 PolarHBondContact O-N 2.96Å; L96-F105 HydrophobicContact CB-CE2 4.39Å; L96-F105 HydrophobicContact CD1-CD2 4.28Å; L96-F105 HydrophobicContact CD1-CE2 3.7Å; L96-F105 HydrophobicContact CD1-CZ 4.37Å; L96-F105 HydrophobicContact CG-CD2 4.45Å; L96-F105 HydrophobicContact CG-CE2 4.19Å; L103-F105 HydrophobicContact CB-CD2 4.46Å; L103-F105 HydrophobicContact CB-CE2 3.83Å; F105-I219 HydrophobicContact CE1-CD1 4.07Å; F105-I219 HydrophobicContact CZ-CD1 4.09Å
106L96.3Very high90.3Very high16 Ų1647 Ų478%0.08425%0.252CS..EExtended strand (participates in β ladder)trans-109.4104.8172.1-179.662.5000109.5I56 L57 V58 F91 I108 Y121I56-L106 PolarHBondContact O-N 3.15Å; L57-L106 HydrophobicContact CD1-CB 4.19Å; L57-L106 HydrophobicContact CD1-CD2 3.92Å; L57-L106 HydrophobicContact CD1-CG 4.02Å; V58-L106 PolarHBondContact N-O 3.16Å; F91-L106 HydrophobicContact CB-CD1 4.12Å; F91-L106 HydrophobicContact CD2-CD1 4.02Å; F91-L106 HydrophobicContact CG-CD1 4.36Å; L106-I108 HydrophobicContact CD1-CD1 4.09Å; L106-I108 HydrophobicContact CD2-CD1 4.17Å; L106-I108 HydrophobicContact CG-CD1 3.87Å; L106-Y121 HydrophobicContact CD2-CD1 3.64Å; L106-Y121 HydrophobicContact CD2-CE1 4.17Å; L106-Y121 HydrophobicContact CD2-CG 4.4Å
107E96.6Very high90.8Very high0 Ų050.8 Ų50.80%027%0.266CS..EExtended strand (participates in β ladder)trans-88.1130.7170.9164.3-174.3-158.600110.1V58 K66 S67 L70 T88 F91 N92V58-E107 HydrophobicContact CB-CB 4.23Å; K66-E107 HydrophobicContact CB-CG 4.2Å; K66-E107 VanDerWaalsContact CB-OE1 3.26Å; K66-E107 WeakPolarHBondContact CB-OE1 3.44Å; S67-E107 WeakPolarHBondContact CA-OE2 3.37Å; S67-E107 WeakPolarHBondContact CB-OE2 3.48Å; S67-E107 PolarHBondContact N-OE1 3.36Å; S67-E107 VanDerWaalsContact N-OE1 3.08Å; S67-E107 PolarHBondContact OG-OE1 2.73Å; S67-E107 PolarHBondContact OG-OE2 3.49Å; L70-E107 HydrophobicContact CD1-CB 3.54Å; L70-E107 HydrophobicContact CD1-CG 4.43Å; T88-E107 PolarHBondContact OG1-OE1 3.2Å; F91-E107 CarbonylContact C-O 3.58Å; F91-E107 WeakPolarHBondContact CA-O 3.33Å; F91-E107 VanDerWaalsContact CB-O 3.31Å; F91-E107 WeakPolarHBondContact CB-O 3.25Å; N92-E107 HydrophobicContact CB-CB 4.17Å; N92-E107 HydrophobicContact CB-CG 4.47Å; N92-E107 PolarHBondContact N-O 2.9Å; N92-E107 PolarHBondContact ND2-OE2 3.5Å; N92-E107 PolarHBondContact O-N 3.26Å
108I97.2Very high91.4Very high4 Ų444.8 Ų44.82%0.02123%0.234CC..EExtended strand (participates in β ladder)trans-107.8141.7169.4-48.9-60.3000109.6L57 V58 L59 K66 F91 L106 Y121L57-I108 HydrophobicContact CD1-CG1 3.97Å; V58-I108 PolarHBondContact O-N 3.48Å; L59-I108 HydrophobicContact CD2-CB 3.72Å; L59-I108 HydrophobicContact CD2-CG1 3.88Å; K66-I108 WeakPolarHBondContact CE-O 3.3Å; F91-I108 HydrophobicContact CB-CD1 3.6Å; L106-I108 HydrophobicContact CD1-CD1 4.09Å; L106-I108 HydrophobicContact CD2-CD1 4.17Å; L106-I108 HydrophobicContact CG-CD1 3.87Å; I108-Y121 HydrophobicContact CD1-CD1 4.17Å; I108-Y121 HydrophobicContact CD1-CD2 4.08Å; I108-Y121 HydrophobicContact CD1-CE1 3.99Å; I108-Y121 HydrophobicContact CD1-CE2 3.91Å; I108-Y121 HydrophobicContact CD1-CG 4.21Å; I108-Y121 HydrophobicContact CG1-CD2 4.05Å; I108-Y121 HydrophobicContact CG1-CE2 4.22Å; I108-Y121 HydrophobicContact CG1-CG 4.34Å
109G96.3Very high92.3Very high0 Ų045.1 Ų45.10%024%0.238CC..  trans-56.7143.5174.900000112.3T88 G90 L114 W118T88-G109 WeakPolarHBondContact O-CA 3.4Å; G90-G109 PolarHBondContact O-N 2.84Å; G109-L114 WeakPolarHBondContact O-CB 3.38Å; G109-W118 PolarHBondContact O-NE1 2.78Å
110G96.8Very high93.3Very high4 Ų444.9 Ų44.94%0.04123%0.23CC..  trans-105.39-17400000116G60 D62 R115G60-G110 WeakPolarHBondContact O-CA 3.32Å; D62-G110 PolarHBondContact N-O 2.78Å; D62-G110 VanDerWaalsContact OD1-O 3.12Å; G110-R115 PolarHBondContact O-NE 2.81Å; G110-R115 PolarHBondContact O-NH2 2.83Å
111G96.1Very high94.3Very high26 Ų2644.7 Ų44.727%0.26822%0.216SC..SBendtrans-65.9151.9171.700000110.6D113 L114 R115G111-D113 VanDerWaalsContact C-N 3.29Å; G111-D113 PolarHBondContact O-N 3.36Å; G111-L114 PolarHBondContact O-N 3.34Å; G111-R115 WeakPolarHBondContact O-CG 3.35Å; G111-R115 PolarHBondContact O-N 2.91Å
112E95.2Very high94.8Very high154 Ų15444.7 Ų44.772%0.7222%0.216SC*.Hα-helixtrans-48.6-46.6-174.2-170.7172.7175.400113.4L114 R115E112-L114 PolarHBondContact O-N 3.15Å; E112-L114 VanDerWaalsContact O-N 3.11Å; E112-R115 PolarHBondContact O-N 3Å
113D94.6Very high94.9Very high128 Ų12853.5 Ų53.568%0.68425%0.247SC*.Hα-helixtrans-59.9-24.6179.6-60.6-31.9000114.5G111 R116G111-D113 VanDerWaalsContact C-N 3.29Å; G111-D113 PolarHBondContact O-N 3.36Å; D113-R116 WeakPolarHBondContact O-CG 3.38Å; D113-R116 PolarHBondContact O-NE 2.79Å; D113-R116 VanDerWaalsContact O-NE 3.14Å
114L95.9Very high94.7Very high40 Ų4063.4 Ų63.421%0.20929%0.285CS..Hα-helixtrans-95-23.7-177.1-64.6176.4000112.9G109 G111 E112 R116 Y117G109-L114 WeakPolarHBondContact O-CB 3.38Å; G111-L114 PolarHBondContact O-N 3.34Å; E112-L114 PolarHBondContact O-N 3.15Å; E112-L114 VanDerWaalsContact O-N 3.11Å; L114-R116 PolarHBondContact O-N 2.96Å; L114-Y117 HydrophobicContact CD2-CD2 4.5Å; L114-Y117 PolarHBondContact O-N 2.82Å
115R96.9Very high94.8Very high20 Ų2062.9 Ų62.98%0.07528%0.282CS..Hα-helixtrans-61.7-29.5-175.9-63.3178.3-160.9149.43.5113.1D62 G110 G111 E112 Y117 W118 R149D62-R115 IonicContact OD1-CZ 3.29Å; D62-R115 IonicContact OD1-NH2 2.84Å; D62-R115 PolarHBondContact OD1-NH2 2.8Å; G110-R115 PolarHBondContact O-NE 2.81Å; G110-R115 PolarHBondContact O-NH2 2.83Å; G111-R115 WeakPolarHBondContact O-CG 3.35Å; G111-R115 PolarHBondContact O-N 2.91Å; E112-R115 PolarHBondContact O-N 3Å; R115-Y117 PolarHBondContact O-N 3.26Å; R115-W118 HydrophobicContact CB-CD2 4.17Å; R115-W118 HydrophobicContact CB-CE3 4.27Å; R115-W118 HydrophobicContact CG-CD2 4.28Å; R115-W118 HydrophobicContact CG-CE3 4.35Å; R115-W118 HydrophobicContact CG-CH2 3.88Å; R115-W118 HydrophobicContact CG-CZ2 3.79Å; R115-W118 HydrophobicContact CG-CZ3 4.16Å; R115-W118 WeakPolarHBondContact O-CB 3.46Å; R115-W118 PolarHBondContact O-N 3.28Å; R115-R149 PolarHBondContact O-NH2 3.19Å
116R95.1Very high94.8Very high166 Ų16666.3 Ų66.363%0.62630%0.298SS*.THydrogen-bonded Turntrans-58.5-29.8175.565.6-174.9176.6179.91.7113.3D113 L114D113-R116 WeakPolarHBondContact O-CG 3.38Å; D113-R116 PolarHBondContact O-NE 2.79Å; D113-R116 VanDerWaalsContact O-NE 3.14Å; L114-R116 PolarHBondContact O-N 2.96Å
117Y94.7Very high94.7Very high95 Ų9565.7 Ų65.737%0.37330%0.295SS..THydrogen-bonded Turntrans-88.7-11-178.5-57.4-69.5000113.7L114 R115 G119 D120 Y121L114-Y117 HydrophobicContact CD2-CD2 4.5Å; L114-Y117 PolarHBondContact O-N 2.82Å; R115-Y117 PolarHBondContact O-N 3.26Å; Y117-G119 PolarHBondContact O-N 3.29Å; Y117-G119 VanDerWaalsContact O-N 3.15Å; Y117-D120 WeakPolarHBondContact O-CB 3.41Å; Y117-D120 PolarHBondContact O-N 2.93Å; Y117-Y121 VanDerWaalsContact O-CD2 3.23Å; Y117-Y121 WeakPolarHBondContact O-CD2 3.02Å
118W96.9Very high94.6Very high0 Ų065.8 Ų65.80%030%0.295CS..Hα-helixtrans-55.8-36.5-175.6-72.3-5.4000113.6L59 G60 L61 G109 R115 D120 Y121 Y130 E146 L150L59-W118 HydrophobicContact CB-CD2 4.48Å; L59-W118 HydrophobicContact CD1-CB 3.84Å; L59-W118 HydrophobicContact CD1-CD2 4.13Å; L59-W118 HydrophobicContact CD1-CE3 4.37Å; L59-W118 HydrophobicContact CD1-CG 3.97Å; L59-W118 HydrophobicContact CD2-CB 4.4Å; L59-W118 HydrophobicContact CD2-CD2 4.15Å; L59-W118 HydrophobicContact CD2-CG 3.88Å; L59-W118 HydrophobicContact CG-CG 4.49Å; G60-W118 VanDerWaalsContact C-CH2 3.5Å; G60-W118 WeakPolarHBondContact O-CH2 3.44Å; G60-W118 VanDerWaalsContact O-CZ2 3.26Å; G60-W118 WeakPolarHBondContact O-CZ2 3.37Å; L61-W118 HydrophobicContact CD2-CH2 4.44Å; G109-W118 PolarHBondContact O-NE1 2.78Å; R115-W118 HydrophobicContact CB-CD2 4.17Å; R115-W118 HydrophobicContact CB-CE3 4.27Å; R115-W118 HydrophobicContact CG-CD2 4.28Å; R115-W118 HydrophobicContact CG-CE3 4.35Å; R115-W118 HydrophobicContact CG-CH2 3.88Å; R115-W118 HydrophobicContact CG-CZ2 3.79Å; R115-W118 HydrophobicContact CG-CZ3 4.16Å; R115-W118 WeakPolarHBondContact O-CB 3.46Å; R115-W118 PolarHBondContact O-N 3.28Å; W118-D120 PolarHBondContact O-N 2.92Å; W118-Y121 PolarHBondContact O-N 2.83Å; W118-Y130 HydrophobicContact CZ3-CE2 4.24Å; W118-E146 HydrophobicContact CZ3-CB 3.89Å; W118-E146 HydrophobicContact CZ3-CG 4.2Å; W118-L150 HydrophobicContact CB-CD2 3.65Å; W118-L150 HydrophobicContact CE3-CD1 3.86Å; W118-L150 HydrophobicContact CE3-CD2 4.31Å; W118-L150 HydrophobicContact CE3-CG 4.42Å; W118-L150 HydrophobicContact CZ3-CD1 4.31Å
119G95.9Very high94.6Very high11 Ų1165.6 Ų65.611%0.11329%0.294CS..Hα-helixtrans-64.4-27.3178.900000113.6Y117 Y121 L122Y117-G119 PolarHBondContact O-N 3.29Å; Y117-G119 VanDerWaalsContact O-N 3.15Å; G119-Y121 PolarHBondContact O-N 2.93Å; G119-L122 PolarHBondContact O-N 2.86Å
120D94.7Very high94.7Very high120 Ų12065.6 Ų65.664%0.64229%0.294SS*.Hα-helixtrans-69.9-23-176.7-57.9-28.2000112Y117 W118Y117-D120 WeakPolarHBondContact O-CB 3.41Å; Y117-D120 PolarHBondContact O-N 2.93Å; W118-D120 PolarHBondContact O-N 2.92Å
