A0A3B3VYD0_9TELE Loading...

Vacuolar-sorting protein SNF8

Component of the endosomal sorting complex required for transport II (ESCRT-II), which is required for multivesicular body (MVB) formation and sorting of endosomal cargo proteins into MVBs.

AlphaFold DB , UniProt , Accession A0A3B3VYD0, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 258 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
1M40Very low61.5Low249 Ų249132.4 Ų132.4100%1.22773%0.734SS**  0100.40-83.3176.3160.100109.1
2H45.2Very low62.9Low199 Ų199126.2 Ų126.292%0.92171%0.713SS**  trans-91.8114.8-179-117-7.8000110.1R4H2-R4 PolarHBondContact O-N 3.17Å; H2-R4 VanDerWaalsContact O-N 3.17Å
3R53.3Low64.2Low248 Ų248129.4 Ų129.494%0.93671%0.714SS**  trans-65.3108.1170.4-87.1177.2158.3169.2-5.7108.7G5R3-G5 PolarHBondContact O-N 3.23Å
4R57Low65.5Low249 Ų249129.9 Ų129.994%0.9471%0.706SS**PPolyproline II helixtrans-63116.7166.2-83.5176137158.9-5.2108.4H2H2-R4 PolarHBondContact O-N 3.17Å; H2-R4 VanDerWaalsContact O-N 3.17Å
5G59.5Low66.7Low70 Ų70130.9 Ų130.972%0.72270%0.701SS**PPolyproline II helixtrans-61.2142.3177.300000111.7R3 G7R3-G5 PolarHBondContact O-N 3.23Å; G5-G7 PolarHBondContact O-N 3.31Å
6V62Low67.7Low116 Ų116129.2 Ų129.270%0.70369%0.691SS**PPolyproline II helixtrans-59122.4178-129.40000109.4A10V6-A10 HydrophobicContact CG1-CB 4.36Å
7G68.9Low68.6Low46 Ų46123.8 Ų123.847%0.47467%0.669SS.*PPolyproline II helixtrans-65.6145.4-176.700000113.2G5 G9 A10 I11G5-G7 PolarHBondContact O-N 3.31Å; G7-G9 PolarHBondContact O-N 3Å; G7-A10 WeakPolarHBondContact O-CB 3.3Å; G7-A10 PolarHBondContact O-N 3.33Å; G7-I11 PolarHBondContact O-N 3.07Å
8A69.1Low69.5Low84 Ų84122.7 Ų122.769%0.69466%0.658SS**Hα-helixtrans-52-33.5-176.300000114.2I11 A12A8-I11 PolarHBondContact O-N 2.99Å; A8-A12 PolarHBondContact O-N 2.97Å
9G72.1Confident70.3Confident56 Ų56119.3 Ų119.358%0.57765%0.649SS**Hα-helixtrans-67.4-33.2174.700000114.3G7 K13G7-G9 PolarHBondContact O-N 3Å; G9-K13 WeakPolarHBondContact O-CB 3.34Å; G9-K13 PolarHBondContact O-N 3.35Å
10A73.3Confident71.1Confident54 Ų54119.6 Ų119.645%0.44664%0.644SS.*Hα-helixtrans-70.4-35.8174.600000111.3V6 G7 K14V6-A10 HydrophobicContact CG1-CB 4.36Å; G7-A10 WeakPolarHBondContact O-CB 3.3Å; G7-A10 PolarHBondContact O-N 3.33Å; A10-K14 VanDerWaalsContact O-CB 3.3Å; A10-K14 WeakPolarHBondContact O-CB 3.37Å; A10-K14 PolarHBondContact O-N 2.87Å
11I76.8Confident71.8Confident85 Ų85122.7 Ų122.744%0.43665%0.647SS.*Hα-helixtrans-67.8-44175.4-60.5173.6000110.7G7 A8 K14 K15G7-I11 PolarHBondContact O-N 3.07Å; A8-I11 PolarHBondContact O-N 2.99Å; I11-K14 PolarHBondContact O-N 2.94Å; I11-K15 PolarHBondContact O-N 3.37Å
12A78.1Confident74.1Confident58 Ų58118.4 Ų118.448%0.47962%0.622SS.*Hα-helixtrans-63.2-43.8176.500000112.1A8 K14 K15 L16A8-A12 PolarHBondContact O-N 2.97Å; A12-K14 VanDerWaalsContact C-N 3.34Å; A12-K14 PolarHBondContact O-N 3.02Å; A12-K15 PolarHBondContact O-N 3.42Å; A12-L16 WeakPolarHBondContact O-CB 3.42Å; A12-L16 PolarHBondContact O-N 3.26Å
13K79.9Confident76.1Confident168 Ų168115 Ų11573%0.7361%0.607SS**Hα-helixtrans-65.6-37.1177.5-157.6173.9-174.5179.30112G9 A17G9-K13 WeakPolarHBondContact O-CB 3.34Å; G9-K13 PolarHBondContact O-N 3.35Å; K13-A17 WeakPolarHBondContact O-CB 3.41Å; K13-A17 PolarHBondContact O-N 3.48Å
14K81.8Confident77.7Confident136 Ų136112.8 Ų112.859%0.59160%0.598SS**Hα-helixtrans-65.6-46.9174-171.8178.8176.2-174.30112.1A10 I11 A12 L16 A17 E18A10-K14 VanDerWaalsContact O-CB 3.3Å; A10-K14 WeakPolarHBondContact O-CB 3.37Å; A10-K14 PolarHBondContact O-N 2.87Å; I11-K14 PolarHBondContact O-N 2.94Å; A12-K14 VanDerWaalsContact C-N 3.34Å; A12-K14 PolarHBondContact O-N 3.02Å; K14-L16 VanDerWaalsContact C-N 3.33Å; K14-L16 PolarHBondContact O-N 3.38Å; K14-A17 PolarHBondContact O-N 2.99Å; K14-E18 WeakPolarHBondContact CE-OE1 3.21Å; K14-E18 WeakPolarHBondContact O-CG 3.01Å; K14-E18 PolarHBondContact O-N 3.41Å
15K83.1Confident79.1Confident145 Ų145102.8 Ų102.863%0.6357%0.573SS**Hα-helixtrans-59.7-41.4175.4-84.3-171.9174.1-175.10112.7I11 A12 E18 A19I11-K15 PolarHBondContact O-N 3.37Å; A12-K15 PolarHBondContact O-N 3.42Å; K15-E18 PolarHBondContact O-N 2.9Å; K15-A19 WeakPolarHBondContact O-CB 3.49Å; K15-A19 PolarHBondContact O-N 3.38Å
16L83.5Confident80.5Confident104 Ų104102.7 Ų102.755%0.54556%0.559SS.*Hα-helixtrans-69.6-35.5179.6-156.7150.4000111.6A12 K14 K20A12-L16 WeakPolarHBondContact O-CB 3.42Å; A12-L16 PolarHBondContact O-N 3.26Å; K14-L16 VanDerWaalsContact C-N 3.33Å; K14-L16 PolarHBondContact O-N 3.38Å; L16-K20 HydrophobicContact CD2-CD 4Å; L16-K20 HydrophobicContact CD2-CG 4.45Å; L16-K20 WeakPolarHBondContact O-CG 3.43Å; L16-K20 PolarHBondContact O-N 3.18Å; L16-K20 VanDerWaalsContact O-N 3.12Å
17A83.2Confident81.7Confident38 Ų38100.4 Ų100.431%0.31455%0.545SS..Hα-helixtrans-65.6-47.8171.300000111.7K13 K14 A19 K20 Y21K13-A17 WeakPolarHBondContact O-CB 3.41Å; K13-A17 PolarHBondContact O-N 3.48Å; K14-A17 PolarHBondContact O-N 2.99Å; A17-A19 VanDerWaalsContact C-N 3.32Å; A17-A19 PolarHBondContact O-N 2.87Å; A17-K20 PolarHBondContact O-N 3.38Å; A17-Y21 HydrophobicContact CB-CD2 4.39Å; A17-Y21 HydrophobicContact CB-CE2 4.17Å; A17-Y21 WeakPolarHBondContact O-CD2 3.45Å; A17-Y21 PolarHBondContact O-N 3.12Å
18E83.8Confident82.6Confident104 Ų104103.2 Ų103.249%0.48655%0.548SS..Hα-helixtrans-57.4-42.2175.9-77.3171-178.100112.1K14 K15 Y21 K22K14-E18 WeakPolarHBondContact CE-OE1 3.21Å; K14-E18 WeakPolarHBondContact O-CG 3.01Å; K14-E18 PolarHBondContact O-N 3.41Å; K15-E18 PolarHBondContact O-N 2.9Å; E18-Y21 PolarHBondContact O-N 2.94Å; E18-K22 WeakPolarHBondContact O-CB 3.48Å; E18-K22 PolarHBondContact O-N 3.18Å
19A85.3Confident83.5Confident58 Ų58101.2 Ų101.248%0.47953%0.532SS..Hα-helixtrans-61.8-45.3175.300000112.2K15 A17 K22 E23K15-A19 WeakPolarHBondContact O-CB 3.49Å; K15-A19 PolarHBondContact O-N 3.38Å; A17-A19 VanDerWaalsContact C-N 3.32Å; A17-A19 PolarHBondContact O-N 2.87Å; A19-K22 PolarHBondContact O-N 3.42Å; A19-E23 WeakPolarHBondContact O-CB 3.41Å; A19-E23 PolarHBondContact O-N 2.98Å
20K85.6Confident84.3Confident124 Ų124104.3 Ų104.354%0.53953%0.531SS..Hα-helixtrans-65.7-37176.5-76-177.7175-177.20113.2L16 A17 R24L16-K20 HydrophobicContact CD2-CD 4Å; L16-K20 HydrophobicContact CD2-CG 4.45Å; L16-K20 WeakPolarHBondContact O-CG 3.43Å; L16-K20 PolarHBondContact O-N 3.18Å; L16-K20 VanDerWaalsContact O-N 3.12Å; A17-K20 PolarHBondContact O-N 3.38Å; K20-R24 WeakPolarHBondContact O-CB 3.45Å; K20-R24 WeakPolarHBondContact O-CG 3.44Å; K20-R24 PolarHBondContact O-N 3.27Å
21Y85.8Confident85.2Confident185 Ų185106.5 Ų106.573%0.72554%0.535SS*.Hα-helixtrans-67-38.6174.3-76-63.2000111.4A17 E18 G25A17-Y21 HydrophobicContact CB-CD2 4.39Å; A17-Y21 HydrophobicContact CB-CE2 4.17Å; A17-Y21 WeakPolarHBondContact O-CD2 3.45Å; A17-Y21 PolarHBondContact O-N 3.12Å; E18-Y21 PolarHBondContact O-N 2.94Å; Y21-G25 PolarHBondContact O-N 2.87Å
22K88.6Confident85.7Confident160 Ų160107.8 Ų107.870%0.69654%0.539SS*.Hα-helixtrans-65-45.6175.8-169.8176.7179.5-178.40111.6E18 A19 G25 T26E18-K22 WeakPolarHBondContact O-CB 3.48Å; E18-K22 PolarHBondContact O-N 3.18Å; A19-K22 PolarHBondContact O-N 3.42Å; K22-G25 WeakPolarHBondContact O-CA 3.39Å; K22-G25 PolarHBondContact O-N 2.76Å; K22-T26 PolarHBondContact O-N 3.01Å; K22-T26 PolarHBondContact O-OG1 3.39Å
23E87.6Confident86.2Confident128 Ų128110 Ų11060%0.59854%0.542SS*.Hα-helixtrans-63.3-43.9176.6-174.1-177.7-169.500112.3A19 G25 T26 V27A19-E23 WeakPolarHBondContact O-CB 3.41Å; A19-E23 PolarHBondContact O-N 2.98Å; E23-G25 VanDerWaalsContact C-N 3.28Å; E23-G25 PolarHBondContact O-N 2.93Å; E23-T26 WeakPolarHBondContact CA-OG1 3.44Å; E23-T26 PolarHBondContact O-N 3.21Å; E23-T26 PolarHBondContact O-OG1 2.93Å; E23-V27 WeakPolarHBondContact O-CG2 3.44Å; E23-V27 PolarHBondContact O-N 3.45Å
24R86.7Confident86.8Confident200 Ų200106.8 Ų106.876%0.75554%0.536SS*.Hα-helixtrans-65.2-33.8172.5-77.1-168.3174.1-154.8-1.9112.7K20 L28K20-R24 WeakPolarHBondContact O-CB 3.45Å; K20-R24 WeakPolarHBondContact O-CG 3.44Å; K20-R24 PolarHBondContact O-N 3.27Å; R24-L28 WeakPolarHBondContact O-CB 3.47Å; R24-L28 PolarHBondContact O-N 2.94Å
25G87.4Confident87.2Confident40 Ų40106 Ų10641%0.41253%0.534SS..Hα-helixtrans-64.1-40.1174.100000112.4Y21 K22 E23 A29Y21-G25 PolarHBondContact O-N 2.87Å; K22-G25 WeakPolarHBondContact O-CA 3.39Å; K22-G25 PolarHBondContact O-N 2.76Å; E23-G25 VanDerWaalsContact C-N 3.28Å; E23-G25 PolarHBondContact O-N 2.93Å; G25-A29 WeakPolarHBondContact O-CB 3.47Å; G25-A29 PolarHBondContact O-N 3.28Å; G25-A29 VanDerWaalsContact O-N 3.1Å
26T87.8Confident87.4Confident68 Ų68104.6 Ų104.642%0.41753%0.532SS..Hα-helixtrans-68.3-43.8175.7510000111.8K22 E23 L28 A29 E30K22-T26 PolarHBondContact O-N 3.01Å; K22-T26 PolarHBondContact O-OG1 3.39Å; E23-T26 WeakPolarHBondContact CA-OG1 3.44Å; E23-T26 PolarHBondContact O-N 3.21Å; E23-T26 PolarHBondContact O-OG1 2.93Å; T26-L28 PolarHBondContact O-N 2.91Å; T26-A29 PolarHBondContact O-N 3.24Å; T26-E30 WeakPolarHBondContact O-CG 3.37Å; T26-E30 PolarHBondContact O-N 3.1Å
27V87.2Confident87.5Confident68 Ų68102.4 Ų102.441%0.41253%0.525SS..Hα-helixtrans-62-43176.8174.20000111.3E23 A29 E30 D31E23-V27 WeakPolarHBondContact O-CG2 3.44Å; E23-V27 PolarHBondContact O-N 3.45Å; V27-A29 VanDerWaalsContact C-N 3.3Å; V27-A29 PolarHBondContact O-N 3.45Å; V27-E30 PolarHBondContact O-N 3.04Å; V27-D31 PolarHBondContact O-N 2.93Å