121Y95.2Very high94.7Very high83 Ų8365.4 Ų65.433%0.32529%0.293SS..Hα-helixtrans-90.7-14.7-179.1-62.2-83.6000113.6L57 L106 I108 Y117 W118 G119 R123 T125L57-Y121 HydrophobicContact CD1-CG 4.35Å; L106-Y121 HydrophobicContact CD2-CD1 3.64Å; L106-Y121 HydrophobicContact CD2-CE1 4.17Å; L106-Y121 HydrophobicContact CD2-CG 4.4Å; I108-Y121 HydrophobicContact CD1-CD1 4.17Å; I108-Y121 HydrophobicContact CD1-CD2 4.08Å; I108-Y121 HydrophobicContact CD1-CE1 3.99Å; I108-Y121 HydrophobicContact CD1-CE2 3.91Å; I108-Y121 HydrophobicContact CD1-CG 4.21Å; I108-Y121 HydrophobicContact CG1-CD2 4.05Å; I108-Y121 HydrophobicContact CG1-CE2 4.22Å; I108-Y121 HydrophobicContact CG1-CG 4.34Å; Y117-Y121 VanDerWaalsContact O-CD2 3.23Å; Y117-Y121 WeakPolarHBondContact O-CD2 3.02Å; W118-Y121 PolarHBondContact O-N 2.83Å; G119-Y121 PolarHBondContact O-N 2.93Å; Y121-R123 PolarHBondContact O-N 3.24Å; Y121-T125 PolarHBondContact O-OG1 2.85Å
122L94.2Very high94.7Very high2 Ų264.4 Ų64.41%0.0128%0.281CS..G310 helixtrans-64.9-36.4-173.4-68.4172.8000113.3L57 G119 R124 T125 L128 L150 V153 E154 L157L57-L122 HydrophobicContact CD2-CD2 3.82Å; L57-L122 HydrophobicContact CD2-CG 4.47Å; G119-L122 PolarHBondContact O-N 2.86Å; L122-R124 PolarHBondContact O-N 3.44Å; L122-R124 VanDerWaalsContact O-N 3.14Å; L122-T125 VanDerWaalsContact O-CB 3.27Å; L122-T125 WeakPolarHBondContact O-CB 3.38Å; L122-T125 PolarHBondContact O-N 2.83Å; L122-L128 HydrophobicContact CD2-CD2 4.47Å; L122-L150 HydrophobicContact CD1-CB 4.23Å; L122-L150 HydrophobicContact CD1-CD2 3.96Å; L122-V153 HydrophobicContact CD1-CB 3.84Å; L122-V153 HydrophobicContact CD1-CG1 3.8Å; L122-E154 HydrophobicContact CB-CB 4.28Å; L122-E154 HydrophobicContact CD1-CB 4.38Å; L122-L157 HydrophobicContact CD2-CD2 3.62Å
123R87.8Confident94.8Very high225 Ų22557.6 Ų57.685%0.84925%0.25SC*.G310 helixtrans-64.1-23.8-172.9-61.5-168.9-158.7-1434.1115Y121Y121-R123 PolarHBondContact O-N 3.24Å
124R85.4Confident94.9Very high210 Ų21051.5 Ų51.579%0.79222%0.217SC*.G310 helixtrans-101.81179.6-64.3-176.5179.8-173.2-0.5112.4Q55 L122Q55-R124 WeakPolarHBondContact CB-O 3.41Å; Q55-R124 PolarHBondContact OE1-O 3.26Å; L122-R124 PolarHBondContact O-N 3.44Å; L122-R124 VanDerWaalsContact O-N 3.14Å
125T94.1Very high94.9Very high13 Ų1349.9 Ų49.98%0.0821%0.209CC..  trans-90.3134.9-175.5-61.20000109.8L57 Y121 L122 I127 L157L57-T125 HydrophobicContact CB-CG2 3.41Å; L57-T125 VanDerWaalsContact CB-CG2 3.41Å; L57-T125 WeakPolarHBondContact CB-OG1 3.36Å; Y121-T125 PolarHBondContact O-OG1 2.85Å; L122-T125 VanDerWaalsContact O-CB 3.27Å; L122-T125 WeakPolarHBondContact O-CB 3.38Å; L122-T125 PolarHBondContact O-N 2.83Å; T125-I127 VanDerWaalsContact CG2-C 3.43Å; T125-I127 WeakPolarHBondContact CG2-O 3.38Å; T125-L157 HydrophobicContact CG2-CD1 4.05Å; T125-L157 HydrophobicContact CG2-CD2 4.21Å; T125-L157 VanDerWaalsContact O-CD1 3.24Å; T125-L157 WeakPolarHBondContact O-CD1 3.48Å
126H94Very high94.9Very high76 Ų7650.5 Ų50.535%0.35221%0.214SC..SBendtrans-89.7-36.7173.7-60.977.9000111.3Q55 L157 P158Q55-H126 PolarHBondContact N-ND1 3.11Å; Q55-H126 WeakPolarHBondContact O-CB 3.47Å; Q55-H126 PolarHBondContact O-N 3.03Å; H126-L157 WeakPolarHBondContact O-CD1 3.49Å; H126-P158 WeakPolarHBondContact O-CD 3.32Å
127I94.3Very high94.9Very high2 Ų248.4 Ų48.41%0.0121%0.206CC..EExtended strand (participates in β ladder)trans-139.2133.4178.7-60.6167.7000109.8I56 L57 T125 V160 I219 L222 V223I56-I127 WeakPolarHBondContact CA-O 3.46Å; L57-I127 PolarHBondContact N-O 3.42Å; T125-I127 VanDerWaalsContact CG2-C 3.43Å; T125-I127 WeakPolarHBondContact CG2-O 3.38Å; I127-V160 HydrophobicContact CG2-CG2 4.2Å; I127-I219 HydrophobicContact CD1-CB 4.2Å; I127-I219 HydrophobicContact CD1-CG1 4.24Å; I127-I219 HydrophobicContact CD1-CG2 3.94Å; I127-L222 HydrophobicContact CD1-CB 3.51Å; I127-L222 HydrophobicContact CD1-CD1 4.16Å; I127-L222 HydrophobicContact CG1-CB 4.12Å; I127-L222 HydrophobicContact CG1-CD1 4.42Å; I127-L222 HydrophobicContact CG2-CD1 4.34Å; I127-V223 HydrophobicContact CD1-CG2 3.96Å
128L96.1Very high95.1Very high2 Ų248.8 Ų48.81%0.0122%0.222CC..EExtended strand (participates in β ladder)trans-93.3119.7168.9172.161.7000110.2L57 L59 L122 L150 L157 P158 V159 V160L57-L128 HydrophobicContact CB-CD1 4.42Å; L57-L128 HydrophobicContact CD2-CD1 4.41Å; L59-L128 HydrophobicContact CB-CD1 4Å; L59-L128 HydrophobicContact CD1-CD1 3.77Å; L59-L128 HydrophobicContact CG-CD1 3.81Å; L122-L128 HydrophobicContact CD2-CD2 4.47Å; L128-L150 HydrophobicContact CD2-CD1 4.42Å; L128-L157 HydrophobicContact CB-CD2 3.66Å; L128-L157 HydrophobicContact CB-CG 4.15Å; L128-P158 PolarHBondContact N-O 3.48Å; L128-V159 HydrophobicContact CB-CG1 4.47Å; L128-V159 HydrophobicContact CB-CG2 4.14Å; L128-V159 HydrophobicContact CD2-CG1 4.23Å; L128-V159 HydrophobicContact CD2-CG2 4.13Å; L128-V159 HydrophobicContact CG-CG1 4.25Å; L128-V159 CarbonylContact O-C 3.59Å; L128-V159 WeakPolarHBondContact O-CA 3.39Å; L128-V160 PolarHBondContact O-N 2.73Å
129V96.3Very high95.1Very high0 Ų051.8 Ų51.80%023%0.234CC..EExtended strand (participates in β ladder)trans-95.6113.3164.3178.10000108.4I56 L57 V58 L59 M69 V131 V160 I219I56-V129 HydrophobicContact CG2-CB 4.45Å; I56-V129 HydrophobicContact CG2-CG2 3.62Å; L57-V129 PolarHBondContact O-N 3.14Å; V58-V129 WeakPolarHBondContact CA-O 3.34Å; V58-V129 HydrophobicContact CG1-CG1 4.5Å; V58-V129 HydrophobicContact CG2-CB 4.34Å; L59-V129 PolarHBondContact N-O 3.37Å; M69-V129 HydrophobicContact CE-CG1 4.1Å; M69-V129 HydrophobicContact SD-CG1 4.21Å; V129-V131 HydrophobicContact CG1-CG2 4.13Å; V129-V160 CarbonylContact C-O 3.3Å; V129-V160 WeakPolarHBondContact CA-O 3.44Å; V129-V160 HydrophobicContact CG2-CB 4.41Å; V129-I219 HydrophobicContact CG2-CD1 4.43Å
130Y97.6Very high95.2Very high0 Ų051.8 Ų51.80%023%0.231CC..EExtended strand (participates in β ladder)trans-105.9106179.3-166.5-96.4000110.9L59 W118 V132 A143 L147 L150 V160 V161 L162L59-Y130 HydrophobicContact CB-CD2 4.16Å; W118-Y130 HydrophobicContact CZ3-CE2 4.24Å; Y130-V132 HydrophobicContact CD1-CG2 3.53Å; Y130-V132 HydrophobicContact CE1-CG2 3.57Å; Y130-A143 HydrophobicContact CE1-CB 4.47Å; Y130-A143 WeakPolarHBondContact OH-CA 3.44Å; Y130-A143 PolarHBondContact OH-O 2.91Å; Y130-L147 HydrophobicContact CD1-CB 4.24Å; Y130-L147 HydrophobicContact CD1-CD1 4.05Å; Y130-L147 HydrophobicContact CD1-CD2 4.13Å; Y130-L147 HydrophobicContact CD1-CG 4.36Å; Y130-L147 HydrophobicContact CD2-CD1 4.03Å; Y130-L147 HydrophobicContact CE1-CB 3.88Å; Y130-L147 HydrophobicContact CE1-CD2 4.37Å; Y130-L147 HydrophobicContact CE1-CG 4.47Å; Y130-L147 HydrophobicContact CE2-CB 4.23Å; Y130-L147 HydrophobicContact CE2-CD1 4.5Å; Y130-L147 HydrophobicContact CG-CD1 3.8Å; Y130-L150 HydrophobicContact CD2-CD1 4.19Å; Y130-L150 HydrophobicContact CE2-CD1 4.02Å; Y130-V160 PolarHBondContact N-O 3.08Å; Y130-V161 WeakPolarHBondContact O-CA 3.41Å; Y130-L162 PolarHBondContact O-N 3.19Å
131V97.2Very high95.4Very high1 Ų150.4 Ų50.41%0.00623%0.228CC..EExtended strand (participates in β ladder)trans-90.4127.7-176.1-171.40000110.8V58 L59 G60 A64 K66 M69 V129 L162 N164V58-V131 HydrophobicContact CG1-CG2 3.99Å; L59-V131 PolarHBondContact O-N 3.34Å; G60-V131 WeakPolarHBondContact CA-O 3.49Å; A64-V131 HydrophobicContact CB-CB 4.45Å; A64-V131 HydrophobicContact CB-CG1 4.2Å; A64-V131 WeakPolarHBondContact CB-O 3.49Å; K66-V131 HydrophobicContact CG-CB 3.88Å; K66-V131 HydrophobicContact CG-CG2 3.93Å; M69-V131 HydrophobicContact SD-CG2 4.04Å; V129-V131 HydrophobicContact CG1-CG2 4.13Å; V131-L162 HydrophobicContact CG2-CB 4.49Å; V131-L162 HydrophobicContact CG2-CD2 4.42Å; V131-N164 HydrophobicContact CG1-CB 3.92Å
132V97.4Very high95.5Very high4 Ų449.6 Ų49.62%0.02423%0.23CC..EExtended strand (participates in β ladder)trans-121.8132.2-178.1-172.30000109.7Y130 S134 L140 A143 V161 L162 N164 L177 L181Y130-V132 HydrophobicContact CD1-CG2 3.53Å; Y130-V132 HydrophobicContact CE1-CG2 3.57Å; V132-S134 PolarHBondContact O-N 3.04Å; V132-S134 VanDerWaalsContact O-N 3.13Å; V132-L140 HydrophobicContact CG1-CD2 3.65Å; V132-A143 HydrophobicContact CG1-CB 4.44Å; V132-V161 HydrophobicContact CG2-CG1 4.11Å; V132-L162 PolarHBondContact N-O 2.81Å; V132-N164 WeakPolarHBondContact O-CB 3.13Å; V132-N164 PolarHBondContact O-N 3.24Å; V132-L177 HydrophobicContact CG1-CD1 4.11Å; V132-L181 HydrophobicContact CG2-CD1 4.09Å
133D96.4Very high95.7Very high12 Ų1249.7 Ų49.76%0.06423%0.231CC..EExtended strand (participates in β ladder)trans-73.3101.3167.1-173-18.9000108.6S135 D136 K165 K168D133-S135 PolarHBondContact O-N 3.21Å; D133-S135 VanDerWaalsContact O-N 3.14Å; D133-S135 WeakPolarHBondContact OD1-CA 3.26Å; D133-S135 WeakPolarHBondContact OD1-CB 3.46Å; D133-S135 PolarHBondContact OD1-N 3.42Å; D133-S135 PolarHBondContact OD1-OG 2.92Å; D133-D136 HydrophobicContact CB-CB 3.9Å; D133-D136 PolarHBondContact O-N 3.3Å; D133-D136 VanDerWaalsContact O-N 3.12Å; D133-D136 PolarHBondContact OD1-N 3.49Å; D133-K165 WeakPolarHBondContact OD1-CD 3.41Å; D133-K165 WeakPolarHBondContact OD2-CD 3.37Å; D133-K165 WeakPolarHBondContact OD2-CE 3.44Å; D133-K165 IonicContact OD2-NZ 3.05Å; D133-K165 PolarHBondContact OD2-NZ 2.78Å; D133-K168 IonicContact OD2-NZ 2.54Å