28L88.8Confident87.8Confident105 Ų105107.5 Ų107.555%0.5554%0.54SS..Hα-helixtrans-63.3-37.1177.1-175.566.2000112.3R24 T26 Q32R24-L28 WeakPolarHBondContact O-CB 3.47Å; R24-L28 PolarHBondContact O-N 2.94Å; T26-L28 PolarHBondContact O-N 2.91Å; L28-Q32 WeakPolarHBondContact O-CB 3.5Å; L28-Q32 WeakPolarHBondContact O-CG 3.39Å; L28-Q32 PolarHBondContact O-N 2.92Å
29A86.9Confident87.9Confident42 Ų42108.2 Ų108.235%0.34754%0.543SS..Hα-helixtrans-67.8-41.4175.500000111.5G25 T26 V27 Q32 I33G25-A29 WeakPolarHBondContact O-CB 3.47Å; G25-A29 PolarHBondContact O-N 3.28Å; G25-A29 VanDerWaalsContact O-N 3.1Å; T26-A29 PolarHBondContact O-N 3.24Å; V27-A29 VanDerWaalsContact C-N 3.3Å; V27-A29 PolarHBondContact O-N 3.45Å; A29-Q32 PolarHBondContact O-N 2.97Å; A29-I33 VanDerWaalsContact O-CG1 3.3Å; A29-I33 WeakPolarHBondContact O-CG1 3.35Å; A29-I33 PolarHBondContact O-N 3.35Å
30E89.6Confident87.7Confident121 Ų121109.9 Ų109.957%0.56554%0.544SS*.Hα-helixtrans-61.8-46.4174.4-74.6173.8178.200111.5T26 V27 Q32 I33 V34T26-E30 WeakPolarHBondContact O-CG 3.37Å; T26-E30 PolarHBondContact O-N 3.1Å; V27-E30 PolarHBondContact O-N 3.04Å; E30-Q32 VanDerWaalsContact C-N 3.31Å; E30-Q32 PolarHBondContact O-N 3.16Å; E30-I33 PolarHBondContact O-N 3.39Å; E30-I33 VanDerWaalsContact O-N 3.16Å; E30-V34 WeakPolarHBondContact O-CG2 3.3Å; E30-V34 PolarHBondContact O-N 3.45Å
31D91.4Very high87.5Confident100 Ų100110.6 Ų110.654%0.53555%0.549SS..Hα-helixtrans-59.7-41.6176-75.8-20.6000111.7V27 V34 Q35V27-D31 PolarHBondContact O-N 2.93Å; D31-V34 PolarHBondContact O-N 3.35Å; D31-Q35 WeakPolarHBondContact O-CB 3.38Å; D31-Q35 PolarHBondContact O-N 2.87Å
32Q88.7Confident87.6Confident111 Ų111105.3 Ų105.352%0.51954%0.536SS..Hα-helixtrans-62.6-43.2174.8-81.9-178.7-6.900112.1L28 A29 E30 Q35 M36L28-Q32 WeakPolarHBondContact O-CB 3.5Å; L28-Q32 WeakPolarHBondContact O-CG 3.39Å; L28-Q32 PolarHBondContact O-N 2.92Å; A29-Q32 PolarHBondContact O-N 2.97Å; E30-Q32 VanDerWaalsContact C-N 3.31Å; E30-Q32 PolarHBondContact O-N 3.16Å; Q32-Q35 PolarHBondContact O-N 2.94Å; Q32-M36 WeakPolarHBondContact O-CB 3.45Å; Q32-M36 VanDerWaalsContact O-CG 3.29Å; Q32-M36 WeakPolarHBondContact O-CG 3.41Å; Q32-M36 PolarHBondContact O-N 3.03Å
33I88.5Confident87.2Confident106 Ų106101.9 Ų101.954%0.54452%0.521SS..Hα-helixtrans-62.8-45.6177.8-70.2165.3000110.5A29 E30 Q35 M36 S37A29-I33 VanDerWaalsContact O-CG1 3.3Å; A29-I33 WeakPolarHBondContact O-CG1 3.35Å; A29-I33 PolarHBondContact O-N 3.35Å; E30-I33 PolarHBondContact O-N 3.39Å; E30-I33 VanDerWaalsContact O-N 3.16Å; I33-Q35 VanDerWaalsContact C-N 3.33Å; I33-Q35 PolarHBondContact O-N 3.17Å; I33-M36 PolarHBondContact O-N 3.42Å; I33-S37 PolarHBondContact O-N 3.37Å; I33-S37 PolarHBondContact O-OG 3.43Å
34V92.2Very high86.8Confident99 Ų99101 Ų10160%0.652%0.516SS*.Hα-helixtrans-61.7-43.4178172.80000110.9E30 D31 S37 K38E30-V34 WeakPolarHBondContact O-CG2 3.3Å; E30-V34 PolarHBondContact O-N 3.45Å; D31-V34 PolarHBondContact O-N 3.35Å; V34-S37 PolarHBondContact O-N 3.07Å; V34-K38 PolarHBondContact O-N 3.43Å
35Q90.1Very high86.6Confident119 Ų11994.7 Ų94.756%0.55650%0.502SS*.Hα-helixtrans-63.6-43.2176.8-174.3179.9-9.200111.8D31 Q32 I33 K38 Q39D31-Q35 WeakPolarHBondContact O-CB 3.38Å; D31-Q35 PolarHBondContact O-N 2.87Å; Q32-Q35 PolarHBondContact O-N 2.94Å; I33-Q35 VanDerWaalsContact C-N 3.33Å; I33-Q35 PolarHBondContact O-N 3.17Å; Q35-K38 PolarHBondContact O-N 2.89Å; Q35-Q39 WeakPolarHBondContact O-CG 3.28Å; Q35-Q39 PolarHBondContact O-N 3.28Å
36M86.1Confident86.6Confident116 Ų11696.8 Ų96.857%0.57150%0.504SS*.Hα-helixtrans-62.6-44.7176.4-76.2-176.170.100111.8Q32 I33 K38 Q39 L40Q32-M36 WeakPolarHBondContact O-CB 3.45Å; Q32-M36 VanDerWaalsContact O-CG 3.29Å; Q32-M36 WeakPolarHBondContact O-CG 3.41Å; Q32-M36 PolarHBondContact O-N 3.03Å; I33-M36 PolarHBondContact O-N 3.42Å; M36-K38 VanDerWaalsContact C-N 3.32Å; M36-K38 PolarHBondContact O-N 2.91Å; M36-Q39 PolarHBondContact O-N 2.86Å; M36-L40 WeakPolarHBondContact O-CG 3.29Å; M36-L40 PolarHBondContact O-N 3.4Å
37S86.4Confident86.3Confident58 Ų5893.9 Ų93.941%0.40649%0.486SS..Hα-helixtrans-58.7-43.9176.3-69.80000111.8I33 V34 Q39 L40 E41I33-S37 PolarHBondContact O-N 3.37Å; I33-S37 PolarHBondContact O-OG 3.43Å; V34-S37 PolarHBondContact O-N 3.07Å; S37-Q39 VanDerWaalsContact C-N 3.33Å; S37-Q39 PolarHBondContact O-N 3.25Å; S37-L40 PolarHBondContact O-N 3.38Å; S37-E41 WeakPolarHBondContact O-CG 3.44Å; S37-E41 PolarHBondContact O-N 2.88Å
38K89.4Confident85.9Confident146 Ų14692.5 Ų92.564%0.63548%0.475SS*.Hα-helixtrans-62.8-39.1176.6-172.4176.9-177.7178.40112.6V34 Q35 M36 T42V34-K38 PolarHBondContact O-N 3.43Å; Q35-K38 PolarHBondContact O-N 2.89Å; M36-K38 VanDerWaalsContact C-N 3.32Å; M36-K38 PolarHBondContact O-N 2.91Å; K38-T42 PolarHBondContact O-N 3.41Å; K38-T42 PolarHBondContact O-OG1 3.4Å
39Q85.6Confident85.8Confident118 Ų11893.7 Ų93.755%0.55148%0.478SS*.Hα-helixtrans-65.8-41.8175.4-75-177.5-22.200111.6Q35 M36 S37 T42 F43Q35-Q39 WeakPolarHBondContact O-CG 3.28Å; Q35-Q39 PolarHBondContact O-N 3.28Å; M36-Q39 PolarHBondContact O-N 2.86Å; S37-Q39 VanDerWaalsContact C-N 3.33Å; S37-Q39 PolarHBondContact O-N 3.25Å; Q39-T42 PolarHBondContact O-N 3.48Å; Q39-F43 VanDerWaalsContact O-CB 3.28Å; Q39-F43 WeakPolarHBondContact O-CB 3.49Å; Q39-F43 PolarHBondContact O-N 3.03Å
40L80.4Confident85.7Confident94 Ų9494.7 Ų94.749%0.49247%0.474SS..Hα-helixtrans-62.3-42175.7-73.2172.8000112.2M36 S37 F43 K44 I75M36-L40 WeakPolarHBondContact O-CG 3.29Å; M36-L40 PolarHBondContact O-N 3.4Å; S37-L40 PolarHBondContact O-N 3.38Å; L40-F43 PolarHBondContact O-N 3.01Å; L40-K44 VanDerWaalsContact O-CB 3.32Å; L40-K44 WeakPolarHBondContact O-CB 3.32Å; L40-K44 PolarHBondContact O-N 3.41Å; L40-I75 HydrophobicContact CD2-CG2 3.85Å
41E83Confident85.5Confident138 Ų13888.9 Ų88.965%0.64545%0.447SS*.Hα-helixtrans-63.4-46.9175.9-75.2176.8176.900112.2S37 F43 K44 S45S37-E41 WeakPolarHBondContact O-CG 3.44Å; S37-E41 PolarHBondContact O-N 2.88Å; E41-F43 VanDerWaalsContact C-N 3.29Å; E41-F43 PolarHBondContact O-N 3.3Å; E41-K44 PolarHBondContact O-N 3.41Å; E41-S45 PolarHBondContact O-N 2.84Å
42T86.9Confident85.1Confident74 Ų7486.7 Ų86.745%0.45444%0.44SS..Hα-helixtrans-60.1-43.9177-52.80000110.5K38 Q39 S45 N46K38-T42 PolarHBondContact O-N 3.41Å; K38-T42 PolarHBondContact O-OG1 3.4Å; Q39-T42 PolarHBondContact O-N 3.48Å; T42-S45 PolarHBondContact O-N 2.81Å; T42-N46 PolarHBondContact O-N 3.41Å; T42-N46 PolarHBondContact O-ND2 3.46Å; T42-N46 PolarHBondContact O-OD1 3.32Å
43F80.3Confident85.1Confident88 Ų8889.3 Ų89.339%0.38645%0.449SS..Hα-helixtrans-66.2-42.5179.6-163.2-76.7000111.8Q39 L40 E41 S45 N46 L47 I75Q39-F43 VanDerWaalsContact O-CB 3.28Å; Q39-F43 WeakPolarHBondContact O-CB 3.49Å; Q39-F43 PolarHBondContact O-N 3.03Å; L40-F43 PolarHBondContact O-N 3.01Å; E41-F43 VanDerWaalsContact C-N 3.29Å; E41-F43 PolarHBondContact O-N 3.3Å; F43-S45 VanDerWaalsContact C-N 3.35Å; F43-S45 PolarHBondContact O-N 2.96Å; F43-N46 PolarHBondContact O-N 3.34Å; F43-L47 HydrophobicContact CD1-CB 4.41Å; F43-L47 HydrophobicContact CD1-CD1 4.36Å; F43-L47 HydrophobicContact CE1-CB 4.22Å; F43-L47 HydrophobicContact CE1-CD1 3.68Å; F43-L47 HydrophobicContact CE1-CG 4.47Å; F43-L47 WeakPolarHBondContact O-CB 3.46Å; F43-L47 PolarHBondContact O-N 3.05Å; F43-I75 HydrophobicContact CD1-CD1 3.44Å; F43-I75 VanDerWaalsContact CD1-CD1 3.44Å; F43-I75 HydrophobicContact CD1-CG1 4.36Å; F43-I75 HydrophobicContact CE1-CD1 2.98Å; F43-I75 HydrophobicContact CE1-CG1 4.17Å; F43-I75 HydrophobicContact CG-CD1 4.45Å; F43-I75 HydrophobicContact CZ-CD1 3.65Å
44K78.4Confident85.1Confident109 Ų10986.4 Ų86.447%0.47443%0.433SS..Hα-helixtrans-56.1-50.8175-178-178.2169.8-172.20110.2L40 E41 N46 L47 E48L40-K44 VanDerWaalsContact O-CB 3.32Å; L40-K44 WeakPolarHBondContact O-CB 3.32Å; L40-K44 PolarHBondContact O-N 3.41Å; E41-K44 PolarHBondContact O-N 3.41Å; K44-N46 VanDerWaalsContact C-N 3.3Å; K44-N46 PolarHBondContact O-N 2.85Å; K44-L47 PolarHBondContact O-N 3.19Å; K44-L47 VanDerWaalsContact O-N 3.14Å; K44-E48 WeakPolarHBondContact CE-OE1 3.46Å; K44-E48 HydrophobicContact CG-CG 4.4Å; K44-E48 WeakPolarHBondContact O-CB 3.29Å; K44-E48 VanDerWaalsContact O-CG 3.25Å; K44-E48 WeakPolarHBondContact O-CG 3.39Å; K44-E48 PolarHBondContact O-N 2.98Å
45S83.6Confident84.8Confident68 Ų6884.5 Ų84.548%0.47642%0.417SS..Hα-helixtrans-56-43.1176.6-172.90000112.5E41 T42 F43 E48 E49E41-S45 PolarHBondContact O-N 2.84Å; T42-S45 PolarHBondContact O-N 2.81Å; F43-S45 VanDerWaalsContact C-N 3.35Å; F43-S45 PolarHBondContact O-N 2.96Å; S45-E48 PolarHBondContact O-N 3.24Å; S45-E49 PolarHBondContact O-N 2.78Å
46N86.5Confident84.5Confident85 Ų8584 Ų8446%0.45542%0.415SS..Hα-helixtrans-67.5-38.8178.5-66.5-16.6000112.3T42 F43 K44 E48 E49 F50T42-N46 PolarHBondContact O-N 3.41Å; T42-N46 PolarHBondContact O-ND2 3.46Å; T42-N46 PolarHBondContact O-OD1 3.32Å; F43-N46 PolarHBondContact O-N 3.34Å; K44-N46 VanDerWaalsContact C-N 3.3Å; K44-N46 PolarHBondContact O-N 2.85Å; N46-E48 VanDerWaalsContact C-N 3.32Å; N46-E49 PolarHBondContact O-N 3.14Å; N46-F50 VanDerWaalsContact O-CB 3.29Å; N46-F50 WeakPolarHBondContact O-CB 3.29Å; N46-F50 PolarHBondContact O-N 3.21Å