134S96.4Very high96.2Very high0 Ų042.3 Ų42.30%021%0.205CC..THydrogen-bonded Turntrans-65.3-13.6-179.666.50000113.2V132 N164 Q166 A171 L172V132-S134 PolarHBondContact O-N 3.04Å; V132-S134 VanDerWaalsContact O-N 3.13Å; S134-N164 VanDerWaalsContact CB-O 3.29Å; S134-N164 WeakPolarHBondContact CB-O 3.5Å; S134-N164 PolarHBondContact N-O 2.96Å; S134-N164 PolarHBondContact OG-O 3.12Å; S134-Q166 PolarHBondContact OG-NE2 3.33Å; S134-Q166 VanDerWaalsContact OG-NE2 3.17Å; S134-A171 CarbonylContact O-C 3.57Å; S134-A171 WeakPolarHBondContact O-CA 3.24Å; S134-A171 WeakPolarHBondContact OG-CB 3.45Å; S134-L172 WeakPolarHBondContact O-CD1 3.31Å; S134-L172 PolarHBondContact O-N 3Å
135S96.1Very high96.8Very high6 Ų635 Ų354%0.04219%0.189CC..THydrogen-bonded Turntrans-90.6-17.8176.274.90000113.2D133 R137 K168 N170D133-S135 PolarHBondContact O-N 3.21Å; D133-S135 VanDerWaalsContact O-N 3.14Å; D133-S135 WeakPolarHBondContact OD1-CA 3.26Å; D133-S135 WeakPolarHBondContact OD1-CB 3.46Å; D133-S135 PolarHBondContact OD1-N 3.42Å; D133-S135 PolarHBondContact OD1-OG 2.92Å; S135-R137 VanDerWaalsContact C-N 3.34Å; S135-R137 PolarHBondContact O-N 2.84Å; S135-R137 VanDerWaalsContact O-N 3.09Å; S135-K168 WeakPolarHBondContact OG-CD 3.3Å; S135-K168 PolarHBondContact OG-NZ 3.2Å; S135-N170 WeakPolarHBondContact CB-OD1 3.45Å; S135-N170 PolarHBondContact O-ND2 3.27Å
136D96.7Very high97Very high32 Ų3235.9 Ų35.917%0.17119%0.192CC..  trans-92.269-173-164.3-16.5000111.9D133 S138 R139 L140D133-D136 HydrophobicContact CB-CB 3.9Å; D133-D136 PolarHBondContact O-N 3.3Å; D133-D136 VanDerWaalsContact O-N 3.12Å; D133-D136 PolarHBondContact OD1-N 3.49Å; D136-S138 PolarHBondContact O-N 2.92Å; D136-S138 VanDerWaalsContact O-N 3.1Å; D136-S138 PolarHBondContact OD1-OG 3.28Å; D136-R139 PolarHBondContact O-N 2.82Å; D136-R139 VanDerWaalsContact O-N 3.08Å; D136-R139 PolarHBondContact OD1-N 2.84Å; D136-R139 IonicContact OD2-CZ 3.36Å; D136-R139 IonicContact OD2-NE 2.82Å; D136-R139 PolarHBondContact OD2-NE 3.49Å; D136-R139 IonicContact OD2-NH2 2.84Å; D136-R139 PolarHBondContact OD2-NH2 3.05Å; D136-L140 PolarHBondContact O-N 2.86Å
137R96.2Very high97.2Very high123 Ų12332.2 Ų32.246%0.46418%0.175SC..THydrogen-bonded Turntrans-52.6-33.2179.7-74.9177.1-174.4-110.10.7113S135 R139 L140 N170 L172 E176S135-R137 VanDerWaalsContact C-N 3.34Å; S135-R137 PolarHBondContact O-N 2.84Å; S135-R137 VanDerWaalsContact O-N 3.09Å; R137-R139 VanDerWaalsContact C-N 3.33Å; R137-R139 PolarHBondContact O-N 3.02Å; R137-L140 HydrophobicContact CG-CD1 4.33Å; R137-N170 PolarHBondContact NE-O 2.9Å; R137-L172 HydrophobicContact CG-CD1 3.53Å; R137-E176 IonicContact CZ-OE1 2.79Å; R137-E176 IonicContact NH1-OE1 3.16Å; R137-E176 IonicContact NH2-OE1 2.68Å; R137-E176 PolarHBondContact NH2-OE1 2.83Å
138S97.5Very high97.3Very high102 Ų10234.1 Ų34.171%0.71318%0.184SC*.THydrogen-bonded Turntrans-66.2-33.3-178.676.70000113.3D136D136-S138 PolarHBondContact O-N 2.92Å; D136-S138 VanDerWaalsContact O-N 3.1Å; D136-S138 PolarHBondContact OD1-OG 3.28Å
139R97.8Very high97.3Very high64 Ų6437.2 Ų37.224%0.24220%0.196CC..THydrogen-bonded Turntrans-100.9-1.6-178-66.7-165.5-66.1157.67113.9L61 D62 D136 R137 L142 A143L61-R139 HydrophobicContact CD1-CB 3.94Å; D62-R139 PolarHBondContact O-NH1 2.87Å; D62-R139 PolarHBondContact O-NH2 3.11Å; D62-R139 IonicContact OD1-NH1 3.96Å; D62-R139 IonicContact OD2-NH1 3.34Å; D62-R139 PolarHBondContact OD2-NH1 3.43Å; D136-R139 PolarHBondContact O-N 2.82Å; D136-R139 VanDerWaalsContact O-N 3.08Å; D136-R139 PolarHBondContact OD1-N 2.84Å; D136-R139 IonicContact OD2-CZ 3.36Å; D136-R139 IonicContact OD2-NE 2.82Å; D136-R139 PolarHBondContact OD2-NE 3.49Å; D136-R139 IonicContact OD2-NH2 2.84Å; D136-R139 PolarHBondContact OD2-NH2 3.05Å; R137-R139 VanDerWaalsContact C-N 3.33Å; R137-R139 PolarHBondContact O-N 3.02Å; R139-L142 WeakPolarHBondContact O-CB 3.33Å; R139-L142 PolarHBondContact O-N 2.74Å; R139-L142 VanDerWaalsContact O-N 3.11Å; R139-A143 PolarHBondContact O-N 3.41Å
140L97.8Very high97.3Very high11 Ų1137.3 Ų37.36%0.05820%0.196CC..Hα-helixtrans-55.1-42.3174.5-75.2175.2000113.8V132 D136 R137 L142 A143 K144 L172 L177 A180 L181V132-L140 HydrophobicContact CG1-CD2 3.65Å; D136-L140 PolarHBondContact O-N 2.86Å; R137-L140 HydrophobicContact CG-CD1 4.33Å; L140-L142 VanDerWaalsContact C-N 3.26Å; L140-L142 PolarHBondContact O-N 3.31Å; L140-A143 PolarHBondContact O-N 3.42Å; L140-K144 WeakPolarHBondContact O-CB 3.3Å; L140-K144 PolarHBondContact O-N 3.33Å; L140-L172 HydrophobicContact CD1-CD1 3.84Å; L140-L172 HydrophobicContact CD1-CD2 3.54Å; L140-L172 HydrophobicContact CD1-CG 4.41Å; L140-L177 HydrophobicContact CD2-CD1 3.82Å; L140-A180 HydrophobicContact CD1-CB 4.01Å; L140-L181 HydrophobicContact CD2-CD2 4.42Å
141P98.4Very high97.1Very high90 Ų9037.7 Ų37.758%0.58420%0.198SC*.Hα-helixtrans-59.9-37.4176.5-25.735.9000112.9A145P141-A145 WeakPolarHBondContact O-CB 3.24Å; P141-A145 PolarHBondContact O-N 2.94Å
142L98.4Very high96.9Very high67 Ų6746.3 Ų46.335%0.35123%0.231SC..Hα-helixtrans-70.6-42.5176.4179.959.3000111.6L61 R139 L140 K144 A145 E146L61-L142 HydrophobicContact CD1-CB 4.32Å; L61-L142 HydrophobicContact CD1-CD2 4.25Å; L61-L142 HydrophobicContact CD1-CG 4.18Å; L61-L142 HydrophobicContact CD2-CD2 4.45Å; L61-L142 HydrophobicContact CD2-CG 4.19Å; R139-L142 WeakPolarHBondContact O-CB 3.33Å; R139-L142 PolarHBondContact O-N 2.74Å; R139-L142 VanDerWaalsContact O-N 3.11Å; L140-L142 VanDerWaalsContact C-N 3.26Å; L140-L142 PolarHBondContact O-N 3.31Å; L142-K144 VanDerWaalsContact C-N 3.34Å; L142-K144 PolarHBondContact O-N 2.94Å; L142-A145 PolarHBondContact O-N 2.88Å; L142-E146 HydrophobicContact CD1-CG 4.45Å; L142-E146 PolarHBondContact O-N 2.89Å
143A98.4Very high96.7Very high4 Ų449.8 Ų49.83%0.03325%0.251CS..Hα-helixtrans-60.1-45.7175.200000111L61 Y130 V132 R139 L140 E146 L147 L181L61-A143 HydrophobicContact CD1-CB 3.86Å; L61-A143 HydrophobicContact CG-CB 4.17Å; Y130-A143 HydrophobicContact CE1-CB 4.47Å; Y130-A143 WeakPolarHBondContact OH-CA 3.44Å; Y130-A143 PolarHBondContact OH-O 2.91Å; V132-A143 HydrophobicContact CG1-CB 4.44Å; R139-A143 PolarHBondContact O-N 3.41Å; L140-A143 PolarHBondContact O-N 3.42Å; A143-E146 PolarHBondContact O-N 3.44Å; A143-L147 WeakPolarHBondContact O-CB 3.26Å; A143-L147 PolarHBondContact O-N 3.2Å; A143-L181 HydrophobicContact CB-CD2 4.43Å
144K98.3Very high96.5Very high69 Ų6951.9 Ų51.930%0.326%0.261SS..Hα-helixtrans-55.9-52.6172.3174.3179.1167.21790111.3L140 L142 E146 L147 H148 A180 L181 S182L140-K144 WeakPolarHBondContact O-CB 3.3Å; L140-K144 PolarHBondContact O-N 3.33Å; L142-K144 VanDerWaalsContact C-N 3.34Å; L142-K144 PolarHBondContact O-N 2.94Å; K144-E146 VanDerWaalsContact C-N 3.3Å; K144-E146 PolarHBondContact O-N 3.3Å; K144-L147 PolarHBondContact O-N 3.31Å; K144-H148 WeakPolarHBondContact O-CB 3.42Å; K144-H148 PolarHBondContact O-CD2 2.76Å; K144-H148 PolarHBondContact O-N 2.79Å; K144-A180 WeakPolarHBondContact CD-O 3.47Å; K144-L181 HydrophobicContact CB-CD2 4.09Å; K144-S182 WeakPolarHBondContact CE-OG 3.4Å; K144-S182 PolarHBondContact NZ-OG 3.05Å
145A98.2Very high96.2Very high56 Ų5655.3 Ų55.346%0.46328%0.283SS..Hα-helixtrans-58.4-42.8-177.200000112.2P141 L142 R149P141-A145 WeakPolarHBondContact O-CB 3.24Å; P141-A145 PolarHBondContact O-N 2.94Å; L142-A145 PolarHBondContact O-N 2.88Å; A145-R149 WeakPolarHBondContact O-CB 3.39Å; A145-R149 PolarHBondContact O-N 2.88Å
146E98.3Very high95.9Very high32 Ų3262.6 Ų62.615%0.1532%0.317CS..Hα-helixtrans-68.7-44.2176.7-71.5-65.8169.300112.7L61 W118 L142 A143 K144 H148 R149 L150L61-E146 HydrophobicContact CD2-CG 4.4Å; W118-E146 HydrophobicContact CZ3-CB 3.89Å; W118-E146 HydrophobicContact CZ3-CG 4.2Å; L142-E146 HydrophobicContact CD1-CG 4.45Å; L142-E146 PolarHBondContact O-N 2.89Å; A143-E146 PolarHBondContact O-N 3.44Å; K144-E146 VanDerWaalsContact C-N 3.3Å; K144-E146 PolarHBondContact O-N 3.3Å; E146-H148 PolarHBondContact O-N 3.19Å; E146-R149 WeakPolarHBondContact O-CB 3.42Å; E146-R149 PolarHBondContact O-N 2.7Å; E146-R149 VanDerWaalsContact O-N 3.16Å; E146-R149 IonicContact OE2-CZ 3.78Å; E146-R149 VanDerWaalsContact OE2-CZ 3.29Å; E146-R149 IonicContact OE2-NE 3.84Å; E146-R149 PolarHBondContact OE2-NE 2.93Å; E146-R149 IonicContact OE2-NH2 3.97Å; E146-R149 PolarHBondContact OE2-NH2 3.11Å; E146-L150 VanDerWaalsContact O-CG 3.32Å; E146-L150 WeakPolarHBondContact O-CG 3.42Å; E146-L150 PolarHBondContact O-N 3.31Å
147L97.6Very high95.6Very high0 Ų061.6 Ų61.60%031%0.311CS..Hα-helixtrans-56.4-52.8175.4175.657.9000110.4Y130 A143 K144 R149 L150 L151 V159 V161 L183Y130-L147 HydrophobicContact CD1-CB 4.24Å; Y130-L147 HydrophobicContact CD1-CD1 4.05Å; Y130-L147 HydrophobicContact CD1-CD2 4.13Å; Y130-L147 HydrophobicContact CD1-CG 4.36Å; Y130-L147 HydrophobicContact CD2-CD1 4.03Å; Y130-L147 HydrophobicContact CE1-CB 3.88Å; Y130-L147 HydrophobicContact CE1-CD2 4.37Å; Y130-L147 HydrophobicContact CE1-CG 4.47Å; Y130-L147 HydrophobicContact CE2-CB 4.23Å; Y130-L147 HydrophobicContact CE2-CD1 4.5Å; Y130-L147 HydrophobicContact CG-CD1 3.8Å; A143-L147 WeakPolarHBondContact O-CB 3.26Å; A143-L147 PolarHBondContact O-N 3.2Å; K144-L147 PolarHBondContact O-N 3.31Å; L147-R149 PolarHBondContact O-N 3.11Å; L147-L150 WeakPolarHBondContact O-CB 3.21Å; L147-L150 PolarHBondContact O-N 2.79Å; L147-L151 HydrophobicContact CD1-CD1 3.86Å; L147-L151 HydrophobicContact CD1-CD2 4.29Å; L147-L151 HydrophobicContact CD1-CG 3.97Å; L147-L151 HydrophobicContact CG-CD1 3.71Å; L147-L151 HydrophobicContact CG-CG 4.31Å; L147-L151 WeakPolarHBondContact O-CG 3.38Å; L147-L151 PolarHBondContact O-N 2.83Å; L147-V159 HydrophobicContact CD1-CG1 4.4Å; L147-V161 HydrophobicContact CD2-CG2 4.19Å; L147-L183 HydrophobicContact CD2-CD2 3.85Å
148H96.6Very high95.5Very high41 Ų4156.9 Ų56.919%0.1930%0.296CS..Hα-helixtrans-62.6-29.2178.2-79-107.6000113.1K144 E146 R152 L181 S182 V186K144-H148 WeakPolarHBondContact O-CB 3.42Å; K144-H148 PolarHBondContact O-CD2 2.76Å; K144-H148 PolarHBondContact O-N 2.79Å; E146-H148 PolarHBondContact O-N 3.19Å; H148-R152 WeakPolarHBondContact O-CG 3.41Å; H148-R152 PolarHBondContact O-N 2.59Å; H148-R152 PolarHBondContact O-NE 3.28Å; H148-L181 PolarHBondContact NE2-O 2.78Å; H148-S182 PolarHBondContact CE1-O 2.79Å; H148-S182 PolarHBondContact NE2-O 2.72Å; H148-V186 VanDerWaalsContact CE1-CG2 3.49Å; H148-V186 WeakPolarHBondContact CE1-CG2 3.33Å
149R96.1Very high95.3Very high68 Ų6852 Ų5226%0.25726%0.262SS..Hα-helixtrans-66.5-46.5171-174-174.466.686.4-3.5111.4R115 A145 E146 L147 R152 V153R115-R149 PolarHBondContact O-NH2 3.19Å; A145-R149 WeakPolarHBondContact O-CB 3.39Å; A145-R149 PolarHBondContact O-N 2.88Å; E146-R149 WeakPolarHBondContact O-CB 3.42Å; E146-R149 PolarHBondContact O-N 2.7Å; E146-R149 VanDerWaalsContact O-N 3.16Å; E146-R149 IonicContact OE2-CZ 3.78Å; E146-R149 VanDerWaalsContact OE2-CZ 3.29Å; E146-R149 IonicContact OE2-NE 3.84Å; E146-R149 PolarHBondContact OE2-NE 2.93Å; E146-R149 IonicContact OE2-NH2 3.97Å; E146-R149 PolarHBondContact OE2-NH2 3.11Å; L147-R149 PolarHBondContact O-N 3.11Å; R149-R152 PolarHBondContact O-N 3.06Å; R149-V153 WeakPolarHBondContact O-CG2 3.46Å; R149-V153 PolarHBondContact O-N 2.96Å
150L95.9Very high95.1Very high2 Ų249 Ų491%0.0125%0.251CS..Hα-helixtrans-63.8-43.6178.8-64.1168.1000111.8L59 W118 L122 L128 Y130 E146 L147 R152 V153 E154L59-L150 HydrophobicContact CD1-CD1 3.6Å; L59-L150 HydrophobicContact CD1-CD2 4.07Å; L59-L150 HydrophobicContact CD1-CG 4.48Å; W118-L150 HydrophobicContact CB-CD2 3.65Å; W118-L150 HydrophobicContact CE3-CD1 3.86Å; W118-L150 HydrophobicContact CE3-CD2 4.31Å; W118-L150 HydrophobicContact CE3-CG 4.42Å; W118-L150 HydrophobicContact CZ3-CD1 4.31Å; L122-L150 HydrophobicContact CD1-CB 4.23Å; L122-L150 HydrophobicContact CD1-CD2 3.96Å; L128-L150 HydrophobicContact CD2-CD1 4.42Å; Y130-L150 HydrophobicContact CD2-CD1 4.19Å; Y130-L150 HydrophobicContact CE2-CD1 4.02Å; E146-L150 VanDerWaalsContact O-CG 3.32Å; E146-L150 WeakPolarHBondContact O-CG 3.42Å; E146-L150 PolarHBondContact O-N 3.31Å; L147-L150 WeakPolarHBondContact O-CB 3.21Å; L147-L150 PolarHBondContact O-N 2.79Å; L150-R152 PolarHBondContact O-N 2.85Å; L150-V153 WeakPolarHBondContact O-CB 3.32Å; L150-V153 PolarHBondContact O-N 2.78Å; L150-E154 PolarHBondContact O-N 3.28Å; L150-E154 VanDerWaalsContact O-N 3.15Å
151L93.2Very high95Very high8 Ų848.4 Ų48.44%0.04225%0.248CC..Hα-helixtrans-62.5-31179.8-65.3167.2000112.7L147 E154 P155 V159 V186 R190L147-L151 HydrophobicContact CD1-CD1 3.86Å; L147-L151 HydrophobicContact CD1-CD2 4.29Å; L147-L151 HydrophobicContact CD1-CG 3.97Å; L147-L151 HydrophobicContact CG-CD1 3.71Å; L147-L151 HydrophobicContact CG-CG 4.31Å; L147-L151 WeakPolarHBondContact O-CG 3.38Å; L147-L151 PolarHBondContact O-N 2.83Å; L151-E154 CarbonylContact O-C 3.58Å; L151-E154 VanDerWaalsContact O-C 3.3Å; L151-P155 WeakPolarHBondContact O-CA 3.4Å; L151-V159 HydrophobicContact CD2-CB 4.41Å; L151-V159 HydrophobicContact CD2-CG2 3.49Å; L151-V159 VanDerWaalsContact CD2-CG2 3.49Å; L151-V186 HydrophobicContact CD1-CB 4.22Å; L151-V186 HydrophobicContact CD1-CG1 3.41Å; L151-V186 VanDerWaalsContact CD1-CG1 3.41Å; L151-V186 HydrophobicContact CD1-CG2 3.7Å; L151-V186 HydrophobicContact CD2-CG1 4.07Å; L151-V186 HydrophobicContact CG-CG1 4.25Å; L151-R190 VanDerWaalsContact CD2-CZ 3.48Å; L151-R190 PolarHBondContact O-NH2 3.27Å
152R92.6Very high94.8Very high182 Ų18244.2 Ų44.269%0.68722%0.221SC*.Hα-helixtrans-72.7-30.5173.1-76.5178.8-72.3152.3-7.4113.1H148 R149 L150H148-R152 WeakPolarHBondContact O-CG 3.41Å; H148-R152 PolarHBondContact O-N 2.59Å; H148-R152 PolarHBondContact O-NE 3.28Å; R149-R152 PolarHBondContact O-N 3.06Å; L150-R152 PolarHBondContact O-N 2.85Å
153V93.3Very high94.7Very high76 Ų7641 Ų4146%0.46120%0.204SC..Hα-helixtrans-71.1-41178174.30000110.5L122 R149 L150L122-V153 HydrophobicContact CD1-CB 3.84Å; L122-V153 HydrophobicContact CD1-CG1 3.8Å; R149-V153 WeakPolarHBondContact O-CG2 3.46Å; R149-V153 PolarHBondContact O-N 2.96Å; L150-V153 WeakPolarHBondContact O-CB 3.32Å; L150-V153 PolarHBondContact O-N 2.78Å
154E92.6Very high94.4Very high57 Ų5741.1 Ų41.127%0.26620%0.204SC..  trans-128.792.7175.9-171.452.6-109.800111.3L122 L150 L151 Q156 L157 R190L122-E154 HydrophobicContact CB-CB 4.28Å; L122-E154 HydrophobicContact CD1-CB 4.38Å; L150-E154 PolarHBondContact O-N 3.28Å; L150-E154 VanDerWaalsContact O-N 3.15Å; L151-E154 CarbonylContact O-C 3.58Å; L151-E154 VanDerWaalsContact O-C 3.3Å; E154-Q156 VanDerWaalsContact C-N 3.31Å; E154-Q156 PolarHBondContact O-N 3.28Å; E154-L157 HydrophobicContact CB-CB 4.08Å; E154-L157 HydrophobicContact CG-CB 3.51Å; E154-L157 HydrophobicContact CG-CD2 4.47Å; E154-R190 PolarHBondContact O-NH1 3.49Å
155P89.6Confident94.1Very high72 Ų7239.9 Ų39.947%0.46820%0.199SC..THydrogen-bonded Turntrans-62.9-30-175.7-2837.7000115.4L151 R190L151-P155 WeakPolarHBondContact O-CA 3.4Å; P155-R190 PolarHBondContact O-NE 3.11Å; P155-R190 PolarHBondContact O-NH1 3.27Å; P155-R190 PolarHBondContact O-NH2 2.77Å
156Q89.5Confident93.7Very high159 Ų15939.8 Ų39.874%0.74319%0.189SC*.THydrogen-bonded Turntrans-98.3-9.3-172.2-65-173.7-2400113.5E154 P158E154-Q156 VanDerWaalsContact C-N 3.31Å; E154-Q156 PolarHBondContact O-N 3.28Å; Q156-P158 VanDerWaalsContact O-CD 3.26Å; Q156-P158 WeakPolarHBondContact O-CD 3.37Å
157L91.8Very high93.1Very high10 Ų1042 Ų425%0.05220%0.201CC..  trans-63.4122-177.4-175.764.9000110.9L122 T125 H126 L128 E154 V159 R190L122-L157 HydrophobicContact CD2-CD2 3.62Å; T125-L157 HydrophobicContact CG2-CD1 4.05Å; T125-L157 HydrophobicContact CG2-CD2 4.21Å; T125-L157 VanDerWaalsContact O-CD1 3.24Å; T125-L157 WeakPolarHBondContact O-CD1 3.48Å; H126-L157 WeakPolarHBondContact O-CD1 3.49Å; L128-L157 HydrophobicContact CB-CD2 3.66Å; L128-L157 HydrophobicContact CB-CG 4.15Å; E154-L157 HydrophobicContact CB-CB 4.08Å; E154-L157 HydrophobicContact CG-CB 3.51Å; E154-L157 HydrophobicContact CG-CD2 4.47Å; L157-V159 VanDerWaalsContact O-CG2 3.3Å; L157-V159 WeakPolarHBondContact O-CG2 3.23Å; L157-R190 PolarHBondContact O-NH1 3.01Å; L157-R190 VanDerWaalsContact O-NH1 3.17Å
158P93.2Very high92.7Very high24 Ų2445.7 Ų45.716%0.15622%0.218CC..  trans-59.4138.2170.2-24.435.1000111.4H126 L128 Q156 K191 L222H126-P158 WeakPolarHBondContact O-CD 3.32Å; L128-P158 PolarHBondContact N-O 3.48Å; Q156-P158 VanDerWaalsContact O-CD 3.26Å; Q156-P158 WeakPolarHBondContact O-CD 3.37Å; P158-K191 WeakPolarHBondContact CA-O 3.37Å; P158-K191 HydrophobicContact CB-CB 4.35Å; P158-L222 HydrophobicContact CB-CD1 4.12Å; P158-L222 HydrophobicContact CB-CD2 3.98Å; P158-L222 HydrophobicContact CG-CD2 4.49Å
159V93.7Very high92.3Very high0 Ų052.7 Ų52.70%026%0.255CS..EExtended strand (participates in β ladder)trans-128130.8-175.8-1750000111.7L128 L147 L151 L157 V161 K191 L192 F193L128-V159 HydrophobicContact CB-CG1 4.47Å; L128-V159 HydrophobicContact CB-CG2 4.14Å; L128-V159 HydrophobicContact CD2-CG1 4.23Å; L128-V159 HydrophobicContact CD2-CG2 4.13Å; L128-V159 HydrophobicContact CG-CG1 4.25Å; L128-V159 CarbonylContact O-C 3.59Å; L128-V159 WeakPolarHBondContact O-CA 3.39Å; L147-V159 HydrophobicContact CD1-CG1 4.4Å; L151-V159 HydrophobicContact CD2-CB 4.41Å; L151-V159 HydrophobicContact CD2-CG2 3.49Å; L151-V159 VanDerWaalsContact CD2-CG2 3.49Å; L157-V159 VanDerWaalsContact O-CG2 3.3Å; L157-V159 WeakPolarHBondContact O-CG2 3.23Å; V159-V161 HydrophobicContact CG1-CG2 4.05Å; V159-K191 PolarHBondContact N-O 2.6Å; V159-L192 WeakPolarHBondContact O-CA 3.29Å; V159-F193 PolarHBondContact O-N 2.89Å
160V94.3Very high92.1Very high0 Ų053.3 Ų53.30%026%0.264CS..EExtended strand (participates in β ladder)trans-108.9111.1168.1-177.90000108I127 L128 V129 Y130 F193 L195 L222I127-V160 HydrophobicContact CG2-CG2 4.2Å; L128-V160 PolarHBondContact O-N 2.73Å; V129-V160 CarbonylContact C-O 3.3Å; V129-V160 WeakPolarHBondContact CA-O 3.44Å; V129-V160 HydrophobicContact CG2-CB 4.41Å; Y130-V160 PolarHBondContact N-O 3.08Å; V160-F193 CarbonylContact C-O 3.55Å; V160-F193 WeakPolarHBondContact CA-O 3.47Å; V160-L195 HydrophobicContact CG1-CD1 3.85Å; V160-L195 HydrophobicContact CG1-CG 4.45Å; V160-L222 HydrophobicContact CG2-CD1 4.02Å