47L81.8Confident84.6Confident6 Ų683.2 Ų83.23%0.03141%0.41CS..Hα-helixtrans-69-35.6177.4-158.7153.5000110.3F43 K44 F50 A51 F68 M71 I75 W87F43-L47 HydrophobicContact CD1-CB 4.41Å; F43-L47 HydrophobicContact CD1-CD1 4.36Å; F43-L47 HydrophobicContact CE1-CB 4.22Å; F43-L47 HydrophobicContact CE1-CD1 3.68Å; F43-L47 HydrophobicContact CE1-CG 4.47Å; F43-L47 WeakPolarHBondContact O-CB 3.46Å; F43-L47 PolarHBondContact O-N 3.05Å; K44-L47 PolarHBondContact O-N 3.19Å; K44-L47 VanDerWaalsContact O-N 3.14Å; L47-F50 PolarHBondContact O-N 3.43Å; L47-A51 VanDerWaalsContact O-CB 3.28Å; L47-A51 WeakPolarHBondContact O-CB 3.38Å; L47-A51 PolarHBondContact O-N 2.76Å; L47-F68 HydrophobicContact CD2-CE2 3.54Å; L47-F68 HydrophobicContact CD2-CZ 3.78Å; L47-F68 HydrophobicContact CG-CE2 4.39Å; L47-M71 HydrophobicContact CD1-CG 4.12Å; L47-M71 HydrophobicContact CD1-SD 4.06Å; L47-M71 HydrophobicContact CG-SD 4.49Å; L47-I75 HydrophobicContact CD1-CD1 3.99Å; L47-W87 HydrophobicContact CB-CH2 3.97Å; L47-W87 HydrophobicContact CD2-CE3 4.25Å; L47-W87 HydrophobicContact CD2-CH2 3.01Å; L47-W87 HydrophobicContact CD2-CZ2 3.77Å; L47-W87 HydrophobicContact CD2-CZ3 3.28Å; L47-W87 HydrophobicContact CG-CH2 4.04Å
48E79.9Confident84.6Confident39 Ų3980.6 Ų80.618%0.18239%0.391CS..Hα-helixtrans-63.8-46.7174.6-72.9-173.7178.300111.1K44 S45 N46 A51 S52 F86 W87K44-E48 WeakPolarHBondContact CE-OE1 3.46Å; K44-E48 HydrophobicContact CG-CG 4.4Å; K44-E48 WeakPolarHBondContact O-CB 3.29Å; K44-E48 VanDerWaalsContact O-CG 3.25Å; K44-E48 WeakPolarHBondContact O-CG 3.39Å; K44-E48 PolarHBondContact O-N 2.98Å; S45-E48 PolarHBondContact O-N 3.24Å; N46-E48 VanDerWaalsContact C-N 3.32Å; E48-A51 PolarHBondContact O-N 3.24Å; E48-S52 WeakPolarHBondContact O-CB 3.25Å; E48-S52 PolarHBondContact O-N 3.37Å; E48-F86 HydrophobicContact CB-CD1 4.09Å; E48-F86 HydrophobicContact CB-CE1 3.38Å; E48-F86 HydrophobicContact CB-CE2 4.29Å; E48-F86 HydrophobicContact CB-CZ 3.48Å; E48-F86 VanDerWaalsContact CB-CZ 3.48Å; E48-F86 HydrophobicContact CG-CD1 3.42Å; E48-F86 VanDerWaalsContact CG-CD1 3.42Å; E48-F86 HydrophobicContact CG-CD2 4.45Å; E48-F86 HydrophobicContact CG-CE1 3.26Å; E48-F86 HydrophobicContact CG-CE2 4.3Å; E48-F86 HydrophobicContact CG-CG 4.05Å; E48-F86 HydrophobicContact CG-CZ 3.73Å; E48-W87 HydrophobicContact CB-CH2 4.16Å; E48-W87 HydrophobicContact CG-CH2 3.43Å; E48-W87 VanDerWaalsContact CG-CH2 3.43Å; E48-W87 HydrophobicContact CG-CZ2 3.77Å; E48-W87 HydrophobicContact CG-CZ3 4.14Å
49E86.1Confident84.3Confident130 Ų13076.6 Ų76.661%0.60737%0.372SS*.Hα-helixtrans-61.7-48.5174.5-172.4-178.7171.900111.4S45 N46 A51 S52 K53S45-E49 PolarHBondContact O-N 2.78Å; N46-E49 PolarHBondContact O-N 3.14Å; E49-A51 VanDerWaalsContact C-N 3.33Å; E49-A51 PolarHBondContact O-N 3.06Å; E49-S52 PolarHBondContact O-N 3.12Å; E49-S52 PolarHBondContact O-OG 3.36Å; E49-K53 PolarHBondContact O-N 3.35Å
50F85.7Confident84.2Confident63 Ų6378.2 Ų78.228%0.27638%0.377SS..Hα-helixtrans-55.1-49.9177.2177.8-95000111.2N46 L47 S52 K53 H54 F64 F68N46-F50 VanDerWaalsContact O-CB 3.29Å; N46-F50 WeakPolarHBondContact O-CB 3.29Å; N46-F50 PolarHBondContact O-N 3.21Å; L47-F50 PolarHBondContact O-N 3.43Å; F50-S52 VanDerWaalsContact C-N 3.32Å; F50-S52 PolarHBondContact O-N 3.01Å; F50-K53 PolarHBondContact O-N 2.92Å; F50-H54 AromaticContact CD2-CD2 3.62Å; F50-H54 AromaticContact CE2-CD2 3.52Å; F50-H54 AromaticContact CE2-NE2 3.79Å; F50-H54 AromaticContact CZ-CD2 3.95Å; F50-H54 WeakPolarHBondContact O-CB 3.49Å; F50-H54 PolarHBondContact O-CD2 3.01Å; F50-H54 VanDerWaalsContact O-CD2 3.24Å; F50-H54 PolarHBondContact O-N 3.46Å; F50-F64 AromaticContact CE1-CZ 3.84Å; F50-F64 HydrophobicContact CE1-CZ 3.84Å; F50-F64 HydrophobicContact CZ-CE2 4.05Å; F50-F64 AromaticContact CZ-CZ 3.6Å; F50-F64 HydrophobicContact CZ-CZ 3.6Å; F50-F68 HydrophobicContact CD1-CD2 4.2Å; F50-F68 HydrophobicContact CD1-CE2 4.3Å; F50-F68 HydrophobicContact CE1-CD2 4.1Å
51A83.6Confident84.6Confident0 Ų077 Ų770%037%0.372CS..Hα-helixtrans-67.2-36.4-177.600000112.1L47 E48 E49 K53 H54 K55 I58 F68 W87 L91L47-A51 VanDerWaalsContact O-CB 3.28Å; L47-A51 WeakPolarHBondContact O-CB 3.38Å; L47-A51 PolarHBondContact O-N 2.76Å; E48-A51 PolarHBondContact O-N 3.24Å; E49-A51 VanDerWaalsContact C-N 3.33Å; E49-A51 PolarHBondContact O-N 3.06Å; A51-K53 VanDerWaalsContact C-N 3.33Å; A51-K53 PolarHBondContact O-N 3.39Å; A51-H54 CarbonylContact O-C 2.94Å; A51-H54 PolarHBondContact O-N 3.48Å; A51-K55 WeakPolarHBondContact O-CA 3.44Å; A51-K55 PolarHBondContact O-N 2.7Å; A51-I58 HydrophobicContact CB-CD1 4.13Å; A51-F68 HydrophobicContact CB-CE2 3.62Å; A51-F68 HydrophobicContact CB-CZ 3.63Å; A51-W87 HydrophobicContact CB-CE3 4.44Å; A51-W87 HydrophobicContact CB-CZ3 3.83Å; A51-L91 HydrophobicContact CB-CD1 3.43Å; A51-L91 VanDerWaalsContact CB-CD1 3.43Å; A51-L91 HydrophobicContact CB-CD2 3.55Å; A51-L91 HydrophobicContact CB-CG 4.08Å; A51-L91 WeakPolarHBondContact O-CD2 3.28Å
52S83.6Confident84.9Confident54 Ų5471.7 Ų71.738%0.37835%0.349SS..Hα-helixtrans-61.4-42.3174.878.30000111.9E48 E49 F50E48-S52 WeakPolarHBondContact O-CB 3.25Å; E48-S52 PolarHBondContact O-N 3.37Å; E49-S52 PolarHBondContact O-N 3.12Å; E49-S52 PolarHBondContact O-OG 3.36Å; F50-S52 VanDerWaalsContact C-N 3.32Å; F50-S52 PolarHBondContact O-N 3.01Å
53K90Very high85Confident165 Ų16575.2 Ų75.272%0.71736%0.36SS*.Hα-helixtrans-69.2-38179.3-171.9176.9-178.6179.30112.3E49 F50 A51E49-K53 PolarHBondContact O-N 3.35Å; F50-K53 PolarHBondContact O-N 2.92Å; A51-K53 VanDerWaalsContact C-N 3.33Å; A51-K53 PolarHBondContact O-N 3.39Å
54H88.1Confident85.5Confident45 Ų4572.7 Ų72.721%0.20835%0.349CS..THydrogen-bonded Turntrans-101.815.4-175.8-65.2-83.8000113.7F50 A51 Q56 E57 I58 F64F50-H54 AromaticContact CD2-CD2 3.62Å; F50-H54 AromaticContact CE2-CD2 3.52Å; F50-H54 AromaticContact CE2-NE2 3.79Å; F50-H54 AromaticContact CZ-CD2 3.95Å; F50-H54 WeakPolarHBondContact O-CB 3.49Å; F50-H54 PolarHBondContact O-CD2 3.01Å; F50-H54 VanDerWaalsContact O-CD2 3.24Å; F50-H54 PolarHBondContact O-N 3.46Å; A51-H54 CarbonylContact O-C 2.94Å; A51-H54 PolarHBondContact O-N 3.48Å; H54-Q56 VanDerWaalsContact C-N 3.29Å; H54-Q56 PolarHBondContact O-N 3.24Å; H54-Q56 VanDerWaalsContact O-N 3.13Å; H54-E57 IonicContact CE1-OE2 3.72Å; H54-E57 IonicContact CG-OE2 3.7Å; H54-E57 IonicContact ND1-OE2 2.76Å; H54-E57 PolarHBondContact ND1-OE2 3.48Å; H54-E57 WeakPolarHBondContact O-CB 3.01Å; H54-E57 PolarHBondContact O-N 3.44Å; H54-I58 WeakPolarHBondContact O-CG1 3.44Å; H54-I58 PolarHBondContact O-N 3.41Å; H54-F64 HydrophobicContact CB-CE1 3.8Å; H54-F64 HydrophobicContact CB-CZ 3.93Å
55K84.7Confident86Confident59 Ų5967.7 Ų67.726%0.25733%0.327SS..Hα-helixtrans-50.3-43.6-175.2178.4175.3178.3168.70114A51 R59 M90 L91A51-K55 WeakPolarHBondContact O-CA 3.44Å; A51-K55 PolarHBondContact O-N 2.7Å; K55-R59 VanDerWaalsContact CE-CZ 3.45Å; K55-R59 VanDerWaalsContact CE-NH2 3.26Å; K55-R59 WeakPolarHBondContact O-CG 3.41Å; K55-R59 PolarHBondContact O-N 2.87Å; K55-M90 WeakPolarHBondContact CD-O 3.26Å; K55-M90 VanDerWaalsContact CE-O 3.23Å; K55-M90 WeakPolarHBondContact CE-O 3.44Å; K55-M90 PolarHBondContact NZ-O 2.99Å; K55-L91 HydrophobicContact CB-CD2 4.35Å; K55-L91 HydrophobicContact CG-CD2 4.44Å
56Q85.4Confident86.2Confident109 Ų10965.9 Ų65.951%0.50931%0.313SS..Hα-helixtrans-72.4-32.8-179.2-63.7-61.5-22.500112.5H54 R59 K60H54-Q56 VanDerWaalsContact C-N 3.29Å; H54-Q56 PolarHBondContact O-N 3.24Å; H54-Q56 VanDerWaalsContact O-N 3.13Å; Q56-R59 PolarHBondContact O-N 3.38Å; Q56-K60 WeakPolarHBondContact O-CB 3.47Å; Q56-K60 WeakPolarHBondContact O-CG 3.45Å; Q56-K60 PolarHBondContact O-N 3.21Å
57E87.9Confident86.3Confident100 Ų10067 Ų6747%0.46732%0.316SS..Hα-helixtrans-70.1-42.4176.7-65.2179.7171.700110.6H54 R59 K60 N61 F64H54-E57 IonicContact CE1-OE2 3.72Å; H54-E57 IonicContact CG-OE2 3.7Å; H54-E57 IonicContact ND1-OE2 2.76Å; H54-E57 PolarHBondContact ND1-OE2 3.48Å; H54-E57 WeakPolarHBondContact O-CB 3.01Å; H54-E57 PolarHBondContact O-N 3.44Å; E57-R59 PolarHBondContact O-N 2.88Å; E57-K60 PolarHBondContact O-N 2.94Å; E57-N61 WeakPolarHBondContact O-CB 3.4Å; E57-N61 PolarHBondContact O-N 3.49Å; E57-F64 HydrophobicContact CB-CD1 3.72Å; E57-F64 HydrophobicContact CB-CE1 3.76Å
58I85.9Confident86.6Confident2 Ų266.9 Ų66.91%0.0132%0.315CS..Hα-helixtrans-58.6-36.6174.6-61.7173000110.8A51 H54 F64 R65 F68 V93A51-I58 HydrophobicContact CB-CD1 4.13Å; H54-I58 WeakPolarHBondContact O-CG1 3.44Å; H54-I58 PolarHBondContact O-N 3.41Å; I58-F64 HydrophobicContact CB-CD1 4.47Å; I58-F64 HydrophobicContact CD1-CE1 4.5Å; I58-F64 HydrophobicContact CG1-CD1 3.84Å; I58-F64 HydrophobicContact CG1-CE1 3.52Å; I58-R65 HydrophobicContact CG2-CG 4.08Å; I58-R65 PolarHBondContact O-NE 3.21Å; I58-F68 HydrophobicContact CD1-CD1 3.97Å; I58-F68 HydrophobicContact CD1-CD2 3.91Å; I58-F68 HydrophobicContact CD1-CE1 4.09Å; I58-F68 HydrophobicContact CD1-CE2 4.03Å; I58-F68 HydrophobicContact CD1-CG 3.88Å; I58-F68 HydrophobicContact CD1-CZ 4.12Å; I58-F68 HydrophobicContact CG1-CG 4.31Å; I58-F68 HydrophobicContact CG2-CD1 4.21Å; I58-V93 HydrophobicContact CG2-CG1 3.98Å
59R82.4Confident86.8Confident63 Ų6365.3 Ų65.324%0.23831%0.308CS..Hα-helixtrans-75.5-42.9179.3-76.2175.6176.7-156.9-6.2113K55 Q56 E57 R65 L91K55-R59 VanDerWaalsContact CE-CZ 3.45Å; K55-R59 VanDerWaalsContact CE-NH2 3.26Å; K55-R59 WeakPolarHBondContact O-CG 3.41Å; K55-R59 PolarHBondContact O-N 2.87Å; Q56-R59 PolarHBondContact O-N 3.38Å; E57-R59 PolarHBondContact O-N 2.88Å; R59-R65 PolarHBondContact O-NH2 3.19Å; R59-L91 VanDerWaalsContact CZ-O 3.29Å; R59-L91 PolarHBondContact NE-O 3.47Å; R59-L91 PolarHBondContact NH2-O 3.23Å
60K84.6Confident86.8Confident151 Ų15164.3 Ų64.366%0.65730%0.303SS*.Hα-helixtrans-89.9-28.6-171.7-70.5-176.2178.2-175.10114.5Q56 E57 P62Q56-K60 WeakPolarHBondContact O-CB 3.47Å; Q56-K60 WeakPolarHBondContact O-CG 3.45Å; Q56-K60 PolarHBondContact O-N 3.21Å; E57-K60 PolarHBondContact O-N 2.94Å; K60-P62 WeakPolarHBondContact O-CD 3.47Å
61N88.4Confident86.8Confident70 Ų7065 Ų6537%0.37431%0.308SS..  trans-109.4107.7-174.9-176.3-22.1000110.3E57 Q63 F64 R65E57-N61 WeakPolarHBondContact O-CB 3.4Å; E57-N61 PolarHBondContact O-N 3.49Å; N61-Q63 VanDerWaalsContact C-N 3.33Å; N61-Q63 PolarHBondContact O-N 2.99Å; N61-Q63 WeakPolarHBondContact OD1-CB 3.32Å; N61-Q63 PolarHBondContact OD1-N 3.39Å; N61-F64 HydrophobicContact CB-CB 3.91Å; N61-F64 PolarHBondContact O-N 3.11Å; N61-F64 PolarHBondContact OD1-N 2.97Å; N61-R65 PolarHBondContact O-N 3.44Å
62P88.8Confident86.8Confident26 Ų2665 Ų6517%0.16931%0.308CS..Hα-helixtrans-58.6-40.8178.4-23.533.2000113.1K60 F64 R65 V66 D138K60-P62 WeakPolarHBondContact O-CD 3.47Å; P62-F64 VanDerWaalsContact C-N 3.34Å; P62-F64 PolarHBondContact O-N 2.87Å; P62-R65 WeakPolarHBondContact O-CB 3.37Å; P62-R65 PolarHBondContact O-N 2.93Å; P62-V66 WeakPolarHBondContact O-CG2 3.4Å; P62-V66 PolarHBondContact O-N 3.48Å; P62-D138 HydrophobicContact CG-CB 3.62Å
63Q89.8Confident86.8Confident148 Ų14865.6 Ų65.669%0.69232%0.316SS*.Hα-helixtrans-62.6-42.8179.7-66.9-175-22.400111.8N61 R65 V66 Q67N61-Q63 VanDerWaalsContact C-N 3.33Å; N61-Q63 PolarHBondContact O-N 2.99Å; N61-Q63 WeakPolarHBondContact OD1-CB 3.32Å; N61-Q63 PolarHBondContact OD1-N 3.39Å; Q63-R65 VanDerWaalsContact C-N 3.3Å; Q63-R65 PolarHBondContact O-N 2.87Å; Q63-V66 PolarHBondContact O-N 3.28Å; Q63-Q67 WeakPolarHBondContact O-CG 3.39Å; Q63-Q67 PolarHBondContact O-N 3.24Å
64F90.3Very high86.4Confident35 Ų3563.6 Ų63.615%0.15432%0.318CS..Hα-helixtrans-67-35.4177.3-174.1-114.5000111.8F50 H54 E57 I58 N61 P62 Q67 F68F50-F64 AromaticContact CE1-CZ 3.84Å; F50-F64 HydrophobicContact CE1-CZ 3.84Å; F50-F64 HydrophobicContact CZ-CE2 4.05Å; F50-F64 AromaticContact CZ-CZ 3.6Å; F50-F64 HydrophobicContact CZ-CZ 3.6Å; H54-F64 HydrophobicContact CB-CE1 3.8Å; H54-F64 HydrophobicContact CB-CZ 3.93Å; E57-F64 HydrophobicContact CB-CD1 3.72Å; E57-F64 HydrophobicContact CB-CE1 3.76Å; I58-F64 HydrophobicContact CB-CD1 4.47Å; I58-F64 HydrophobicContact CD1-CE1 4.5Å; I58-F64 HydrophobicContact CG1-CD1 3.84Å; I58-F64 HydrophobicContact CG1-CE1 3.52Å; N61-F64 HydrophobicContact CB-CB 3.91Å; N61-F64 PolarHBondContact O-N 3.11Å; N61-F64 PolarHBondContact OD1-N 2.97Å; P62-F64 VanDerWaalsContact C-N 3.34Å; P62-F64 PolarHBondContact O-N 2.87Å; F64-Q67 PolarHBondContact O-N 2.93Å; F64-F68 WeakPolarHBondContact O-CB 3.49Å; F64-F68 PolarHBondContact O-N 3.17Å
65R89.5Confident85.9Confident4 Ų464 Ų642%0.01532%0.321CS..Hα-helixtrans-61.1-42.8173.9-164.4-171-60.7148.5-2.6112I58 R59 N61 P62 Q63 F68 Q69 F96 Y97 D138 D143I58-R65 HydrophobicContact CG2-CG 4.08Å; I58-R65 PolarHBondContact O-NE 3.21Å; R59-R65 PolarHBondContact O-NH2 3.19Å; N61-R65 PolarHBondContact O-N 3.44Å; P62-R65 WeakPolarHBondContact O-CB 3.37Å; P62-R65 PolarHBondContact O-N 2.93Å; Q63-R65 VanDerWaalsContact C-N 3.3Å; Q63-R65 PolarHBondContact O-N 2.87Å; R65-F68 PolarHBondContact O-N 3Å; R65-Q69 WeakPolarHBondContact O-CG 3.44Å; R65-Q69 PolarHBondContact O-N 3.34Å; R65-Q69 VanDerWaalsContact O-N 3.12Å; R65-F96 VanDerWaalsContact NH1-CE1 3.27Å; R65-Y97 WeakPolarHBondContact CD-OH 3.34Å; R65-D138 PolarHBondContact NH1-O 3.42Å; R65-D138 PolarHBondContact NH2-O 3.32Å; R65-D143 VanDerWaalsContact CD-OD1 3.23Å; R65-D143 WeakPolarHBondContact CD-OD1 3.18Å; R65-D143 IonicContact CZ-OD1 2.71Å; R65-D143 IonicContact NH1-OD1 3.09Å; R65-D143 PolarHBondContact NH1-OD1 3.29Å; R65-D143 IonicContact NH1-OD2 3.19Å; R65-D143 PolarHBondContact NH1-OD2 3.11Å
66V87.8Confident85.4Confident29 Ų2964.6 Ų64.618%0.17634%0.343CS..Hα-helixtrans-59.2-52175.4177.80000110.5P62 Q63 F68 Q69 E70 D142P62-V66 WeakPolarHBondContact O-CG2 3.4Å; P62-V66 PolarHBondContact O-N 3.48Å; Q63-V66 PolarHBondContact O-N 3.28Å; V66-F68 VanDerWaalsContact C-N 3.35Å; V66-F68 PolarHBondContact O-N 3.13Å; V66-Q69 PolarHBondContact O-N 2.94Å; V66-Q69 VanDerWaalsContact O-N 3.08Å; V66-E70 HydrophobicContact CG1-CG 4.41Å; V66-E70 WeakPolarHBondContact O-CG 3.22Å; V66-E70 PolarHBondContact O-N 3.38Å; V66-D142 HydrophobicContact CG2-CB 4.11Å; V66-D142 WeakPolarHBondContact CG2-OD2 3.07Å
67Q88.8Confident85.1Confident110 Ų11061.2 Ų61.251%0.51433%0.33SS..Hα-helixtrans-59.7-43.7-179.5-68.2172.8-2.600112.4Q63 F64 Q69 E70 M71Q63-Q67 WeakPolarHBondContact O-CG 3.39Å; Q63-Q67 PolarHBondContact O-N 3.24Å; F64-Q67 PolarHBondContact O-N 2.93Å; Q67-Q69 VanDerWaalsContact C-N 3.26Å; Q67-Q69 PolarHBondContact O-N 3.08Å; Q67-E70 PolarHBondContact O-N 3.03Å; Q67-M71 PolarHBondContact O-N 3.12Å
68F87.2Confident84.5Confident3 Ų360 Ų601%0.01333%0.327CS..Hα-helixtrans-57.8-41.7176174.1-107.8000111.4L47 F50 A51 I58 F64 R65 V66 M71 C72 W87 L91L47-F68 HydrophobicContact CD2-CE2 3.54Å; L47-F68 HydrophobicContact CD2-CZ 3.78Å; L47-F68 HydrophobicContact CG-CE2 4.39Å; F50-F68 HydrophobicContact CD1-CD2 4.2Å; F50-F68 HydrophobicContact CD1-CE2 4.3Å; F50-F68 HydrophobicContact CE1-CD2 4.1Å; A51-F68 HydrophobicContact CB-CE2 3.62Å; A51-F68 HydrophobicContact CB-CZ 3.63Å; I58-F68 HydrophobicContact CD1-CD1 3.97Å; I58-F68 HydrophobicContact CD1-CD2 3.91Å; I58-F68 HydrophobicContact CD1-CE1 4.09Å; I58-F68 HydrophobicContact CD1-CE2 4.03Å; I58-F68 HydrophobicContact CD1-CG 3.88Å; I58-F68 HydrophobicContact CD1-CZ 4.12Å; I58-F68 HydrophobicContact CG1-CG 4.31Å; I58-F68 HydrophobicContact CG2-CD1 4.21Å; F64-F68 WeakPolarHBondContact O-CB 3.49Å; F64-F68 PolarHBondContact O-N 3.17Å; R65-F68 PolarHBondContact O-N 3Å; V66-F68 VanDerWaalsContact C-N 3.35Å; V66-F68 PolarHBondContact O-N 3.13Å; F68-M71 WeakPolarHBondContact O-CB 3.42Å; F68-M71 PolarHBondContact O-N 3.39Å; F68-C72 PolarHBondContact O-N 3.04Å; F68-C72 VanDerWaalsContact O-N 3.11Å; F68-C72 PolarHBondContact O-SG 2.59Å; F68-W87 HydrophobicContact CZ-CE3 4.13Å; F68-W87 HydrophobicContact CZ-CZ3 4.07Å; F68-L91 HydrophobicContact CE1-CD1 4.08Å; F68-L91 HydrophobicContact CZ-CD1 3.87Å
69Q84.3Confident83.9Confident6 Ų660.2 Ų60.23%0.02833%0.329CS..Hα-helixtrans-77.4-32.4-178.9-66.8-175.723.900114R65 V66 Q67 M71 C72 A73 P79 Y97R65-Q69 WeakPolarHBondContact O-CG 3.44Å; R65-Q69 PolarHBondContact O-N 3.34Å; R65-Q69 VanDerWaalsContact O-N 3.12Å; V66-Q69 PolarHBondContact O-N 2.94Å; V66-Q69 VanDerWaalsContact O-N 3.08Å; Q67-Q69 VanDerWaalsContact C-N 3.26Å; Q67-Q69 PolarHBondContact O-N 3.08Å; Q69-M71 VanDerWaalsContact C-N 3.25Å; Q69-M71 PolarHBondContact O-N 2.75Å; Q69-C72 PolarHBondContact O-N 2.92Å; Q69-A73 WeakPolarHBondContact O-CB 3.45Å; Q69-A73 PolarHBondContact O-N 3.42Å; Q69-P79 HydrophobicContact CG-CG 4.21Å; Q69-Y97 VanDerWaalsContact NE2-CE2 3.26Å; Q69-Y97 VanDerWaalsContact NE2-CZ 3.35Å; Q69-Y97 PolarHBondContact NE2-OH 2.71Å
70E86.6Confident83.5Confident109 Ų10957.7 Ų57.751%0.50932%0.32SS..Hα-helixtrans-60.3-39.8170.2-72.8175.7170.600111.1V66 Q67 A73 T74V66-E70 HydrophobicContact CG1-CG 4.41Å; V66-E70 WeakPolarHBondContact O-CG 3.22Å; V66-E70 PolarHBondContact O-N 3.38Å; Q67-E70 PolarHBondContact O-N 3.03Å; E70-A73 PolarHBondContact O-N 2.67Å; E70-T74 PolarHBondContact O-N 3.33Å; E70-T74 PolarHBondContact O-OG1 3.17Å
71M84.2Confident82.7Confident76 Ų7653.9 Ų53.937%0.37432%0.316SS..Hα-helixtrans-60.2-50.2172.8-169.2-173.5-56.600111.1L47 Q67 F68 Q69 A73 T74 I75L47-M71 HydrophobicContact CD1-CG 4.12Å; L47-M71 HydrophobicContact CD1-SD 4.06Å; L47-M71 HydrophobicContact CG-SD 4.49Å; Q67-M71 PolarHBondContact O-N 3.12Å; F68-M71 WeakPolarHBondContact O-CB 3.42Å; F68-M71 PolarHBondContact O-N 3.39Å; Q69-M71 VanDerWaalsContact C-N 3.25Å; Q69-M71 PolarHBondContact O-N 2.75Å; M71-A73 VanDerWaalsContact C-N 3.35Å; M71-A73 PolarHBondContact O-N 2.9Å; M71-T74 PolarHBondContact O-N 3.03Å; M71-I75 VanDerWaalsContact O-CD1 3.29Å; M71-I75 WeakPolarHBondContact O-CD1 3.39Å
72C83.6Confident81.4Confident0 Ų053.2 Ų53.20%032%0.317CS..Hα-helixtrans-57.6-45.9176.7-64.10000112.1F68 Q69 T74 I75 G76 V77 P79F68-C72 PolarHBondContact O-N 3.04Å; F68-C72 VanDerWaalsContact O-N 3.11Å; F68-C72 PolarHBondContact O-SG 2.59Å; Q69-C72 PolarHBondContact O-N 2.92Å; C72-T74 PolarHBondContact O-N 3.16Å; C72-I75 PolarHBondContact O-N 3.38Å; C72-G76 PolarHBondContact O-N 2.84Å; C72-V77 CarbonylContact C-O 3.1Å; C72-V77 HydrophobicContact CB-CB 4.41Å; C72-V77 VanDerWaalsContact CB-O 3.26Å; C72-V77 WeakPolarHBondContact CB-O 3.4Å; C72-V77 PolarHBondContact O-N 3.49Å; C72-P79 HydrophobicContact CB-CG 4.19Å
73A83.7Confident79.9Confident67 Ų6753.9 Ų53.955%0.55433%0.329SS*.Hα-helixtrans-64.4-37-178.500000112.9Q69 E70 M71 I75 G76Q69-A73 WeakPolarHBondContact O-CB 3.45Å; Q69-A73 PolarHBondContact O-N 3.42Å; E70-A73 PolarHBondContact O-N 2.67Å; M71-A73 VanDerWaalsContact C-N 3.35Å; M71-A73 PolarHBondContact O-N 2.9Å; A73-I75 PolarHBondContact O-N 3.02Å; A73-I75 VanDerWaalsContact O-N 3.12Å; A73-G76 PolarHBondContact O-N 3.37Å