161V95.4Very high92Very high0 Ų054.1 Ų54.10%027%0.271CS..EExtended strand (participates in β ladder)trans-88.6123.3173.1-177.90000108.7Y130 V132 L147 V159 L181 L183 F193 L194 L195Y130-V161 WeakPolarHBondContact O-CA 3.41Å; V132-V161 HydrophobicContact CG2-CG1 4.11Å; L147-V161 HydrophobicContact CD2-CG2 4.19Å; V159-V161 HydrophobicContact CG1-CG2 4.05Å; V161-L181 HydrophobicContact CG1-CD1 3.76Å; V161-L183 HydrophobicContact CG2-CD1 4.45Å; V161-F193 PolarHBondContact N-O 3.42Å; V161-L194 HydrophobicContact CB-CD1 3.75Å; V161-L194 HydrophobicContact CG1-CD1 3.58Å; V161-L194 WeakPolarHBondContact O-CA 3.48Å; V161-L195 PolarHBondContact O-N 2.53Å
162L94.7Very high92.1Very high2 Ų254 Ų541%0.0127%0.27CS..EExtended strand (participates in β ladder)trans-110.7103.9179.4-172.167.5000110.6M69 Y130 V131 V132 N164 L195 A197 V215M69-L162 HydrophobicContact CE-CD2 4.07Å; M69-L162 HydrophobicContact CG-CD2 4Å; M69-L162 HydrophobicContact SD-CD2 3.59Å; M69-L162 VanDerWaalsContact SD-CD2 3.59Å; Y130-L162 PolarHBondContact O-N 3.19Å; V131-L162 HydrophobicContact CG2-CB 4.49Å; V131-L162 HydrophobicContact CG2-CD2 4.42Å; V132-L162 PolarHBondContact N-O 2.81Å; L162-N164 PolarHBondContact O-N 2.91Å; L162-N164 VanDerWaalsContact O-N 3.09Å; L162-L195 CarbonylContact C-O 3.57Å; L162-L195 HydrophobicContact CD1-CB 3.92Å; L162-A197 HydrophobicContact CD1-CB 3.58Å; L162-A197 HydrophobicContact CG-CB 4.37Å; L162-V215 HydrophobicContact CD1-CG2 4.37Å
163G95.3Very high92.1Very high0 Ų047.8 Ų47.80%026%0.255CS..EExtended strand (participates in β ladder)trans-73.988.6169.200000111.3Q166 L195 A196 A197G163-Q166 WeakPolarHBondContact O-CG 3.18Å; G163-Q166 PolarHBondContact O-NE2 3.2Å; G163-L195 PolarHBondContact N-O 2.99Å; G163-A196 WeakPolarHBondContact O-CA 3.11Å; G163-A197 PolarHBondContact O-N 3.13Å
164N93.1Very high92Very high6 Ų647.6 Ų47.63%0.03225%0.253CS..EExtended strand (participates in β ladder)trans-83165.4-177.1-169.430.7000112.5A64 V131 V132 S134 L162 A197A64-N164 PolarHBondContact O-ND2 3.14Å; V131-N164 HydrophobicContact CG1-CB 3.92Å; V132-N164 WeakPolarHBondContact O-CB 3.13Å; V132-N164 PolarHBondContact O-N 3.24Å; S134-N164 VanDerWaalsContact CB-O 3.29Å; S134-N164 WeakPolarHBondContact CB-O 3.5Å; S134-N164 PolarHBondContact N-O 2.96Å; S134-N164 PolarHBondContact OG-O 3.12Å; L162-N164 PolarHBondContact O-N 2.91Å; L162-N164 VanDerWaalsContact O-N 3.09Å; N164-A197 WeakPolarHBondContact CA-O 3.46Å
165K91.4Very high92Very high42 Ų4248.4 Ų48.418%0.18327%0.27CS..  trans68.237.9177.5-43.6-164.2-164.6170.40115.3G63 D133 D167 K168 A197G63-K165 VanDerWaalsContact O-CE 3.26Å; G63-K165 WeakPolarHBondContact O-CE 3.18Å; G63-K165 PolarHBondContact O-NZ 3.45Å; D133-K165 WeakPolarHBondContact OD1-CD 3.41Å; D133-K165 WeakPolarHBondContact OD2-CD 3.37Å; D133-K165 WeakPolarHBondContact OD2-CE 3.44Å; D133-K165 IonicContact OD2-NZ 3.05Å; D133-K165 PolarHBondContact OD2-NZ 2.78Å; K165-D167 VanDerWaalsContact CA-OD1 3.23Å; K165-D167 WeakPolarHBondContact CA-OD1 3.49Å; K165-D167 PolarHBondContact O-N 2.83Å; K165-D167 VanDerWaalsContact O-N 3.15Å; K165-K168 HydrophobicContact CB-CD 4.09Å; K165-K168 HydrophobicContact CD-CD 4.36Å; K165-K168 PolarHBondContact O-N 3.09Å; K165-A197 PolarHBondContact N-O 2.92Å
166Q89Confident92.3Very high55 Ų5548.4 Ų48.426%0.25726%0.263SS..THydrogen-bonded Turntrans-65.3-8.2176.3-65.4-68.5-30.600113.9S134 G163 K168 L172 A196 A197 Q198S134-Q166 PolarHBondContact OG-NE2 3.33Å; S134-Q166 VanDerWaalsContact OG-NE2 3.17Å; G163-Q166 WeakPolarHBondContact O-CG 3.18Å; G163-Q166 PolarHBondContact O-NE2 3.2Å; Q166-K168 VanDerWaalsContact C-N 3.27Å; Q166-K168 PolarHBondContact O-N 3.01Å; Q166-L172 PolarHBondContact NE2-O 3.32Å; Q166-L172 PolarHBondContact OE1-O 2.96Å; Q166-A196 HydrophobicContact CG-CB 3.96Å; Q166-A197 WeakPolarHBondContact CG-O 3.47Å; Q166-Q198 HydrophobicContact CB-CB 4.35Å
167D86.1Confident92.6Very high77 Ų7740.9 Ų40.941%0.41223%0.228SC..THydrogen-bonded Turntrans-69.9-20.3171.855.3-68.7000113.9K165 Q198K165-D167 VanDerWaalsContact CA-OD1 3.23Å; K165-D167 WeakPolarHBondContact CA-OD1 3.49Å; K165-D167 PolarHBondContact O-N 2.83Å; K165-D167 VanDerWaalsContact O-N 3.15Å; D167-Q198 HydrophobicContact CB-CG 3.93Å
168K89.3Confident92.8Very high79 Ų7942.9 Ų42.934%0.34324%0.237SC..SBendtrans-84.9141.9-175-67.6176.5171.9-173.50111.7D133 S135 K165 Q166 N170 A171D133-K168 IonicContact OD2-NZ 2.54Å; S135-K168 WeakPolarHBondContact OG-CD 3.3Å; S135-K168 PolarHBondContact OG-NZ 3.2Å; K165-K168 HydrophobicContact CB-CD 4.09Å; K165-K168 HydrophobicContact CD-CD 4.36Å; K165-K168 PolarHBondContact O-N 3.09Å; Q166-K168 VanDerWaalsContact C-N 3.27Å; Q166-K168 PolarHBondContact O-N 3.01Å; K168-N170 PolarHBondContact O-N 2.76Å; K168-A171 WeakPolarHBondContact O-CB 3.46Å; K168-A171 PolarHBondContact O-N 2.83Å
169L88.2Confident93Very high188 Ų18848.7 Ų48.798%0.98426%0.262SS*.THydrogen-bonded Turntrans-56.2-28.5-178-67.9173.6000114.5
170N92.3Very high93.1Very high81 Ų8150.3 Ų50.343%0.43328%0.276SS..THydrogen-bonded Turntrans-101.810.7-178.164.8-36.6000113.6S135 R137 K168S135-N170 WeakPolarHBondContact CB-OD1 3.45Å; S135-N170 PolarHBondContact O-ND2 3.27Å; R137-N170 PolarHBondContact NE-O 2.9Å; K168-N170 PolarHBondContact O-N 2.76Å
171A94.2Very high93.2Very high19 Ų1950.3 Ų50.316%0.15728%0.276CS..PPolyproline II helixtrans-59.7137.2174.900000111.4S134 K168S134-A171 CarbonylContact O-C 3.57Å; S134-A171 WeakPolarHBondContact O-CA 3.24Å; S134-A171 WeakPolarHBondContact OG-CB 3.45Å; K168-A171 WeakPolarHBondContact O-CB 3.46Å; K168-A171 PolarHBondContact O-N 2.83Å
172L94.1Very high93.3Very high4 Ų451.7 Ų51.72%0.02129%0.286CS..PPolyproline II helixtrans-75.8137.2173.8-82.876.8000110.3S134 R137 L140 Q166 E176 L177 A180S134-L172 WeakPolarHBondContact O-CD1 3.31Å; S134-L172 PolarHBondContact O-N 3Å; R137-L172 HydrophobicContact CG-CD1 3.53Å; L140-L172 HydrophobicContact CD1-CD1 3.84Å; L140-L172 HydrophobicContact CD1-CD2 3.54Å; L140-L172 HydrophobicContact CD1-CG 4.41Å; Q166-L172 PolarHBondContact NE2-O 3.32Å; Q166-L172 PolarHBondContact OE1-O 2.96Å; L172-E176 HydrophobicContact CB-CB 3.94Å; L172-E176 HydrophobicContact CD2-CB 3.79Å; L172-E176 HydrophobicContact CG-CB 3.86Å; L172-L177 HydrophobicContact CB-CB 4.16Å; L172-L177 HydrophobicContact CD2-CD1 4.43Å; L172-A180 HydrophobicContact CD2-CB 3.92Å
173S92.9Very high93.2Very high53 Ų5351.6 Ų51.637%0.37129%0.285SS..PPolyproline II helixtrans-60.9164.6163.164.70000111.4A175 E176 L177S173-A175 VanDerWaalsContact C-N 3.27Å; S173-A175 PolarHBondContact O-N 3.17Å; S173-E176 WeakPolarHBondContact CB-OE2 3.17Å; S173-E176 PolarHBondContact N-OE2 3.04Å; S173-E176 PolarHBondContact O-N 3.29Å; S173-E176 WeakPolarHBondContact OG-CG 3.35Å; S173-E176 PolarHBondContact OG-N 3.04Å; S173-E176 PolarHBondContact OG-OE2 3.44Å; S173-L177 WeakPolarHBondContact O-CB 3.21Å; S173-L177 PolarHBondContact O-N 3.16Å
174V91.3Very high92.9Very high71 Ų7156.3 Ų56.343%0.4331%0.311SS..Hα-helixtrans-55-43.8177175.60000111.3L177 H178 L194 A196V174-L177 PolarHBondContact O-N 3.25Å; V174-H178 WeakPolarHBondContact O-CB 3.42Å; V174-H178 PolarHBondContact O-N 3.27Å; V174-L194 HydrophobicContact CG1-CD2 3.73Å; V174-L194 HydrophobicContact CG1-CG 4.06Å; V174-L194 WeakPolarHBondContact O-CD2 3.09Å; V174-A196 HydrophobicContact CG2-CB 3.58Å
175A93.7Very high92.6Very high74 Ų7461.6 Ų61.661%0.61234%0.343SS*.Hα-helixtrans-66.1-46.6-18000000112.3S173 L177 H178 E179S173-A175 VanDerWaalsContact C-N 3.27Å; S173-A175 PolarHBondContact O-N 3.17Å; A175-L177 VanDerWaalsContact C-N 3.3Å; A175-L177 PolarHBondContact O-N 3.3Å; A175-H178 WeakPolarHBondContact O-CB 3.26Å; A175-H178 PolarHBondContact O-N 3.02Å; A175-E179 PolarHBondContact O-N 2.74Å; A175-E179 VanDerWaalsContact O-N 3.11Å
176E95.8Very high92.1Very high72 Ų7260.5 Ų60.534%0.33634%0.339SS..Hα-helixtrans-62.2-40176.7-71168.3104.300111.4R137 L172 S173 E179 A180R137-E176 IonicContact CZ-OE1 2.79Å; R137-E176 IonicContact NH1-OE1 3.16Å; R137-E176 IonicContact NH2-OE1 2.68Å; R137-E176 PolarHBondContact NH2-OE1 2.83Å; L172-E176 HydrophobicContact CB-CB 3.94Å; L172-E176 HydrophobicContact CD2-CB 3.79Å; L172-E176 HydrophobicContact CG-CB 3.86Å; S173-E176 WeakPolarHBondContact CB-OE2 3.17Å; S173-E176 PolarHBondContact N-OE2 3.04Å; S173-E176 PolarHBondContact O-N 3.29Å; S173-E176 WeakPolarHBondContact OG-CG 3.35Å; S173-E176 PolarHBondContact OG-N 3.04Å; S173-E176 PolarHBondContact OG-OE2 3.44Å; E176-E179 PolarHBondContact O-N 3.17Å; E176-A180 WeakPolarHBondContact O-CB 2.94Å; E176-A180 PolarHBondContact O-N 3.18Å
177L95.7Very high91.2Very high1 Ų160.7 Ų60.71%0.00534%0.344CS..Hα-helixtrans-69.2-37-179.7-171.560.7000111.5V132 L140 L172 S173 V174 A175 A180 L181 L194V132-L177 HydrophobicContact CG1-CD1 4.11Å; L140-L177 HydrophobicContact CD2-CD1 3.82Å; L172-L177 HydrophobicContact CB-CB 4.16Å; L172-L177 HydrophobicContact CD2-CD1 4.43Å; S173-L177 WeakPolarHBondContact O-CB 3.21Å; S173-L177 PolarHBondContact O-N 3.16Å; V174-L177 PolarHBondContact O-N 3.25Å; A175-L177 VanDerWaalsContact C-N 3.3Å; A175-L177 PolarHBondContact O-N 3.3Å; L177-A180 PolarHBondContact O-N 2.79Å; L177-L181 HydrophobicContact CD1-CD1 3.84Å; L177-L181 HydrophobicContact CD1-CG 4.05Å; L177-L181 HydrophobicContact CG-CD1 3.9Å; L177-L181 HydrophobicContact CG-CG 4.43Å; L177-L181 WeakPolarHBondContact O-CB 3.34Å; L177-L181 WeakPolarHBondContact O-CG 3.49Å; L177-L181 PolarHBondContact O-N 3.03Å; L177-L194 HydrophobicContact CD2-CD1 4Å; L177-L194 HydrophobicContact CG-CD1 4.4Å
178H95.4Very high90.3Very high52 Ų5263.6 Ų63.624%0.24136%0.36CS..Hα-helixtrans-57.1-49.8172.9-169.5-84000111.5V174 A175 S182 L183 D184 L194V174-H178 WeakPolarHBondContact O-CB 3.42Å; V174-H178 PolarHBondContact O-N 3.27Å; A175-H178 WeakPolarHBondContact O-CB 3.26Å; A175-H178 PolarHBondContact O-N 3.02Å; H178-S182 PolarHBondContact O-N 3.36Å; H178-L183 PolarHBondContact O-N 3.23Å; H178-L183 VanDerWaalsContact O-N 3.15Å; H178-D184 IonicContact CE1-OD1 3.79Å; H178-D184 PolarHBondContact CE1-OD1 3.09Å; H178-D184 IonicContact CE1-OD2 2.67Å; H178-D184 PolarHBondContact CE1-OD2 3.22Å; H178-D184 IonicContact ND1-OD1 3.01Å; H178-D184 IonicContact ND1-OD2 3.8Å; H178-D184 PolarHBondContact ND1-OD2 2.78Å; H178-L194 HydrophobicContact CB-CD2 3.82Å
179E96.3Very high89.6Confident146 Ų14667.3 Ų67.368%0.68238%0.384SS*.Hα-helixtrans-65.6-47.9178.5-174.2-179.7-179.600111.6A175 E176 L181 S182A175-E179 PolarHBondContact O-N 2.74Å; A175-E179 VanDerWaalsContact O-N 3.11Å; E176-E179 PolarHBondContact O-N 3.17Å; E179-L181 VanDerWaalsContact C-N 3.26Å; E179-L181 PolarHBondContact O-N 3.22Å; E179-S182 WeakPolarHBondContact O-CA 3.48Å; E179-S182 PolarHBondContact O-N 3.08Å; E179-S182 PolarHBondContact O-OG 2.92Å
180A97Very high89.6Confident35 Ų3560 Ų6029%0.28934%0.343SS..Hα-helixtrans-61.5-33.7-177.800000112.9L140 K144 L172 E176 L177L140-A180 HydrophobicContact CD1-CB 4.01Å; K144-A180 WeakPolarHBondContact CD-O 3.47Å; L172-A180 HydrophobicContact CD2-CB 3.92Å; E176-A180 WeakPolarHBondContact O-CB 2.94Å; E176-A180 PolarHBondContact O-N 3.18Å; L177-A180 PolarHBondContact O-N 2.79Å
181L97.1Very high89.4Confident0 Ų062.1 Ų62.10%035%0.348CS..Hα-helixtrans-89.7-6.9175-61.6176000112.9V132 L140 A143 K144 H148 V161 L177 E179 L183V132-L181 HydrophobicContact CG2-CD1 4.09Å; L140-L181 HydrophobicContact CD2-CD2 4.42Å; A143-L181 HydrophobicContact CB-CD2 4.43Å; K144-L181 HydrophobicContact CB-CD2 4.09Å; H148-L181 PolarHBondContact NE2-O 2.78Å; V161-L181 HydrophobicContact CG1-CD1 3.76Å; L177-L181 HydrophobicContact CD1-CD1 3.84Å; L177-L181 HydrophobicContact CD1-CG 4.05Å; L177-L181 HydrophobicContact CG-CD1 3.9Å; L177-L181 HydrophobicContact CG-CG 4.43Å; L177-L181 WeakPolarHBondContact O-CB 3.34Å; L177-L181 WeakPolarHBondContact O-CG 3.49Å; L177-L181 PolarHBondContact O-N 3.03Å; E179-L181 VanDerWaalsContact C-N 3.26Å; E179-L181 PolarHBondContact O-N 3.22Å; L181-L183 HydrophobicContact CB-CD1 4.43Å; L181-L183 HydrophobicContact CB-CD2 3.63Å; L181-L183 HydrophobicContact CB-CG 3.83Å; L181-L183 HydrophobicContact CD1-CD2 4.48Å; L181-L183 PolarHBondContact O-N 3.43Å
182S95.9Very high89.3Confident29 Ų2962.6 Ų62.620%0.20335%0.348CS..THydrogen-bonded Turntrans49.755.8-177.9-50.90000112.1K144 H148 H178 E179 D184K144-S182 WeakPolarHBondContact CE-OG 3.4Å; K144-S182 PolarHBondContact NZ-OG 3.05Å; H148-S182 PolarHBondContact CE1-O 2.79Å; H148-S182 PolarHBondContact NE2-O 2.72Å; H178-S182 PolarHBondContact O-N 3.36Å; E179-S182 WeakPolarHBondContact O-CA 3.48Å; E179-S182 PolarHBondContact O-N 3.08Å; E179-S182 PolarHBondContact O-OG 2.92Å; S182-D184 VanDerWaalsContact C-N 3.27Å; S182-D184 PolarHBondContact O-N 2.68Å
183L93.3Very high89.1Confident0 Ų065.7 Ų65.70%036%0.361CS..G310 helixtrans-73.8-20-176.5-56.9-178.2000112.4L147 V161 H178 L181 V185 V186 L192 L194L147-L183 HydrophobicContact CD2-CD2 3.85Å; V161-L183 HydrophobicContact CG2-CD1 4.45Å; H178-L183 PolarHBondContact O-N 3.23Å; H178-L183 VanDerWaalsContact O-N 3.15Å; L181-L183 HydrophobicContact CB-CD1 4.43Å; L181-L183 HydrophobicContact CB-CD2 3.63Å; L181-L183 HydrophobicContact CB-CG 3.83Å; L181-L183 HydrophobicContact CD1-CD2 4.48Å; L181-L183 PolarHBondContact O-N 3.43Å; L183-V185 PolarHBondContact O-N 3.27Å; L183-V185 VanDerWaalsContact O-N 3.15Å; L183-V186 WeakPolarHBondContact O-CB 3.36Å; L183-V186 PolarHBondContact O-N 3.27Å; L183-L192 HydrophobicContact CB-CD2 4.45Å; L183-L192 HydrophobicContact CD1-CD2 4.1Å; L183-L192 HydrophobicContact CD2-CD1 4.29Å; L183-L194 HydrophobicContact CD1-CB 4.4Å; L183-L194 HydrophobicContact CD1-CD1 4.33Å; L183-L194 HydrophobicContact CD1-CD2 4.03Å; L183-L194 HydrophobicContact CD1-CG 4.5Å
184D89.6Confident89Confident99 Ų9964.6 Ų64.653%0.52935%0.351SS..G310 helixtrans-55-32.4175.4-57.9-80.3000113.3H178 S182 V186 T187H178-D184 IonicContact CE1-OD1 3.79Å; H178-D184 PolarHBondContact CE1-OD1 3.09Å; H178-D184 IonicContact CE1-OD2 2.67Å; H178-D184 PolarHBondContact CE1-OD2 3.22Å; H178-D184 IonicContact ND1-OD1 3.01Å; H178-D184 IonicContact ND1-OD2 3.8Å; H178-D184 PolarHBondContact ND1-OD2 2.78Å; S182-D184 VanDerWaalsContact C-N 3.27Å; S182-D184 PolarHBondContact O-N 2.68Å; D184-V186 VanDerWaalsContact C-N 3.26Å; D184-V186 PolarHBondContact O-N 3.1Å; D184-T187 PolarHBondContact O-OG1 2.7Å; D184-T187 VanDerWaalsContact O-OG1 3.04Å
185V86.3Confident88.9Confident117 Ų11762.8 Ų62.871%0.70934%0.339SS*.G310 helixtrans-81-11.9-177.5-170.80000111.8L183L183-V185 PolarHBondContact O-N 3.27Å; L183-V185 VanDerWaalsContact O-N 3.15Å
186V80.7Confident88.4Confident18 Ų1861.4 Ų61.411%0.10933%0.328CS..THydrogen-bonded Turntrans-99.3-20.4-171.81770000111.7H148 L151 L183 D184 R190 L192H148-V186 VanDerWaalsContact CE1-CG2 3.49Å; H148-V186 WeakPolarHBondContact CE1-CG2 3.33Å; L151-V186 HydrophobicContact CD1-CB 4.22Å; L151-V186 HydrophobicContact CD1-CG1 3.41Å; L151-V186 VanDerWaalsContact CD1-CG1 3.41Å; L151-V186 HydrophobicContact CD1-CG2 3.7Å; L151-V186 HydrophobicContact CD2-CG1 4.07Å; L151-V186 HydrophobicContact CG-CG1 4.25Å; L183-V186 WeakPolarHBondContact O-CB 3.36Å; L183-V186 PolarHBondContact O-N 3.27Å; D184-V186 VanDerWaalsContact C-N 3.26Å; D184-V186 PolarHBondContact O-N 3.1Å; V186-R190 HydrophobicContact CG1-CG 4.37Å; V186-L192 HydrophobicContact CB-CD1 4.25Å; V186-L192 HydrophobicContact CG1-CD1 3.75Å
187T69.7Low87.3Confident59 Ų5958.5 Ų58.536%0.36232%0.316SS..THydrogen-bonded Turntrans-79.9-15.6-163.739.60000116.2D184 D189 L192D184-T187 PolarHBondContact O-OG1 2.7Å; D184-T187 VanDerWaalsContact O-OG1 3.04Å; T187-D189 VanDerWaalsContact C-N 3.27Å; T187-D189 PolarHBondContact O-N 3.2Å; T187-D189 VanDerWaalsContact O-N 3.15Å; T187-L192 HydrophobicContact CG2-CB 4.37Å
188D67.3Low85.9Confident139 Ų13961.2 Ų61.274%0.74333%0.328SS*.THydrogen-bonded Turntrans-65.1-25.6-165.1-72.2-13.2000114.6
189D75.8Confident84.1Confident157 Ų15759.5 Ų59.584%0.8432%0.321SS*.SBendtrans-131.94.1-175.7-69.6-46.1000115T187T187-D189 VanDerWaalsContact C-N 3.27Å; T187-D189 PolarHBondContact O-N 3.2Å; T187-D189 VanDerWaalsContact O-N 3.15Å
190R87.3Confident82Confident35 Ų3558 Ų5813%0.13232%0.318CS..SBendtrans-133.8152.2-178.280.1175.868-142.97.6113.6L151 E154 P155 L157 V186 L192L151-R190 VanDerWaalsContact CD2-CZ 3.48Å; L151-R190 PolarHBondContact O-NH2 3.27Å; E154-R190 PolarHBondContact O-NH1 3.49Å; P155-R190 PolarHBondContact O-NE 3.11Å; P155-R190 PolarHBondContact O-NH1 3.27Å; P155-R190 PolarHBondContact O-NH2 2.77Å; L157-R190 PolarHBondContact O-NH1 3.01Å; L157-R190 VanDerWaalsContact O-NH1 3.17Å; V186-R190 HydrophobicContact CG1-CG 4.37Å; R190-L192 HydrophobicContact CG-CB 4.48Å; R190-L192 PolarHBondContact O-N 3.31Å
191K88.9Confident79.4Confident124 Ų12458.6 Ų58.654%0.53932%0.32SS..  trans-72.1115.7167.6-61.7-176.1-175.9176.70109.4P158 V159 F193 L222P158-K191 WeakPolarHBondContact CA-O 3.37Å; P158-K191 HydrophobicContact CB-CB 4.35Å; V159-K191 PolarHBondContact N-O 2.6Å; K191-F193 HydrophobicContact CB-CE2 4.29Å; K191-L222 HydrophobicContact CB-CD2 3.87Å; K191-L222 HydrophobicContact CD-CD2 3.35Å; K191-L222 HydrophobicContact CG-CD2 4.27Å
192L91.1Very high76.9Confident29 Ų2965 Ų6515%0.15235%0.35CS..EExtended strand (participates in β ladder)trans-127.3129.7176.3-175150.2000109.8V159 L183 V186 T187 R190V159-L192 WeakPolarHBondContact O-CA 3.29Å; L183-L192 HydrophobicContact CB-CD2 4.45Å; L183-L192 HydrophobicContact CD1-CD2 4.1Å; L183-L192 HydrophobicContact CD2-CD1 4.29Å; V186-L192 HydrophobicContact CB-CD1 4.25Å; V186-L192 HydrophobicContact CG1-CD1 3.75Å; T187-L192 HydrophobicContact CG2-CB 4.37Å; R190-L192 HydrophobicContact CG-CB 4.48Å; R190-L192 PolarHBondContact O-N 3.31Å
193F90.7Very high74.3Confident69 Ų6971 Ų7130%0.30338%0.375SS..EExtended strand (participates in β ladder)trans-121.4137.1174-61.8-85.4000110.1V159 V160 V161 K191 L218 L222V159-F193 PolarHBondContact O-N 2.89Å; V160-F193 CarbonylContact C-O 3.55Å; V160-F193 WeakPolarHBondContact CA-O 3.47Å; V161-F193 PolarHBondContact N-O 3.42Å; K191-F193 HydrophobicContact CB-CE2 4.29Å; F193-L218 HydrophobicContact CB-CD1 4.44Å; F193-L218 HydrophobicContact CD1-CD2 3.79Å; F193-L218 HydrophobicContact CD2-CD2 4.46Å; F193-L218 HydrophobicContact CE1-CD2 3.81Å; F193-L218 HydrophobicContact CE2-CD2 4.47Å; F193-L218 HydrophobicContact CG-CD2 4.12Å; F193-L218 HydrophobicContact CZ-CD2 4.16Å; F193-L222 HydrophobicContact CD2-CD1 3.98Å; F193-L222 HydrophobicContact CE2-CD1 3.92Å; F193-L222 HydrophobicContact CE2-CD2 3.71Å; F193-L222 HydrophobicContact CE2-CG 3.96Å