74T82.9Confident78.4Confident124 Ų12456 Ų5676%0.76134%0.336SS*.Hα-helixtrans-58.2-26.9177.7-59.50000112.3E70 M71 C72E70-T74 PolarHBondContact O-N 3.33Å; E70-T74 PolarHBondContact O-OG1 3.17Å; M71-T74 PolarHBondContact O-N 3.03Å; C72-T74 PolarHBondContact O-N 3.16Å
75I76.6Confident77.2Confident54 Ų5455.2 Ų55.228%0.27734%0.337SS..THydrogen-bonded Turntrans-99.9-5.5-177.3-57.6149.1000111.3L40 F43 L47 M71 C72 A73 V77L40-I75 HydrophobicContact CD2-CG2 3.85Å; F43-I75 HydrophobicContact CD1-CD1 3.44Å; F43-I75 VanDerWaalsContact CD1-CD1 3.44Å; F43-I75 HydrophobicContact CD1-CG1 4.36Å; F43-I75 HydrophobicContact CE1-CD1 2.98Å; F43-I75 HydrophobicContact CE1-CG1 4.17Å; F43-I75 HydrophobicContact CG-CD1 4.45Å; F43-I75 HydrophobicContact CZ-CD1 3.65Å; L47-I75 HydrophobicContact CD1-CD1 3.99Å; M71-I75 VanDerWaalsContact O-CD1 3.29Å; M71-I75 WeakPolarHBondContact O-CD1 3.39Å; C72-I75 PolarHBondContact O-N 3.38Å; A73-I75 PolarHBondContact O-N 3.02Å; A73-I75 VanDerWaalsContact O-N 3.12Å; I75-V77 VanDerWaalsContact C-N 3.34Å; I75-V77 HydrophobicContact CB-CG2 4.44Å; I75-V77 HydrophobicContact CG2-CG2 4.13Å
76G75.5Confident76Confident70 Ų7058.1 Ų58.172%0.72235%0.35SS*.THydrogen-bonded Turntrans77.820.2-173.500000113.4C72 A73C72-G76 PolarHBondContact O-N 2.84Å; A73-G76 PolarHBondContact O-N 3.37Å
77V77.9Confident75.1Confident38 Ų3857.6 Ų57.623%0.2335%0.345CS..  trans-94.5123.1171.6-178.80000108.7C72 I75 P79 W87C72-V77 CarbonylContact C-O 3.1Å; C72-V77 HydrophobicContact CB-CB 4.41Å; C72-V77 VanDerWaalsContact CB-O 3.26Å; C72-V77 WeakPolarHBondContact CB-O 3.4Å; C72-V77 PolarHBondContact O-N 3.49Å; I75-V77 VanDerWaalsContact C-N 3.34Å; I75-V77 HydrophobicContact CB-CG2 4.44Å; I75-V77 HydrophobicContact CG2-CG2 4.13Å; V77-P79 WeakPolarHBondContact O-CD 3.44Å; V77-W87 HydrophobicContact CG1-CZ2 4.21Å; V77-W87 VanDerWaalsContact CG1-NE1 3.31Å
78D75.3Confident74.1Confident74 Ų7452.6 Ų52.640%0.39632%0.322SS..  trans-103105.6172.8179.7-6.9000109.2L80 A81 K150D78-L80 PolarHBondContact O-N 3.3Å; D78-L80 WeakPolarHBondContact OD1-CA 3.23Å; D78-L80 WeakPolarHBondContact OD1-CB 3.41Å; D78-L80 PolarHBondContact OD1-N 2.94Å; D78-A81 HydrophobicContact CB-CB 3.84Å; D78-A81 WeakPolarHBondContact O-CB 3.34Å; D78-A81 PolarHBondContact O-N 2.96Å; D78-A81 VanDerWaalsContact O-N 3.16Å; D78-A81 PolarHBondContact OD1-N 3.39Å; D78-K150 VanDerWaalsContact CG-NZ 3.26Å; D78-K150 IonicContact OD1-NZ 2.77Å; D78-K150 PolarHBondContact OD1-NZ 2.88Å; D78-K150 IonicContact OD2-NZ 3.24Å; D78-K150 PolarHBondContact OD2-NZ 3.27Å
79P74.2Confident73.1Confident8 Ų860 Ų605%0.05236%0.357CS..THydrogen-bonded Turntrans-66.1-9.3-177.427.6-32.4000112.7Q69 C72 V77 W87 V93Q69-P79 HydrophobicContact CG-CG 4.21Å; C72-P79 HydrophobicContact CB-CG 4.19Å; V77-P79 WeakPolarHBondContact O-CD 3.44Å; P79-W87 HydrophobicContact CB-CB 3.9Å; P79-W87 HydrophobicContact CB-CG 4.03Å; P79-W87 WeakPolarHBondContact O-CB 3.33Å; P79-V93 HydrophobicContact CB-CG2 4.34Å
80L73.1Confident72.1Confident9 Ų964 Ų645%0.04738%0.377CS..THydrogen-bonded Turntrans-113.310.3-177.9-52.6-179.9000112.6D78 V93 Y97 K150D78-L80 PolarHBondContact O-N 3.3Å; D78-L80 WeakPolarHBondContact OD1-CA 3.23Å; D78-L80 WeakPolarHBondContact OD1-CB 3.41Å; D78-L80 PolarHBondContact OD1-N 2.94Å; L80-V93 HydrophobicContact CD2-CB 4.21Å; L80-V93 HydrophobicContact CD2-CG2 4.17Å; L80-Y97 HydrophobicContact CD1-CD1 4.11Å; L80-Y97 HydrophobicContact CD1-CD2 3.44Å; L80-Y97 VanDerWaalsContact CD1-CD2 3.44Å; L80-Y97 HydrophobicContact CD1-CE1 4.34Å; L80-Y97 HydrophobicContact CD1-CE2 3.68Å; L80-Y97 HydrophobicContact CD1-CG 3.67Å; L80-Y97 HydrophobicContact CD2-CD2 3.23Å; L80-Y97 HydrophobicContact CD2-CE2 3.79Å; L80-Y97 HydrophobicContact CD2-CG 4.03Å; L80-Y97 HydrophobicContact CG-CD2 3.95Å; L80-Y97 HydrophobicContact CG-CE2 4.3Å; L80-Y97 HydrophobicContact CG-CG 4.49Å; L80-K150 VanDerWaalsContact C-NZ 3.34Å; L80-K150 HydrophobicContact CB-CD 4.35Å; L80-K150 PolarHBondContact O-NZ 2.98Å
81A68.6Low71.1Confident71 Ų7158.9 Ų58.959%0.58735%0.353SS*.SBendtrans-75.1-28.1-178.100000113.7D78D78-A81 HydrophobicContact CB-CB 3.84Å; D78-A81 WeakPolarHBondContact O-CB 3.34Å; D78-A81 PolarHBondContact O-N 2.96Å; D78-A81 VanDerWaalsContact O-N 3.16Å; D78-A81 PolarHBondContact OD1-N 3.39Å
82S59.9Low70.5Confident56 Ų5655.6 Ų55.639%0.39234%0.339SS..  trans-146130-176.6-179.80000112.5K84 G85 S88S82-K84 PolarHBondContact O-N 3.38Å; S82-K84 PolarHBondContact OG-N 3.25Å; S82-K84 VanDerWaalsContact OG-N 3.16Å; S82-G85 PolarHBondContact O-N 2.66Å; S82-G85 PolarHBondContact OG-N 2.83Å; S82-S88 VanDerWaalsContact O-CB 3.28Å; S82-S88 WeakPolarHBondContact O-CB 3.42Å
83G58.8Low70Confident40 Ų4055.9 Ų55.941%0.41234%0.34SS..THydrogen-bonded Turntrans-65.5-18.5170.400000113.8Y98G83-Y98 PolarHBondContact N-OH 2.91Å
84K57.9Low69.8Low193 Ų19352.7 Ų52.784%0.83931%0.314SS*.THydrogen-bonded Turntrans-100.19171.4-67.2-171.8178.4-177.50113.1S82S82-K84 PolarHBondContact O-N 3.38Å; S82-K84 PolarHBondContact OG-N 3.25Å; S82-K84 VanDerWaalsContact OG-N 3.16Å
85G64.7Low69.8Low18 Ų1851.8 Ų51.819%0.18630%0.304CS..SBendtrans-78149174.200000110.5S82 W87 S88 E89S82-G85 PolarHBondContact O-N 2.66Å; S82-G85 PolarHBondContact OG-N 2.83Å; G85-W87 PolarHBondContact O-N 2.97Å; G85-S88 PolarHBondContact O-N 2.82Å; G85-E89 PolarHBondContact O-N 3.17Å; G85-E89 VanDerWaalsContact O-N 3.14Å
86F65.3Low70.2Confident65 Ų6549.8 Ų49.829%0.28529%0.294SS..Hα-helixtrans-43.7-42.6173.1175.2-87000112E48 S88 M90E48-F86 HydrophobicContact CB-CD1 4.09Å; E48-F86 HydrophobicContact CB-CE1 3.38Å; E48-F86 HydrophobicContact CB-CE2 4.29Å; E48-F86 HydrophobicContact CB-CZ 3.48Å; E48-F86 VanDerWaalsContact CB-CZ 3.48Å; E48-F86 HydrophobicContact CG-CD1 3.42Å; E48-F86 VanDerWaalsContact CG-CD1 3.42Å; E48-F86 HydrophobicContact CG-CD2 4.45Å; E48-F86 HydrophobicContact CG-CE1 3.26Å; E48-F86 HydrophobicContact CG-CE2 4.3Å; E48-F86 HydrophobicContact CG-CG 4.05Å; E48-F86 HydrophobicContact CG-CZ 3.73Å; F86-S88 PolarHBondContact O-N 2.79Å; F86-M90 HydrophobicContact CD1-CB 4.33Å; F86-M90 HydrophobicContact CD2-CB 4.43Å; F86-M90 HydrophobicContact CE1-CB 4Å; F86-M90 HydrophobicContact CE1-CG 4.14Å; F86-M90 HydrophobicContact CE2-CB 4.15Å; F86-M90 HydrophobicContact CE2-CE 4.36Å; F86-M90 HydrophobicContact CE2-CG 4.1Å; F86-M90 HydrophobicContact CZ-CB 3.92Å; F86-M90 HydrophobicContact CZ-CE 4.39Å; F86-M90 HydrophobicContact CZ-CG 3.7Å; F86-M90 WeakPolarHBondContact O-CB 3.12Å; F86-M90 PolarHBondContact O-N 3.28Å
87W67.8Low70.8Confident19 Ų1946.8 Ų46.87%0.07226%0.261CS..Hα-helixtrans-62.2-43.1-179-53.1111.9000113.6L47 E48 A51 F68 V77 P79 G85 L91 V93L47-W87 HydrophobicContact CB-CH2 3.97Å; L47-W87 HydrophobicContact CD2-CE3 4.25Å; L47-W87 HydrophobicContact CD2-CH2 3.01Å; L47-W87 HydrophobicContact CD2-CZ2 3.77Å; L47-W87 HydrophobicContact CD2-CZ3 3.28Å; L47-W87 HydrophobicContact CG-CH2 4.04Å; E48-W87 HydrophobicContact CB-CH2 4.16Å; E48-W87 HydrophobicContact CG-CH2 3.43Å; E48-W87 VanDerWaalsContact CG-CH2 3.43Å; E48-W87 HydrophobicContact CG-CZ2 3.77Å; E48-W87 HydrophobicContact CG-CZ3 4.14Å; A51-W87 HydrophobicContact CB-CE3 4.44Å; A51-W87 HydrophobicContact CB-CZ3 3.83Å; F68-W87 HydrophobicContact CZ-CE3 4.13Å; F68-W87 HydrophobicContact CZ-CZ3 4.07Å; V77-W87 HydrophobicContact CG1-CZ2 4.21Å; V77-W87 VanDerWaalsContact CG1-NE1 3.31Å; P79-W87 HydrophobicContact CB-CB 3.9Å; P79-W87 HydrophobicContact CB-CG 4.03Å; P79-W87 WeakPolarHBondContact O-CB 3.33Å; G85-W87 PolarHBondContact O-N 2.97Å; W87-L91 HydrophobicContact CE3-CD1 3.62Å; W87-L91 HydrophobicContact CZ3-CD1 4.21Å; W87-L91 WeakPolarHBondContact O-CB 3.28Å; W87-L91 PolarHBondContact O-N 2.95Å; W87-V93 HydrophobicContact CB-CG2 4.35Å; W87-V93 WeakPolarHBondContact O-CG2 3.42Å
88S68.4Low71.2Confident4 Ų449.7 Ų49.73%0.02827%0.268CS..Hα-helixtrans-71.3-47.8179.4-1680000110.9S82 G85 F86 G92S82-S88 VanDerWaalsContact O-CB 3.28Å; S82-S88 WeakPolarHBondContact O-CB 3.42Å; G85-S88 PolarHBondContact O-N 2.82Å; F86-S88 PolarHBondContact O-N 2.79Å; S88-G92 WeakPolarHBondContact O-CA 3.42Å; S88-G92 PolarHBondContact O-N 2.92Å
89E66.4Low71.9Confident158 Ų15851 Ų5174%0.73827%0.272SS*.Hα-helixtrans-71.5-42.5-175.2-166.9170.4-169.300112.4G85G85-E89 PolarHBondContact O-N 3.17Å; G85-E89 VanDerWaalsContact O-N 3.14Å
90M63.4Low72.7Confident91 Ų9150.6 Ų50.645%0.44827%0.269SS..Hα-helixtrans-81.2-36.9-176.2-165.759.9133.300112.5K55 F86K55-M90 WeakPolarHBondContact CD-O 3.26Å; K55-M90 VanDerWaalsContact CE-O 3.23Å; K55-M90 WeakPolarHBondContact CE-O 3.44Å; K55-M90 PolarHBondContact NZ-O 2.99Å; F86-M90 HydrophobicContact CD1-CB 4.33Å; F86-M90 HydrophobicContact CD2-CB 4.43Å; F86-M90 HydrophobicContact CE1-CB 4Å; F86-M90 HydrophobicContact CE1-CG 4.14Å; F86-M90 HydrophobicContact CE2-CB 4.15Å; F86-M90 HydrophobicContact CE2-CE 4.36Å; F86-M90 HydrophobicContact CE2-CG 4.1Å; F86-M90 HydrophobicContact CZ-CB 3.92Å; F86-M90 HydrophobicContact CZ-CE 4.39Å; F86-M90 HydrophobicContact CZ-CG 3.7Å; F86-M90 WeakPolarHBondContact O-CB 3.12Å; F86-M90 PolarHBondContact O-N 3.28Å