194L90.6Very high71.9Confident31 Ų3171.3 Ų71.316%0.16238%0.377CS..EExtended strand (participates in β ladder)trans-114.9124.2174.5176.662.2000109.5V161 V174 L177 H178 L183V161-L194 HydrophobicContact CB-CD1 3.75Å; V161-L194 HydrophobicContact CG1-CD1 3.58Å; V161-L194 WeakPolarHBondContact O-CA 3.48Å; V174-L194 HydrophobicContact CG1-CD2 3.73Å; V174-L194 HydrophobicContact CG1-CG 4.06Å; V174-L194 WeakPolarHBondContact O-CD2 3.09Å; L177-L194 HydrophobicContact CD2-CD1 4Å; L177-L194 HydrophobicContact CG-CD1 4.4Å; H178-L194 HydrophobicContact CB-CD2 3.82Å; L183-L194 HydrophobicContact CD1-CB 4.4Å; L183-L194 HydrophobicContact CD1-CD1 4.33Å; L183-L194 HydrophobicContact CD1-CD2 4.03Å; L183-L194 HydrophobicContact CD1-CG 4.5Å
195L88.6Confident69.4Low33 Ų3369.1 Ų69.117%0.17336%0.363CS..EExtended strand (participates in β ladder)trans-124.2141.6179.7-57.9172.6000110.1V160 V161 L162 G163 T214 V215 L218V160-L195 HydrophobicContact CG1-CD1 3.85Å; V160-L195 HydrophobicContact CG1-CG 4.45Å; V161-L195 PolarHBondContact O-N 2.53Å; L162-L195 CarbonylContact C-O 3.57Å; L162-L195 HydrophobicContact CD1-CB 3.92Å; G163-L195 PolarHBondContact N-O 2.99Å; L195-T214 HydrophobicContact CD2-CG2 4.25Å; L195-V215 HydrophobicContact CD1-CB 4.48Å; L195-V215 HydrophobicContact CD1-CG2 3.42Å; L195-V215 VanDerWaalsContact CD1-CG2 3.42Å; L195-L218 HydrophobicContact CD1-CD1 3.67Å; L195-L218 HydrophobicContact CD2-CD1 3.85Å; L195-L218 HydrophobicContact CG-CD1 4.17Å
196A83.1Confident67.2Low45 Ų4573 Ų7337%0.37237%0.365SS..EExtended strand (participates in β ladder)trans-106.8122.2170.200000109G163 Q166 V174G163-A196 WeakPolarHBondContact O-CA 3.11Å; Q166-A196 HydrophobicContact CG-CB 3.96Å; V174-A196 HydrophobicContact CG2-CB 3.58Å
197A72.3Confident65.3Low11 Ų1179.6 Ų79.69%0.09139%0.392CS..  trans-134.9152.3-175.800000113.4L162 G163 N164 K165 Q166L162-A197 HydrophobicContact CD1-CB 3.58Å; L162-A197 HydrophobicContact CG-CB 4.37Å; G163-A197 PolarHBondContact O-N 3.13Å; N164-A197 WeakPolarHBondContact CA-O 3.46Å; K165-A197 PolarHBondContact N-O 2.92Å; Q166-A197 WeakPolarHBondContact CG-O 3.47Å
198Q66.3Low64Low57 Ų5777.1 Ų77.127%0.26638%0.378SS..  trans-125.8145.5173.8177.3-177.2-14.800108.5Q166 D167 A204 A208Q166-Q198 HydrophobicContact CB-CB 4.35Å; D167-Q198 HydrophobicContact CB-CG 3.93Å; Q198-A204 HydrophobicContact CB-CB 4.48Å; Q198-A204 HydrophobicContact CG-CB 3.89Å; Q198-A208 WeakPolarHBondContact O-CB 3.43Å
199L58.7Low62.9Low16 Ų1673.9 Ų73.98%0.08437%0.365CS..  trans-116.1-10.7-177.3-69.3163.3000115.3M69 L212M69-L199 HydrophobicContact CB-CD1 3.99Å; L199-L212 HydrophobicContact CD2-CD1 3.84Å; L199-L212 HydrophobicContact CD2-CD2 4.27Å; L199-L212 HydrophobicContact CD2-CG 4.26Å
200D51.5Low61.8Low115 Ų11572.5 Ų72.562%0.61535%0.353SS*.SBendtrans-121.724.2-154.7-69.2-24.9000118.6
201S43.7Very low60.3Low48 Ų4871.8 Ų71.834%0.33636%0.357SS..SBendtrans-135.9149.5172.7143.80000112E203 A204 K205S201-E203 VanDerWaalsContact C-N 3.34Å; S201-E203 PolarHBondContact O-N 2.88Å; S201-E203 PolarHBondContact OG-N 2.67Å; S201-A204 CarbonylContact O-C 3.12Å; S201-A204 VanDerWaalsContact O-CA 3.26Å; S201-A204 WeakPolarHBondContact O-CA 3.46Å; S201-A204 WeakPolarHBondContact O-CB 3.44Å; S201-A204 PolarHBondContact O-N 2.96Å; S201-A204 PolarHBondContact OG-N 3.43Å; S201-K205 VanDerWaalsContact O-CG 3.32Å; S201-K205 WeakPolarHBondContact O-CG 2.96Å; S201-K205 PolarHBondContact O-N 2.99Å
202E43.6Very low59Low134 Ų13466.5 Ų66.563%0.62633%0.334SS*.Hα-helixtrans-58.5-36.6179-67.4-65152.700114.1K205E202-K205 VanDerWaalsContact CD-CE 3.41Å; E202-K205 WeakPolarHBondContact O-CB 3.22Å; E202-K205 PolarHBondContact O-N 3.21Å; E202-K205 WeakPolarHBondContact OE1-CE 3.18Å; E202-K205 IonicContact OE1-NZ 2.78Å; E202-K205 PolarHBondContact OE1-NZ 2.63Å; E202-K205 WeakPolarHBondContact OE2-CD 3.21Å; E202-K205 VanDerWaalsContact OE2-CE 3.27Å; E202-K205 WeakPolarHBondContact OE2-CE 3.31Å; E202-K205 IonicContact OE2-NZ 3.58Å; E202-K205 PolarHBondContact OE2-NZ 3.36Å
203E41.7Very low57.8Low155 Ų15568.8 Ų68.872%0.72435%0.347SS*.Hα-helixtrans-77.7-33.6170.4-90.3169.8151.200111.5S201 K205 R206S201-E203 VanDerWaalsContact C-N 3.34Å; S201-E203 PolarHBondContact O-N 2.88Å; S201-E203 PolarHBondContact OG-N 2.67Å; E203-K205 PolarHBondContact O-N 2.9Å; E203-R206 PolarHBondContact O-N 3.27Å
204A41.7Very low56.7Low6 Ų668.4 Ų68.45%0.0535%0.35CS..Hα-helixtrans-69.5-16.416900000112.4Q198 S201 R206 K207 A208Q198-A204 HydrophobicContact CB-CB 4.48Å; Q198-A204 HydrophobicContact CG-CB 3.89Å; S201-A204 CarbonylContact O-C 3.12Å; S201-A204 VanDerWaalsContact O-CA 3.26Å; S201-A204 WeakPolarHBondContact O-CA 3.46Å; S201-A204 WeakPolarHBondContact O-CB 3.44Å; S201-A204 PolarHBondContact O-N 2.96Å; S201-A204 PolarHBondContact OG-N 3.43Å; A204-R206 VanDerWaalsContact C-N 3.35Å; A204-K207 CarbonylContact O-C 3.57Å; A204-K207 PolarHBondContact O-N 3.06Å; A204-A208 VanDerWaalsContact O-CA 3.31Å; A204-A208 WeakPolarHBondContact O-CA 3.23Å; A204-A208 WeakPolarHBondContact O-CB 3.26Å; A204-A208 PolarHBondContact O-N 3.48Å
205K37.8Very low55.7Low54 Ų5467 Ų6724%0.23534%0.343CS..Hα-helixtrans-70.1-36.8176.3-76.5-177.8-161.3176.30109.7S201 E202 E203 A208 C209S201-K205 VanDerWaalsContact O-CG 3.32Å; S201-K205 WeakPolarHBondContact O-CG 2.96Å; S201-K205 PolarHBondContact O-N 2.99Å; E202-K205 VanDerWaalsContact CD-CE 3.41Å; E202-K205 WeakPolarHBondContact O-CB 3.22Å; E202-K205 PolarHBondContact O-N 3.21Å; E202-K205 WeakPolarHBondContact OE1-CE 3.18Å; E202-K205 IonicContact OE1-NZ 2.78Å; E202-K205 PolarHBondContact OE1-NZ 2.63Å; E202-K205 WeakPolarHBondContact OE2-CD 3.21Å; E202-K205 VanDerWaalsContact OE2-CE 3.27Å; E202-K205 WeakPolarHBondContact OE2-CE 3.31Å; E202-K205 IonicContact OE2-NZ 3.58Å; E202-K205 PolarHBondContact OE2-NZ 3.36Å; E203-K205 PolarHBondContact O-N 2.9Å; K205-A208 PolarHBondContact O-N 3.43Å; K205-C209 VanDerWaalsContact O-CB 3.23Å; K205-C209 WeakPolarHBondContact O-CB 3.02Å; K205-C209 PolarHBondContact O-N 3.39Å; K205-C209 PolarHBondContact O-SG 3.15Å
206R40.2Very low54.8Low199 Ų19968 Ų6875%0.75135%0.347SS*.Hα-helixtrans-65.8-41.4172.5-64.3-174.4-164.81595.7111.5E203 A204 Q210E203-R206 PolarHBondContact O-N 3.27Å; A204-R206 VanDerWaalsContact C-N 3.35Å; R206-Q210 WeakPolarHBondContact O-CG 3.35Å; R206-Q210 PolarHBondContact O-N 3.42Å
207K39.9Very low54.5Low156 Ų15670 Ų7068%0.67835%0.351SS*.Hα-helixtrans-73.8-28.3174.9-71.7-176.3177179.40113.6A204 G211A204-K207 CarbonylContact O-C 3.57Å; A204-K207 PolarHBondContact O-N 3.06Å; K207-G211 PolarHBondContact O-N 2.6Å
208A42.2Very low54.7Low7 Ų770.4 Ų70.46%0.05835%0.352CS..Hα-helixtrans-79.4-42.5179.500000110Q198 A204 K205 Q210 G211 L212Q198-A208 WeakPolarHBondContact O-CB 3.43Å; A204-A208 VanDerWaalsContact O-CA 3.31Å; A204-A208 WeakPolarHBondContact O-CA 3.23Å; A204-A208 WeakPolarHBondContact O-CB 3.26Å; A204-A208 PolarHBondContact O-N 3.48Å; K205-A208 PolarHBondContact O-N 3.43Å; A208-Q210 VanDerWaalsContact C-N 3.34Å; A208-G211 PolarHBondContact O-N 3.43Å; A208-L212 WeakPolarHBondContact O-CB 3.38Å; A208-L212 WeakPolarHBondContact O-CG 3.39Å; A208-L212 PolarHBondContact O-N 3.12Å
209C45.5Very low55.2Low70 Ų7067.7 Ų67.747%0.47334%0.339SS..Hα-helixtrans-55.3-53.7165.1-69.50000108K205 G211 L212 D213K205-C209 VanDerWaalsContact O-CB 3.23Å; K205-C209 WeakPolarHBondContact O-CB 3.02Å; K205-C209 PolarHBondContact O-N 3.39Å; K205-C209 PolarHBondContact O-SG 3.15Å; C209-G211 VanDerWaalsContact C-N 3.31Å; C209-G211 PolarHBondContact O-N 3.31Å; C209-L212 PolarHBondContact O-N 3.39Å; C209-L212 VanDerWaalsContact O-N 3.17Å; C209-D213 WeakPolarHBondContact O-CA 3.49Å; C209-D213 WeakPolarHBondContact O-CB 3.47Å; C209-D213 PolarHBondContact O-N 2.59Å
210Q51.2Low56.1Low128 Ų12869.1 Ų69.160%0.59835%0.347SS*.Hα-helixtrans-54.1-43174.2-81.1178.6-15.400114R206 A208 T214R206-Q210 WeakPolarHBondContact O-CG 3.35Å; R206-Q210 PolarHBondContact O-N 3.42Å; A208-Q210 VanDerWaalsContact C-N 3.34Å; Q210-T214 WeakPolarHBondContact O-CB 3.19Å; Q210-T214 PolarHBondContact O-N 3.5Å; Q210-T214 PolarHBondContact O-OG1 3.36Å
211G56.8Low57.1Low20 Ų2070.2 Ų70.221%0.20635%0.348CS..Hα-helixtrans-71.5-36-179.600000113.7K207 A208 C209 V215K207-G211 PolarHBondContact O-N 2.6Å; A208-G211 PolarHBondContact O-N 3.43Å; C209-G211 VanDerWaalsContact C-N 3.31Å; C209-G211 PolarHBondContact O-N 3.31Å; G211-V215 VanDerWaalsContact O-CG2 3.23Å; G211-V215 WeakPolarHBondContact O-CG2 3.29Å; G211-V215 PolarHBondContact O-N 3.32Å