91L65.2Low73.6Confident1 Ų150.3 Ų50.31%0.00527%0.268CS..Hα-helixtrans-103.3-19.7-173.8-49.9174.9000113.6A51 K55 R59 F68 W87 V93A51-L91 HydrophobicContact CB-CD1 3.43Å; A51-L91 VanDerWaalsContact CB-CD1 3.43Å; A51-L91 HydrophobicContact CB-CD2 3.55Å; A51-L91 HydrophobicContact CB-CG 4.08Å; A51-L91 WeakPolarHBondContact O-CD2 3.28Å; K55-L91 HydrophobicContact CB-CD2 4.35Å; K55-L91 HydrophobicContact CG-CD2 4.44Å; R59-L91 VanDerWaalsContact CZ-O 3.29Å; R59-L91 PolarHBondContact NE-O 3.47Å; R59-L91 PolarHBondContact NH2-O 3.23Å; F68-L91 HydrophobicContact CE1-CD1 4.08Å; F68-L91 HydrophobicContact CZ-CD1 3.87Å; W87-L91 HydrophobicContact CE3-CD1 3.62Å; W87-L91 HydrophobicContact CZ3-CD1 4.21Å; W87-L91 WeakPolarHBondContact O-CB 3.28Å; W87-L91 PolarHBondContact O-N 2.95Å; L91-V93 HydrophobicContact CB-CB 4.49Å; L91-V93 HydrophobicContact CB-CG1 3.84Å; L91-V93 HydrophobicContact CB-CG2 4.19Å; L91-V93 HydrophobicContact CD1-CG1 4.42Å; L91-V93 PolarHBondContact O-N 3.05Å
92G70.9Confident74.7Confident8 Ų850.6 Ų50.68%0.08226%0.263CS..  trans60.722.8-170.900000113.1S88 G94 F96S88-G92 WeakPolarHBondContact O-CA 3.42Å; S88-G92 PolarHBondContact O-N 2.92Å; G92-G94 VanDerWaalsContact C-N 3.32Å; G92-F96 PolarHBondContact O-N 3.41Å
93V73.8Confident76.3Confident6 Ų649.4 Ų49.44%0.03625%0.251CS..Hα-helixtrans-67.4-36.1173.8-700000110.6I58 P79 L80 W87 L91 F96 Y97I58-V93 HydrophobicContact CG2-CG1 3.98Å; P79-V93 HydrophobicContact CB-CG2 4.34Å; L80-V93 HydrophobicContact CD2-CB 4.21Å; L80-V93 HydrophobicContact CD2-CG2 4.17Å; W87-V93 HydrophobicContact CB-CG2 4.35Å; W87-V93 WeakPolarHBondContact O-CG2 3.42Å; L91-V93 HydrophobicContact CB-CB 4.49Å; L91-V93 HydrophobicContact CB-CG1 3.84Å; L91-V93 HydrophobicContact CB-CG2 4.19Å; L91-V93 HydrophobicContact CD1-CG1 4.42Å; L91-V93 PolarHBondContact O-N 3.05Å; V93-F96 PolarHBondContact O-N 3.33Å; V93-Y97 VanDerWaalsContact O-CD2 3.23Å; V93-Y97 WeakPolarHBondContact O-CD2 3.18Å; V93-Y97 PolarHBondContact O-N 3.23Å
94G79.1Confident78Confident0 Ų047.5 Ų47.50%023%0.231CC..Hα-helixtrans-57.9-54.1173.800000111.9G92 F96 Y97 Y98G92-G94 VanDerWaalsContact C-N 3.32Å; G94-F96 VanDerWaalsContact C-N 3.29Å; G94-F96 PolarHBondContact O-N 3.42Å; G94-Y97 PolarHBondContact O-N 3Å; G94-Y98 WeakPolarHBondContact O-CD2 3.23Å; G94-Y98 PolarHBondContact O-N 3.32Å
95D82.3Confident79.6Confident104 Ų10440.6 Ų40.656%0.55620%0.203SC*.Hα-helixtrans-54.4-43.3179.9-60.5-12.5000112.5Y97 Y98 E99D95-Y97 PolarHBondContact O-N 3.16Å; D95-Y98 PolarHBondContact O-N 2.82Å; D95-E99 WeakPolarHBondContact O-CB 3.32Å; D95-E99 PolarHBondContact O-N 3.11Å
96F86.6Confident80.9Confident12 Ų1245.3 Ų45.35%0.05322%0.221CC..Hα-helixtrans-58.6-46.8176.4168.8-96.4000112.4R65 G92 V93 G94 L100 Q137 V139 D143R65-F96 VanDerWaalsContact NH1-CE1 3.27Å; G92-F96 PolarHBondContact O-N 3.41Å; V93-F96 PolarHBondContact O-N 3.33Å; G94-F96 VanDerWaalsContact C-N 3.29Å; G94-F96 PolarHBondContact O-N 3.42Å; F96-L100 HydrophobicContact CE1-CD2 4.19Å; F96-L100 HydrophobicContact CZ-CD2 4.24Å; F96-L100 VanDerWaalsContact O-CB 3.28Å; F96-L100 WeakPolarHBondContact O-CB 3.3Å; F96-L100 PolarHBondContact O-N 2.99Å; F96-Q137 HydrophobicContact CD2-CB 4.28Å; F96-Q137 HydrophobicContact CE2-CB 3.99Å; F96-V139 HydrophobicContact CE2-CG2 4.37Å; F96-V139 HydrophobicContact CZ-CG2 4.18Å; F96-D143 HydrophobicContact CE1-CB 4.3Å; F96-D143 HydrophobicContact CZ-CB 4.5Å
97Y88.1Confident82.2Confident7 Ų743.4 Ų43.43%0.02721%0.214CC..Hα-helixtrans-74.6-29.1-179.9-78.2-76.4000113R65 Q69 L80 V93 G94 D95 L100 G101 D143 R146 A147R65-Y97 WeakPolarHBondContact CD-OH 3.34Å; Q69-Y97 VanDerWaalsContact NE2-CE2 3.26Å; Q69-Y97 VanDerWaalsContact NE2-CZ 3.35Å; Q69-Y97 PolarHBondContact NE2-OH 2.71Å; L80-Y97 HydrophobicContact CD1-CD1 4.11Å; L80-Y97 HydrophobicContact CD1-CD2 3.44Å; L80-Y97 VanDerWaalsContact CD1-CD2 3.44Å; L80-Y97 HydrophobicContact CD1-CE1 4.34Å; L80-Y97 HydrophobicContact CD1-CE2 3.68Å; L80-Y97 HydrophobicContact CD1-CG 3.67Å; L80-Y97 HydrophobicContact CD2-CD2 3.23Å; L80-Y97 HydrophobicContact CD2-CE2 3.79Å; L80-Y97 HydrophobicContact CD2-CG 4.03Å; L80-Y97 HydrophobicContact CG-CD2 3.95Å; L80-Y97 HydrophobicContact CG-CE2 4.3Å; L80-Y97 HydrophobicContact CG-CG 4.49Å; V93-Y97 VanDerWaalsContact O-CD2 3.23Å; V93-Y97 WeakPolarHBondContact O-CD2 3.18Å; V93-Y97 PolarHBondContact O-N 3.23Å; G94-Y97 PolarHBondContact O-N 3Å; D95-Y97 PolarHBondContact O-N 3.16Å; Y97-L100 HydrophobicContact CD1-CD2 4.36Å; Y97-G101 PolarHBondContact O-N 2.58Å; Y97-D143 HydrophobicContact CE1-CB 3.99Å; Y97-D143 WeakPolarHBondContact CE1-O 3.23Å; Y97-D143 PolarHBondContact OH-OD1 3.46Å; Y97-R146 HydrophobicContact CD1-CB 4.38Å; Y97-R146 HydrophobicContact CE1-CB 3.9Å; Y97-A147 HydrophobicContact CD1-CB 4.22Å
98Y86.1Confident83.4Confident100 Ų10042.7 Ų42.739%0.39221%0.212SC..Hα-helixtrans-68.3-46172.8-59.5-35.6000111G83 G94 D95 L100 G101 V102G83-Y98 PolarHBondContact N-OH 2.91Å; G94-Y98 WeakPolarHBondContact O-CD2 3.23Å; G94-Y98 PolarHBondContact O-N 3.32Å; D95-Y98 PolarHBondContact O-N 2.82Å; Y98-L100 VanDerWaalsContact C-N 3.34Å; Y98-L100 PolarHBondContact O-N 2.88Å; Y98-G101 PolarHBondContact O-N 3.32Å; Y98-V102 WeakPolarHBondContact O-CG2 3.47Å; Y98-V102 PolarHBondContact O-N 3.45Å
99E88.9Confident84.5Confident100 Ų10048.1 Ų48.147%0.46724%0.24SC..Hα-helixtrans-59.5-45.8173.3-170.8-161.5147.300111.1D95 G101 V102 Q103D95-E99 WeakPolarHBondContact O-CB 3.32Å; D95-E99 PolarHBondContact O-N 3.11Å; E99-G101 VanDerWaalsContact C-N 3.3Å; E99-G101 PolarHBondContact O-N 3.29Å; E99-V102 PolarHBondContact O-N 3.08Å; E99-Q103 WeakPolarHBondContact O-CG 3.41Å; E99-Q103 PolarHBondContact O-N 3.17Å; E99-Q103 PolarHBondContact OE1-NE2 2.74Å
100L92.1Very high85.7Confident0 Ų043.5 Ų43.50%023%0.229CC..Hα-helixtrans-61.6-39176.3-174.760.6000111.8F96 Y97 Y98 Q103 I104 V128 V139 D143 L144 A147F96-L100 HydrophobicContact CE1-CD2 4.19Å; F96-L100 HydrophobicContact CZ-CD2 4.24Å; F96-L100 VanDerWaalsContact O-CB 3.28Å; F96-L100 WeakPolarHBondContact O-CB 3.3Å; F96-L100 PolarHBondContact O-N 2.99Å; Y97-L100 HydrophobicContact CD1-CD2 4.36Å; Y98-L100 VanDerWaalsContact C-N 3.34Å; Y98-L100 PolarHBondContact O-N 2.88Å; L100-Q103 PolarHBondContact O-N 2.91Å; L100-I104 HydrophobicContact CG-CD1 4.09Å; L100-I104 WeakPolarHBondContact O-CD1 3.28Å; L100-I104 VanDerWaalsContact O-CG1 3.24Å; L100-I104 WeakPolarHBondContact O-CG1 3.33Å; L100-I104 PolarHBondContact O-N 3.3Å; L100-V128 HydrophobicContact CD1-CG1 3.7Å; L100-V139 HydrophobicContact CD1-CG1 3.87Å; L100-V139 HydrophobicContact CD1-CG2 4.11Å; L100-V139 HydrophobicContact CD2-CG1 3.95Å; L100-D143 HydrophobicContact CD2-CB 3.72Å; L100-L144 HydrophobicContact CD1-CD2 3.81Å; L100-L144 HydrophobicContact CD2-CD2 4.29Å; L100-L144 HydrophobicContact CG-CD2 4.24Å; L100-A147 HydrophobicContact CB-CB 4.44Å; L100-A147 HydrophobicContact CD2-CB 4.03Å; L100-A147 HydrophobicContact CG-CB 4.06Å
101G92.1Very high86.9Confident3 Ų339.6 Ų39.63%0.03121%0.21CC..Hα-helixtrans-60.2-43.6174.500000112.5Y97 Y98 E99 I104 I105Y97-G101 PolarHBondContact O-N 2.58Å; Y98-G101 PolarHBondContact O-N 3.32Å; E99-G101 VanDerWaalsContact C-N 3.3Å; E99-G101 PolarHBondContact O-N 3.29Å; G101-I104 PolarHBondContact O-N 3.25Å; G101-I105 VanDerWaalsContact O-CG1 3.29Å; G101-I105 WeakPolarHBondContact O-CG1 3.37Å; G101-I105 PolarHBondContact O-N 3.01Å
102V91.6Very high88.1Confident77 Ų7744.4 Ų44.447%0.46723%0.231SC..Hα-helixtrans-62-46.7175.21750000111Y98 E99 I104 I105 E106Y98-V102 WeakPolarHBondContact O-CG2 3.47Å; Y98-V102 PolarHBondContact O-N 3.45Å; E99-V102 PolarHBondContact O-N 3.08Å; V102-I104 VanDerWaalsContact C-N 3.32Å; V102-I104 PolarHBondContact O-N 2.97Å; V102-I105 WeakPolarHBondContact O-CB 3.4Å; V102-I105 PolarHBondContact O-N 3.14Å; V102-I105 VanDerWaalsContact O-N 3.08Å; V102-E106 HydrophobicContact CG1-CG 4.37Å; V102-E106 WeakPolarHBondContact O-CG 3.44Å; V102-E106 PolarHBondContact O-N 3.32Å
103Q92.7Very high88.9Confident31 Ų3150.9 Ų50.915%0.14526%0.258CS..Hα-helixtrans-60.6-40177.8-71.7168.4-700112.5E99 L100 I105 E106 V107E99-Q103 WeakPolarHBondContact O-CG 3.41Å; E99-Q103 PolarHBondContact O-N 3.17Å; E99-Q103 PolarHBondContact OE1-NE2 2.74Å; L100-Q103 PolarHBondContact O-N 2.91Å; Q103-I105 VanDerWaalsContact C-N 3.34Å; Q103-E106 PolarHBondContact O-N 2.99Å; Q103-V107 WeakPolarHBondContact O-CG2 3.35Å; Q103-V107 PolarHBondContact O-N 3.22Å
104I94.4Very high89.5Confident0 Ų053.1 Ų53.10%027%0.266CS..Hα-helixtrans-61.4-44.5174.4-70.9163.2000110.4L100 G101 V102 C108 L124 V128 L144 A147 I148 L151 F158L100-I104 HydrophobicContact CG-CD1 4.09Å; L100-I104 WeakPolarHBondContact O-CD1 3.28Å; L100-I104 VanDerWaalsContact O-CG1 3.24Å; L100-I104 WeakPolarHBondContact O-CG1 3.33Å; L100-I104 PolarHBondContact O-N 3.3Å; G101-I104 PolarHBondContact O-N 3.25Å; V102-I104 VanDerWaalsContact C-N 3.32Å; V102-I104 PolarHBondContact O-N 2.97Å; I104-C108 VanDerWaalsContact O-CB 3.32Å; I104-C108 WeakPolarHBondContact O-CB 3.33Å; I104-C108 PolarHBondContact O-N 3.49Å; I104-C108 PolarHBondContact O-SG 2.69Å; I104-L124 HydrophobicContact CG1-CD1 4.49Å; I104-L124 HydrophobicContact CG1-CD2 4.38Å; I104-L124 HydrophobicContact CG2-CD1 4.36Å; I104-L124 HydrophobicContact CG2-CD2 4.11Å; I104-V128 HydrophobicContact CG1-CG2 4.28Å; I104-L144 HydrophobicContact CD1-CB 4.5Å; I104-L144 HydrophobicContact CD1-CD2 3.78Å; I104-L144 HydrophobicContact CG1-CD2 3.9Å; I104-A147 HydrophobicContact CD1-CB 3.55Å; I104-I148 HydrophobicContact CD1-CG1 4.15Å; I104-I148 HydrophobicContact CG2-CG1 4.25Å; I104-L151 HydrophobicContact CB-CD1 4.4Å; I104-L151 HydrophobicContact CG2-CD1 4.05Å; I104-F158 HydrophobicContact CG2-CE1 3.9Å
105I92.4Very high90.1Very high48 Ų4853.6 Ų53.625%0.24627%0.269CS..Hα-helixtrans-61.4-46.5177.7-68162.5000110.8G101 V102 Q103 C108 L109 L151 F158G101-I105 VanDerWaalsContact O-CG1 3.29Å; G101-I105 WeakPolarHBondContact O-CG1 3.37Å; G101-I105 PolarHBondContact O-N 3.01Å; V102-I105 WeakPolarHBondContact O-CB 3.4Å; V102-I105 PolarHBondContact O-N 3.14Å; V102-I105 VanDerWaalsContact O-N 3.08Å; Q103-I105 VanDerWaalsContact C-N 3.34Å; I105-C108 PolarHBondContact O-N 3.02Å; I105-L109 HydrophobicContact CG2-CD1 3.73Å; I105-L109 HydrophobicContact CG2-CG 4.21Å; I105-L109 WeakPolarHBondContact O-CB 3.35Å; I105-L109 WeakPolarHBondContact O-CG 3.48Å; I105-L109 PolarHBondContact O-N 2.97Å; I105-L151 HydrophobicContact CD1-CD1 4.34Å; I105-L151 HydrophobicContact CD1-CD2 3.78Å; I105-L151 HydrophobicContact CG1-CD1 3.99Å; I105-L151 HydrophobicContact CG1-CD2 4.36Å; I105-F158 HydrophobicContact CB-CZ 4.37Å; I105-F158 HydrophobicContact CG1-CE2 3.82Å; I105-F158 HydrophobicContact CG1-CZ 3.68Å
106E91.8Very high90.4Very high118 Ų11849.4 Ų49.455%0.55125%0.25SS*.Hα-helixtrans-60-47.9179.8-72.2173.2165.800112V102 Q103 C108 L109 A110V102-E106 HydrophobicContact CG1-CG 4.37Å; V102-E106 WeakPolarHBondContact O-CG 3.44Å; V102-E106 PolarHBondContact O-N 3.32Å; Q103-E106 PolarHBondContact O-N 2.99Å; E106-C108 PolarHBondContact O-N 3.39Å; E106-L109 PolarHBondContact O-N 3.03Å; E106-A110 WeakPolarHBondContact O-CB 3.47Å; E106-A110 PolarHBondContact O-N 3.41Å
107V93Very high90.7Very high25 Ų2548.9 Ų48.915%0.15225%0.248CC..Hα-helixtrans-60.4-46.7176.9170.70000110.9Q103 L109 A110 L111 I119 L124 R127 V128Q103-V107 WeakPolarHBondContact O-CG2 3.35Å; Q103-V107 PolarHBondContact O-N 3.22Å; V107-L109 PolarHBondContact O-N 3.49Å; V107-A110 PolarHBondContact O-N 3.24Å; V107-L111 HydrophobicContact CG1-CD1 3.91Å; V107-L111 WeakPolarHBondContact O-CG 3.5Å; V107-L111 PolarHBondContact O-N 3.03Å; V107-I119 HydrophobicContact CG1-CD1 4.3Å; V107-L124 HydrophobicContact CB-CD1 4.11Å; V107-L124 HydrophobicContact CG1-CD1 3.77Å; V107-R127 HydrophobicContact CG1-CB 3.61Å; V107-R127 HydrophobicContact CG1-CG 4.13Å; V107-R127 HydrophobicContact CG2-CB 4.11Å; V107-V128 HydrophobicContact CG2-CG2 4.16Å
108C93Very high90.9Very high4 Ų448.6 Ų48.63%0.02725%0.247CC..Hα-helixtrans-63.2-41.6179.3-77.80000112.5I104 I105 E106 L111 K112 F158 S171I104-C108 VanDerWaalsContact O-CB 3.32Å; I104-C108 WeakPolarHBondContact O-CB 3.33Å; I104-C108 PolarHBondContact O-N 3.49Å; I104-C108 PolarHBondContact O-SG 2.69Å; I105-C108 PolarHBondContact O-N 3.02Å; E106-C108 PolarHBondContact O-N 3.39Å; C108-L111 PolarHBondContact O-N 3.31Å; C108-K112 PolarHBondContact O-N 3.16Å; C108-F158 HydrophobicContact CB-CE1 4.38Å; C108-F158 HydrophobicContact CB-CZ 4.37Å; C108-S171 VanDerWaalsContact CB-CB 3.47Å
109L90.7Very high91.3Very high117 Ų11744 Ų4461%0.61323%0.229SC*.Hα-helixtrans-65.2-42.4175.8-75.7174000111.7I105 E106 V107 L111 K112I105-L109 HydrophobicContact CG2-CD1 3.73Å; I105-L109 HydrophobicContact CG2-CG 4.21Å; I105-L109 WeakPolarHBondContact O-CB 3.35Å; I105-L109 WeakPolarHBondContact O-CG 3.48Å; I105-L109 PolarHBondContact O-N 2.97Å; E106-L109 PolarHBondContact O-N 3.03Å; V107-L109 PolarHBondContact O-N 3.49Å; L109-L111 VanDerWaalsContact C-N 3.28Å; L109-L111 PolarHBondContact O-N 3.15Å; L109-K112 PolarHBondContact O-N 2.79Å
110A90.7Very high91.4Very high61 Ų6140.7 Ų40.750%0.50422%0.216SC..Hα-helixtrans-62.1-36.1178.300000112E106 V107 H113E106-A110 WeakPolarHBondContact O-CB 3.47Å; E106-A110 PolarHBondContact O-N 3.41Å; V107-A110 PolarHBondContact O-N 3.24Å; A110-H113 PolarHBondContact O-CE1 3.37Å; A110-H113 PolarHBondContact O-ND1 2.68Å
111L89.9Confident91.5Very high10 Ų1041 Ų415%0.05222%0.217CC..Hα-helixtrans-93.8-12.1-176.2-64.4174.6000114.8V107 C108 L109 H113 R114 N115 I119 R127V107-L111 HydrophobicContact CG1-CD1 3.91Å; V107-L111 WeakPolarHBondContact O-CG 3.5Å; V107-L111 PolarHBondContact O-N 3.03Å; C108-L111 PolarHBondContact O-N 3.31Å; L109-L111 VanDerWaalsContact C-N 3.28Å; L109-L111 PolarHBondContact O-N 3.15Å; L111-H113 PolarHBondContact O-N 2.93Å; L111-H113 VanDerWaalsContact O-N 3.09Å; L111-R114 PolarHBondContact O-N 3.38Å; L111-N115 PolarHBondContact O-N 2.89Å; L111-N115 VanDerWaalsContact O-N 3.1Å; L111-N115 PolarHBondContact O-OD1 3.38Å; L111-N115 VanDerWaalsContact O-OD1 3.06Å; L111-I119 HydrophobicContact CD1-CD1 3.59Å; L111-R127 HydrophobicContact CD1-CG 4.27Å
112K89.5Confident91.4Very high102 Ų10244.4 Ų44.444%0.44324%0.235SC..Hα-helixtrans-48.6-42.6-178.1179.3-178.3174.5-178.60113.4C108 L109 R114 G116 V172C108-K112 PolarHBondContact O-N 3.16Å; L109-K112 PolarHBondContact O-N 2.79Å; K112-R114 PolarHBondContact O-N 3.47Å; K112-G116 WeakPolarHBondContact O-CA 3.44Å; K112-G116 PolarHBondContact O-N 3.33Å; K112-V172 HydrophobicContact CD-CG2 3.91Å; K112-V172 HydrophobicContact CG-CG2 4.08Å
113H87.3Confident91.4Very high143 Ų14342.1 Ų42.166%0.66222%0.219SC*.Hα-helixtrans-65.9-22.1-178.871.4-80.7000113.5A110 L111A110-H113 PolarHBondContact O-CE1 3.37Å; A110-H113 PolarHBondContact O-ND1 2.68Å; L111-H113 PolarHBondContact O-N 2.93Å; L111-H113 VanDerWaalsContact O-N 3.09Å
114R87.9Confident91.4Very high53 Ų5340.7 Ų40.720%0.221%0.213CC..Hα-helixtrans-95.3-38.6-179.8-56.7-170.7176.4-169.7-4.4112.6L111 K112 P237L111-R114 PolarHBondContact O-N 3.38Å; K112-R114 PolarHBondContact O-N 3.47Å; R114-P237 WeakPolarHBondContact O-CB 3.37Å
115N90.6Very high91.4Very high10 Ų1041.8 Ų41.85%0.05322%0.218CC..Hα-helixtrans-118.65.9-169.267.816.4000115L111 G117 L118 P237 A238L111-N115 PolarHBondContact O-N 2.89Å; L111-N115 VanDerWaalsContact O-N 3.1Å; L111-N115 PolarHBondContact O-OD1 3.38Å; L111-N115 VanDerWaalsContact O-OD1 3.06Å; N115-G117 PolarHBondContact O-N 2.91Å; N115-G117 VanDerWaalsContact O-N 3.1Å; N115-G117 PolarHBondContact OD1-N 2.93Å; N115-L118 VanDerWaalsContact CB-O 3.28Å; N115-L118 WeakPolarHBondContact CB-O 3.28Å; N115-L118 PolarHBondContact ND2-O 2.87Å; N115-L118 PolarHBondContact O-N 3.44Å; N115-L118 PolarHBondContact OD1-O 3.47Å; N115-P237 HydrophobicContact CB-CB 4.4Å; N115-A238 HydrophobicContact CB-CB 4.46Å
116G89.4Confident91.3Very high16 Ų1645.3 Ų45.317%0.16523%0.233CC..THydrogen-bonded Turntrans695.4177.100000114.6K112 G220 L221K112-G116 WeakPolarHBondContact O-CA 3.44Å; K112-G116 PolarHBondContact O-N 3.33Å; G116-G220 WeakPolarHBondContact CA-O 3.39Å; G116-L221 WeakPolarHBondContact O-CD2 3.39Å
117G91.7Very high91.2Very high1 Ų141.5 Ų41.51%0.0121%0.214CC..THydrogen-bonded Turntrans100.113.5-177.900000115.3N115 Q170 S171N115-G117 PolarHBondContact O-N 2.91Å; N115-G117 VanDerWaalsContact O-N 3.1Å; N115-G117 PolarHBondContact OD1-N 2.93Å; G117-Q170 WeakPolarHBondContact O-CA 3.47Å; G117-S171 PolarHBondContact O-N 3.28Å; G117-S171 PolarHBondContact O-OG 3.26Å
118L93.1Very high91.2Very high2 Ų240.4 Ų40.41%0.0121%0.207CC..EExtended strand (participates in β ladder)trans-111.4136.8168-71.4178.9000110.5N115 I161 V169 Q170 L184 L221 A238N115-L118 VanDerWaalsContact CB-O 3.28Å; N115-L118 WeakPolarHBondContact CB-O 3.28Å; N115-L118 PolarHBondContact ND2-O 2.87Å; N115-L118 PolarHBondContact O-N 3.44Å; N115-L118 PolarHBondContact OD1-O 3.47Å; L118-I161 HydrophobicContact CD2-CD1 3.99Å; L118-V169 WeakPolarHBondContact CA-O 3.44Å; L118-Q170 HydrophobicContact CD2-CB 3.88Å; L118-Q170 HydrophobicContact CD2-CG 4.24Å; L118-L184 HydrophobicContact CD1-CD1 4.21Å; L118-L184 HydrophobicContact CD1-CD2 4.17Å; L118-L221 HydrophobicContact CB-CD2 4.44Å; L118-L221 HydrophobicContact CD1-CB 4.45Å; L118-L221 HydrophobicContact CD1-CD1 3.99Å; L118-L221 HydrophobicContact CD1-CD2 3.83Å; L118-L221 HydrophobicContact CD1-CG 4.31Å; L118-L221 HydrophobicContact CG-CD2 3.76Å; L118-A238 HydrophobicContact CB-CB 3.55Å; L118-A238 WeakPolarHBondContact O-CB 3.47Å
119I93.3Very high91Very high2 Ų243 Ų431%0.0122%0.22CC..EExtended strand (participates in β ladder)trans-145.4143.4176.4-171.6171.7000109.9V107 L111 E123 L124 L168 V169V107-I119 HydrophobicContact CG1-CD1 4.3Å; L111-I119 HydrophobicContact CD1-CD1 3.59Å; I119-E123 HydrophobicContact CD1-CB 4.21Å; I119-E123 HydrophobicContact CD1-CG 4.04Å; I119-E123 HydrophobicContact CG1-CB 3.91Å; I119-E123 HydrophobicContact CG1-CG 4.16Å; I119-L124 HydrophobicContact CD1-CB 4.08Å; I119-L124 HydrophobicContact CD1-CD1 4.49Å; I119-L124 HydrophobicContact CG1-CB 4.37Å; I119-L124 HydrophobicContact CG2-CB 4.26Å; I119-L168 CarbonylContact O-C 3.56Å; I119-L168 WeakPolarHBondContact O-CA 3.11Å; I119-V169 HydrophobicContact CG2-CB 3.89Å; I119-V169 PolarHBondContact N-O 3.19Å; I119-V169 VanDerWaalsContact N-O 3.07Å; I119-V169 PolarHBondContact O-N 3.41Å