212L61.6Low58.4Low13 Ų1369 Ų697%0.06834%0.338CS..Hα-helixtrans-77.9-38.5177-72.1-179.6000111.6M69 L73 L199 A208 C209 T214 V215 Q216M69-L212 HydrophobicContact CE-CD2 4.36Å; M69-L212 HydrophobicContact CG-CD2 4.03Å; L73-L212 HydrophobicContact CD2-CB 3.7Å; L73-L212 HydrophobicContact CD2-CD1 4.11Å; L73-L212 HydrophobicContact CD2-CD2 3.82Å; L73-L212 HydrophobicContact CD2-CG 4.07Å; L73-L212 HydrophobicContact CG-CD1 4.3Å; L73-L212 HydrophobicContact CG-CD2 3.98Å; L199-L212 HydrophobicContact CD2-CD1 3.84Å; L199-L212 HydrophobicContact CD2-CD2 4.27Å; L199-L212 HydrophobicContact CD2-CG 4.26Å; A208-L212 WeakPolarHBondContact O-CB 3.38Å; A208-L212 WeakPolarHBondContact O-CG 3.39Å; A208-L212 PolarHBondContact O-N 3.12Å; C209-L212 PolarHBondContact O-N 3.39Å; C209-L212 VanDerWaalsContact O-N 3.17Å; L212-T214 VanDerWaalsContact C-N 3.3Å; L212-V215 CarbonylContact O-C 3.47Å; L212-V215 WeakPolarHBondContact O-CB 3.34Å; L212-V215 PolarHBondContact O-N 3.02Å; L212-Q216 WeakPolarHBondContact O-CB 3.48Å; L212-Q216 PolarHBondContact O-N 3.49Å
213D66.3Low59.4Low78 Ų7865.4 Ų65.442%0.41733%0.325SS..Hα-helixtrans-60.9-43.5168.3-59.8-20.1000108.6C209 V215 Q216 D217C209-D213 WeakPolarHBondContact O-CA 3.49Å; C209-D213 WeakPolarHBondContact O-CB 3.47Å; C209-D213 PolarHBondContact O-N 2.59Å; D213-V215 PolarHBondContact O-N 3.06Å; D213-Q216 CarbonylContact O-C 3.42Å; D213-Q216 PolarHBondContact O-N 2.73Å; D213-D217 VanDerWaalsContact O-CB 3.3Å; D213-D217 WeakPolarHBondContact O-CB 3.45Å; D213-D217 PolarHBondContact O-N 3.08Å
214T68.2Low60.3Low61 Ų6160.9 Ų60.937%0.37431%0.305SS..Hα-helixtrans-63-40.1173.4-59.70000111.6L195 Q210 L212 L218L195-T214 HydrophobicContact CD2-CG2 4.25Å; Q210-T214 WeakPolarHBondContact O-CB 3.19Å; Q210-T214 PolarHBondContact O-N 3.5Å; Q210-T214 PolarHBondContact O-OG1 3.36Å; L212-T214 VanDerWaalsContact C-N 3.3Å; T214-L218 HydrophobicContact CG2-CD1 3.88Å; T214-L218 HydrophobicContact CG2-CG 4.36Å; T214-L218 VanDerWaalsContact O-CB 3.26Å; T214-L218 WeakPolarHBondContact O-CB 3.23Å; T214-L218 WeakPolarHBondContact O-CD1 2.95Å; T214-L218 VanDerWaalsContact O-CG 3.24Å; T214-L218 WeakPolarHBondContact O-CG 3.1Å; T214-L218 PolarHBondContact O-N 3.23Å
215V67.9Low61.2Low2 Ų263.8 Ų63.81%0.01232%0.318CS..Hα-helixtrans-63.1-44.7174.2166.40000110.2M69 L162 L195 G211 L212 D213 L218 I219M69-V215 HydrophobicContact CE-CG1 3.95Å; L162-V215 HydrophobicContact CD1-CG2 4.37Å; L195-V215 HydrophobicContact CD1-CB 4.48Å; L195-V215 HydrophobicContact CD1-CG2 3.42Å; L195-V215 VanDerWaalsContact CD1-CG2 3.42Å; G211-V215 VanDerWaalsContact O-CG2 3.23Å; G211-V215 WeakPolarHBondContact O-CG2 3.29Å; G211-V215 PolarHBondContact O-N 3.32Å; L212-V215 CarbonylContact O-C 3.47Å; L212-V215 WeakPolarHBondContact O-CB 3.34Å; L212-V215 PolarHBondContact O-N 3.02Å; D213-V215 PolarHBondContact O-N 3.06Å; V215-L218 PolarHBondContact O-N 3Å; V215-I219 HydrophobicContact CG1-CD1 3.56Å; V215-I219 HydrophobicContact CG1-CG1 4.39Å; V215-I219 VanDerWaalsContact O-CB 3.3Å; V215-I219 WeakPolarHBondContact O-CB 3.26Å; V215-I219 WeakPolarHBondContact O-CD1 3.37Å; V215-I219 WeakPolarHBondContact O-CG1 3.34Å; V215-I219 PolarHBondContact O-N 2.99Å
216Q71.5Confident62.5Low52 Ų5264.3 Ų64.324%0.24332%0.323CS..Hα-helixtrans-65.2-44.2178.4-172.41729.100111.2L103 L212 D213 I219 L220L103-Q216 HydrophobicContact CD1-CG 4.48Å; L212-Q216 WeakPolarHBondContact O-CB 3.48Å; L212-Q216 PolarHBondContact O-N 3.49Å; D213-Q216 CarbonylContact O-C 3.42Å; D213-Q216 PolarHBondContact O-N 2.73Å; Q216-I219 WeakPolarHBondContact O-CB 3.31Å; Q216-I219 PolarHBondContact O-N 2.98Å; Q216-L220 HydrophobicContact CG-CD1 4.28Å; Q216-L220 WeakPolarHBondContact O-CB 3.32Å; Q216-L220 VanDerWaalsContact O-CG 3.24Å; Q216-L220 WeakPolarHBondContact O-CG 3.18Å; Q216-L220 PolarHBondContact O-N 3.29Å
217D76.3Confident63.8Low89 Ų8956.4 Ų56.448%0.47630%0.297SS..Hα-helixtrans-62.2-44175.8-72.1-18.3000111.2D213 I219 L220 Q221D213-D217 VanDerWaalsContact O-CB 3.3Å; D213-D217 WeakPolarHBondContact O-CB 3.45Å; D213-D217 PolarHBondContact O-N 3.08Å; D217-I219 VanDerWaalsContact C-N 3.35Å; D217-L220 CarbonylContact O-C 3.59Å; D217-L220 PolarHBondContact O-N 3Å; D217-Q221 VanDerWaalsContact O-CG 3.3Å; D217-Q221 WeakPolarHBondContact O-CG 3.45Å; D217-Q221 PolarHBondContact O-N 3.39Å
218L76.4Confident65.3Low18 Ų1850.2 Ų50.29%0.09427%0.274CS..Hα-helixtrans-65.3-39.9175.5-78.5167.5000111.7F193 L195 T214 V215 L220 Q221 L222F193-L218 HydrophobicContact CB-CD1 4.44Å; F193-L218 HydrophobicContact CD1-CD2 3.79Å; F193-L218 HydrophobicContact CD2-CD2 4.46Å; F193-L218 HydrophobicContact CE1-CD2 3.81Å; F193-L218 HydrophobicContact CE2-CD2 4.47Å; F193-L218 HydrophobicContact CG-CD2 4.12Å; F193-L218 HydrophobicContact CZ-CD2 4.16Å; L195-L218 HydrophobicContact CD1-CD1 3.67Å; L195-L218 HydrophobicContact CD2-CD1 3.85Å; L195-L218 HydrophobicContact CG-CD1 4.17Å; T214-L218 HydrophobicContact CG2-CD1 3.88Å; T214-L218 HydrophobicContact CG2-CG 4.36Å; T214-L218 VanDerWaalsContact O-CB 3.26Å; T214-L218 WeakPolarHBondContact O-CB 3.23Å; T214-L218 WeakPolarHBondContact O-CD1 2.95Å; T214-L218 VanDerWaalsContact O-CG 3.24Å; T214-L218 WeakPolarHBondContact O-CG 3.1Å; T214-L218 PolarHBondContact O-N 3.23Å; V215-L218 PolarHBondContact O-N 3Å; L218-L220 VanDerWaalsContact C-N 3.31Å; L218-Q221 PolarHBondContact O-N 3.02Å; L218-L222 WeakPolarHBondContact O-CB 3.27Å; L218-L222 VanDerWaalsContact O-CG 3.25Å; L218-L222 WeakPolarHBondContact O-CG 3.19Å; L218-L222 PolarHBondContact O-N 3.22Å
219I76.9Confident66.9Low0 Ų053.1 Ų53.10%029%0.288CS..Hα-helixtrans-60-46.1173.3-75.8163.3000109.4I56 L103 F105 I127 V129 V215 Q216 D217 Q221 L222 V223I56-I219 HydrophobicContact CD1-CD1 4.12Å; I56-I219 HydrophobicContact CD1-CG2 3.67Å; I56-I219 HydrophobicContact CG1-CG2 4.32Å; L103-I219 HydrophobicContact CD1-CG2 3.9Å; L103-I219 HydrophobicContact CD2-CG2 3.97Å; F105-I219 HydrophobicContact CE1-CD1 4.07Å; F105-I219 HydrophobicContact CZ-CD1 4.09Å; I127-I219 HydrophobicContact CD1-CB 4.2Å; I127-I219 HydrophobicContact CD1-CG1 4.24Å; I127-I219 HydrophobicContact CD1-CG2 3.94Å; V129-I219 HydrophobicContact CG2-CD1 4.43Å; V215-I219 HydrophobicContact CG1-CD1 3.56Å; V215-I219 HydrophobicContact CG1-CG1 4.39Å; V215-I219 VanDerWaalsContact O-CB 3.3Å; V215-I219 WeakPolarHBondContact O-CB 3.26Å; V215-I219 WeakPolarHBondContact O-CD1 3.37Å; V215-I219 WeakPolarHBondContact O-CG1 3.34Å; V215-I219 PolarHBondContact O-N 2.99Å; Q216-I219 WeakPolarHBondContact O-CB 3.31Å; Q216-I219 PolarHBondContact O-N 2.98Å; D217-I219 VanDerWaalsContact C-N 3.35Å; I219-Q221 VanDerWaalsContact C-N 3.32Å; I219-Q221 PolarHBondContact O-N 3.36Å; I219-L222 PolarHBondContact O-N 2.84Å; I219-L222 VanDerWaalsContact O-N 3.16Å; I219-V223 WeakPolarHBondContact O-CB 3.37Å; I219-V223 WeakPolarHBondContact O-CG2 3.39Å; I219-V223 PolarHBondContact O-N 2.54Å; I219-V223 VanDerWaalsContact O-N 3.15Å
220L76.4Confident68.4Low47 Ų4751.9 Ų51.925%0.24628%0.275CS..Hα-helixtrans-66.8-28.7177.8-69.3172.4000113.4A98 L103 Q216 D217 L218A98-L220 HydrophobicContact CB-CD2 3.85Å; L103-L220 HydrophobicContact CD1-CD2 4.42Å; Q216-L220 HydrophobicContact CG-CD1 4.28Å; Q216-L220 WeakPolarHBondContact O-CB 3.32Å; Q216-L220 VanDerWaalsContact O-CG 3.24Å; Q216-L220 WeakPolarHBondContact O-CG 3.18Å; Q216-L220 PolarHBondContact O-N 3.29Å; D217-L220 CarbonylContact O-C 3.59Å; D217-L220 PolarHBondContact O-N 3Å; L218-L220 VanDerWaalsContact C-N 3.31Å
221Q74.1Confident69.7Low137 Ų13746 Ų4664%0.6425%0.25SC*.Hα-helixtrans-76.9-23.5173-73.9176.46.400113.6D217 L218 I219D217-Q221 VanDerWaalsContact O-CG 3.3Å; D217-Q221 WeakPolarHBondContact O-CG 3.45Å; D217-Q221 PolarHBondContact O-N 3.39Å; L218-Q221 PolarHBondContact O-N 3.02Å; I219-Q221 VanDerWaalsContact C-N 3.32Å; I219-Q221 PolarHBondContact O-N 3.36Å
222L69.3Low70.8Confident23 Ų2348.2 Ų48.212%0.1225%0.254CS..Hα-helixtrans-87.5-17.4-180-80.6176.9000113.1I127 P158 V160 K191 F193 L218 I219I127-L222 HydrophobicContact CD1-CB 3.51Å; I127-L222 HydrophobicContact CD1-CD1 4.16Å; I127-L222 HydrophobicContact CG1-CB 4.12Å; I127-L222 HydrophobicContact CG1-CD1 4.42Å; I127-L222 HydrophobicContact CG2-CD1 4.34Å; P158-L222 HydrophobicContact CB-CD1 4.12Å; P158-L222 HydrophobicContact CB-CD2 3.98Å; P158-L222 HydrophobicContact CG-CD2 4.49Å; V160-L222 HydrophobicContact CG2-CD1 4.02Å; K191-L222 HydrophobicContact CB-CD2 3.87Å; K191-L222 HydrophobicContact CD-CD2 3.35Å; K191-L222 HydrophobicContact CG-CD2 4.27Å; F193-L222 HydrophobicContact CD2-CD1 3.98Å; F193-L222 HydrophobicContact CE2-CD1 3.92Å; F193-L222 HydrophobicContact CE2-CD2 3.71Å; F193-L222 HydrophobicContact CE2-CG 3.96Å; L218-L222 WeakPolarHBondContact O-CB 3.27Å; L218-L222 VanDerWaalsContact O-CG 3.25Å; L218-L222 WeakPolarHBondContact O-CG 3.19Å; L218-L222 PolarHBondContact O-N 3.22Å; I219-L222 PolarHBondContact O-N 2.84Å; I219-L222 VanDerWaalsContact O-N 3.16Å
223V64.7Low71.6Confident58 Ų5851.4 Ų51.435%0.35227%0.27SS..  trans-87.60178.2165.80000111R54 I127 I219R54-V223 HydrophobicContact CB-CG2 4.13Å; R54-V223 HydrophobicContact CG-CB 4.47Å; R54-V223 HydrophobicContact CG-CG1 3.61Å; R54-V223 HydrophobicContact CG-CG2 3.96Å; R54-V223 PolarHBondContact NH1-O 3.34Å; R54-V223 PolarHBondContact NH2-O 3.38Å; I127-V223 HydrophobicContact CD1-CG2 3.96Å; I219-V223 WeakPolarHBondContact O-CB 3.37Å; I219-V223 WeakPolarHBondContact O-CG2 3.39Å; I219-V223 PolarHBondContact O-N 2.54Å; I219-V223 VanDerWaalsContact O-N 3.15Å

Retrieved 223 of 223 residues in 1589.2 ms (Link to these results)

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