120T92.9Very high90.9Very high31 Ų3144.4 Ų44.419%0.1922%0.222CC..EExtended strand (participates in β ladder)trans-68.1148.6172.657.30000110.8D122 E123 L124 L168 A238 L239T120-D122 PolarHBondContact O-N 2.98Å; T120-E123 PolarHBondContact O-N 3.46Å; T120-E123 VanDerWaalsContact OG1-CB 3.24Å; T120-E123 WeakPolarHBondContact OG1-CB 3.28Å; T120-E123 PolarHBondContact OG1-N 3.2Å; T120-E123 VanDerWaalsContact OG1-N 3.13Å; T120-L124 WeakPolarHBondContact O-CB 3.47Å; T120-L124 PolarHBondContact O-N 3.45Å; T120-L168 HydrophobicContact CG2-CD2 3.88Å; T120-A238 WeakPolarHBondContact CG2-O 3.24Å; T120-L239 HydrophobicContact CG2-CD2 4.2Å
121L93.1Very high90.5Very high6 Ų644.8 Ų44.83%0.03123%0.232CC..Hα-helixtrans-58.8-35.6175.1-173.863.7000111.5H125 Q141 L144 V145 I148 Y167 V169L121-H125 VanDerWaalsContact O-CB 3.29Å; L121-H125 WeakPolarHBondContact O-CB 3.36Å; L121-H125 PolarHBondContact O-N 3.39Å; L121-Q141 HydrophobicContact CD2-CB 4.19Å; L121-L144 HydrophobicContact CD1-CB 3.95Å; L121-L144 HydrophobicContact CD1-CD1 4.11Å; L121-V145 HydrophobicContact CD1-CG2 4.23Å; L121-V145 HydrophobicContact CD2-CG2 3.75Å; L121-I148 HydrophobicContact CD1-CD1 4.49Å; L121-Y167 WeakPolarHBondContact CB-O 3.42Å; L121-Y167 HydrophobicContact CD2-CD2 4.32Å; L121-Y167 PolarHBondContact N-O 3.39Å; L121-V169 HydrophobicContact CD1-CG2 4.28Å
122D91.3Very high90.2Very high75 Ų7545.5 Ų45.540%0.40123%0.234SC..Hα-helixtrans-64.3-49.4176.3-62.3-57.1000111.8T120 H125 Q126 Q141 S166T120-D122 PolarHBondContact O-N 2.98Å; D122-H125 WeakPolarHBondContact O-CB 3.42Å; D122-H125 PolarHBondContact O-N 2.97Å; D122-Q126 WeakPolarHBondContact O-CG 3.22Å; D122-Q126 PolarHBondContact O-N 2.85Å; D122-Q141 PolarHBondContact OD1-NE2 2.88Å; D122-S166 PolarHBondContact OD2-OG 3.03Å
123E90.6Very high89.6Confident30 Ų3043.2 Ų43.214%0.1424%0.238CC..Hα-helixtrans-64.1-44.1177.2-172.7-175.217800111.2I119 T120 H125 Q126 R127I119-E123 HydrophobicContact CD1-CB 4.21Å; I119-E123 HydrophobicContact CD1-CG 4.04Å; I119-E123 HydrophobicContact CG1-CB 3.91Å; I119-E123 HydrophobicContact CG1-CG 4.16Å; T120-E123 PolarHBondContact O-N 3.46Å; T120-E123 VanDerWaalsContact OG1-CB 3.24Å; T120-E123 WeakPolarHBondContact OG1-CB 3.28Å; T120-E123 PolarHBondContact OG1-N 3.2Å; T120-E123 VanDerWaalsContact OG1-N 3.13Å; E123-H125 VanDerWaalsContact C-N 3.26Å; E123-H125 PolarHBondContact O-N 3.37Å; E123-Q126 PolarHBondContact O-N 3.18Å; E123-R127 HydrophobicContact CG-CG 4.09Å; E123-R127 WeakPolarHBondContact O-CB 3.48Å; E123-R127 WeakPolarHBondContact O-CG 3.5Å; E123-R127 PolarHBondContact O-N 3Å; E123-R127 IonicContact OE1-CZ 3.67Å; E123-R127 IonicContact OE1-NE 2.97Å; E123-R127 PolarHBondContact OE1-NE 3.46Å; E123-R127 IonicContact OE1-NH2 3.27Å; E123-R127 PolarHBondContact OE1-NH2 2.86Å
124L93.5Very high89Confident0 Ų045.6 Ų45.60%025%0.247CC..Hα-helixtrans-56.5-43.6176.217961.6000111I104 V107 I119 T120 R127 V128 L144 I148 V169I104-L124 HydrophobicContact CG1-CD1 4.49Å; I104-L124 HydrophobicContact CG1-CD2 4.38Å; I104-L124 HydrophobicContact CG2-CD1 4.36Å; I104-L124 HydrophobicContact CG2-CD2 4.11Å; V107-L124 HydrophobicContact CB-CD1 4.11Å; V107-L124 HydrophobicContact CG1-CD1 3.77Å; I119-L124 HydrophobicContact CD1-CB 4.08Å; I119-L124 HydrophobicContact CD1-CD1 4.49Å; I119-L124 HydrophobicContact CG1-CB 4.37Å; I119-L124 HydrophobicContact CG2-CB 4.26Å; T120-L124 WeakPolarHBondContact O-CB 3.47Å; T120-L124 PolarHBondContact O-N 3.45Å; L124-R127 PolarHBondContact O-N 2.88Å; L124-V128 HydrophobicContact CD1-CG2 4.04Å; L124-V128 HydrophobicContact CG-CG2 4.41Å; L124-V128 WeakPolarHBondContact O-CB 3.45Å; L124-V128 VanDerWaalsContact O-CG2 3.26Å; L124-V128 WeakPolarHBondContact O-CG2 3.38Å; L124-V128 PolarHBondContact O-N 3.34Å; L124-L144 HydrophobicContact CG-CD1 4.48Å; L124-I148 HydrophobicContact CD2-CD1 3.99Å; L124-V169 HydrophobicContact CD2-CB 4.31Å; L124-V169 HydrophobicContact CD2-CG1 4.31Å; L124-V169 HydrophobicContact CD2-CG2 3.86Å
125H92.9Very high88.1Confident24 Ų2453.4 Ų53.411%0.11128%0.278CS..Hα-helixtrans-61.2-48.2177.4-175.8-137.6000112.4L121 D122 E123 R127 V128 L129 V139 Q141 L144L121-H125 VanDerWaalsContact O-CB 3.29Å; L121-H125 WeakPolarHBondContact O-CB 3.36Å; L121-H125 PolarHBondContact O-N 3.39Å; D122-H125 WeakPolarHBondContact O-CB 3.42Å; D122-H125 PolarHBondContact O-N 2.97Å; E123-H125 VanDerWaalsContact C-N 3.26Å; E123-H125 PolarHBondContact O-N 3.37Å; H125-R127 VanDerWaalsContact C-N 3.34Å; H125-R127 PolarHBondContact O-N 2.85Å; H125-V128 PolarHBondContact O-N 2.8Å; H125-L129 WeakPolarHBondContact O-CB 3.43Å; H125-L129 WeakPolarHBondContact O-CG 3.12Å; H125-L129 PolarHBondContact O-N 2.88Å; H125-V139 PolarHBondContact NE2-O 2.86Å; H125-Q141 HydrophobicContact CB-CG 4.35Å; H125-L144 VanDerWaalsContact CA-CD1 3.5Å; H125-L144 HydrophobicContact CB-CD1 3.5Å; H125-L144 VanDerWaalsContact CB-CD1 3.5Å
126Q90.9Very high87.5Confident121 Ų12154.7 Ų54.757%0.56529%0.29SS*.Hα-helixtrans-61.7-41.5177.5-65.8-54.9-42.300112.2D122 E123 L129 K130D122-Q126 WeakPolarHBondContact O-CG 3.22Å; D122-Q126 PolarHBondContact O-N 2.85Å; E123-Q126 PolarHBondContact O-N 3.18Å; Q126-L129 PolarHBondContact O-N 3.47Å; Q126-K130 WeakPolarHBondContact O-CB 3.42Å; Q126-K130 PolarHBondContact O-N 2.88Å
127R90.4Very high87Confident38 Ų3856.9 Ų56.914%0.14330%0.296CS..Hα-helixtrans-66.5-44.3179.5-65.9-82.5-171.6157.55.8111.9V107 L111 E123 L124 H125 L129 K130 G131 D247V107-R127 HydrophobicContact CG1-CB 3.61Å; V107-R127 HydrophobicContact CG1-CG 4.13Å; V107-R127 HydrophobicContact CG2-CB 4.11Å; L111-R127 HydrophobicContact CD1-CG 4.27Å; E123-R127 HydrophobicContact CG-CG 4.09Å; E123-R127 WeakPolarHBondContact O-CB 3.48Å; E123-R127 WeakPolarHBondContact O-CG 3.5Å; E123-R127 PolarHBondContact O-N 3Å; E123-R127 IonicContact OE1-CZ 3.67Å; E123-R127 IonicContact OE1-NE 2.97Å; E123-R127 PolarHBondContact OE1-NE 3.46Å; E123-R127 IonicContact OE1-NH2 3.27Å; E123-R127 PolarHBondContact OE1-NH2 2.86Å; L124-R127 PolarHBondContact O-N 2.88Å; H125-R127 VanDerWaalsContact C-N 3.34Å; H125-R127 PolarHBondContact O-N 2.85Å; R127-L129 VanDerWaalsContact C-N 3.35Å; R127-K130 PolarHBondContact O-N 3.15Å; R127-G131 PolarHBondContact O-N 3.03Å; R127-D247 IonicContact NH1-OD1 2.79Å; R127-D247 PolarHBondContact NH1-OD1 3.23Å
128V92.4Very high86.7Confident2 Ų261.7 Ų61.71%0.01232%0.321CS..Hα-helixtrans-62.5-43176.3169.20000110.6L100 I104 V107 L124 H125 K130 G131 R132 L144L100-V128 HydrophobicContact CD1-CG1 3.7Å; I104-V128 HydrophobicContact CG1-CG2 4.28Å; V107-V128 HydrophobicContact CG2-CG2 4.16Å; L124-V128 HydrophobicContact CD1-CG2 4.04Å; L124-V128 HydrophobicContact CG-CG2 4.41Å; L124-V128 WeakPolarHBondContact O-CB 3.45Å; L124-V128 VanDerWaalsContact O-CG2 3.26Å; L124-V128 WeakPolarHBondContact O-CG2 3.38Å; L124-V128 PolarHBondContact O-N 3.34Å; H125-V128 PolarHBondContact O-N 2.8Å; V128-K130 PolarHBondContact O-N 3.06Å; V128-G131 PolarHBondContact O-N 3.37Å; V128-R132 WeakPolarHBondContact O-CG 3.43Å; V128-R132 PolarHBondContact O-N 3.23Å; V128-L144 HydrophobicContact CB-CD2 4.48Å; V128-L144 HydrophobicContact CG1-CD2 4.37Å; V128-L144 HydrophobicContact CG2-CD2 4.21Å
129L89.9Confident86.6Confident59 Ų5962 Ų6231%0.30932%0.323SS..Hα-helixtrans-64-39.5175.8-71.9179.1000112.4H125 Q126 R127 R132 V139H125-L129 WeakPolarHBondContact O-CB 3.43Å; H125-L129 WeakPolarHBondContact O-CG 3.12Å; H125-L129 PolarHBondContact O-N 2.88Å; Q126-L129 PolarHBondContact O-N 3.47Å; R127-L129 VanDerWaalsContact C-N 3.35Å; L129-R132 PolarHBondContact O-N 3.05Å; L129-V139 HydrophobicContact CD2-CB 4.18Å
130K87.6Confident86.5Confident147 Ų14763.1 Ų63.164%0.63933%0.331SS*.Hα-helixtrans-65.8-36.8177.2-170.8-172.5177.4-163.80112.5Q126 R127 V128 R132 D247Q126-K130 WeakPolarHBondContact O-CB 3.42Å; Q126-K130 PolarHBondContact O-N 2.88Å; R127-K130 PolarHBondContact O-N 3.15Å; V128-K130 PolarHBondContact O-N 3.06Å; K130-R132 VanDerWaalsContact C-N 3.26Å; K130-R132 PolarHBondContact O-N 3.21Å; K130-D247 IonicContact NZ-OD2 3.89Å; K130-D247 PolarHBondContact NZ-OD2 3.34Å
131G83.1Confident86.4Confident69 Ų6965.1 Ų65.171%0.71134%0.339SS*.Hα-helixtrans-74.5-15.1176.600000113.9R127 V128R127-G131 PolarHBondContact O-N 3.03Å; V128-G131 PolarHBondContact O-N 3.37Å
132R82.4Confident86.3Confident25 Ų2567.3 Ų67.39%0.09435%0.35CS..SBendtrans-82.4136.3180-84.3179.8174.9-118.7-9.7111.6V128 L129 K130 A136 Q137V128-R132 WeakPolarHBondContact O-CG 3.43Å; V128-R132 PolarHBondContact O-N 3.23Å; L129-R132 PolarHBondContact O-N 3.05Å; K130-R132 VanDerWaalsContact C-N 3.26Å; K130-R132 PolarHBondContact O-N 3.21Å; R132-A136 HydrophobicContact CB-CB 3.71Å; R132-A136 HydrophobicContact CG-CB 3.94Å; R132-Q137 PolarHBondContact NH1-O 2.86Å
133G77.2Confident86.4Confident53 Ų5363.7 Ų63.755%0.54633%0.331SS..  trans-70.7164.6176.900000113Y135 A136G133-Y135 PolarHBondContact O-N 3.17Å; G133-A136 VanDerWaalsContact O-CB 3.26Å; G133-A136 WeakPolarHBondContact O-CB 3.5Å; G133-A136 PolarHBondContact O-N 3.44Å
134K74.1Confident86.5Confident194 Ų19462.3 Ų62.384%0.84332%0.324SS*.THydrogen-bonded Turntrans-53.9-22.7-178.8-172.5175.8179.8-179.30115.2
135Y71Confident86.5Confident216 Ų21663 Ų6385%0.84733%0.329SS*.THydrogen-bonded Turntrans-107.55.8-179.1-58-71.7000113.5G133G133-Y135 PolarHBondContact O-N 3.17Å
136A76.2Confident86.3Confident37 Ų3764 Ų6431%0.30633%0.332SS..SBendtrans-69151.5176.500000110.6R132 G133R132-A136 HydrophobicContact CB-CB 3.71Å; R132-A136 HydrophobicContact CG-CB 3.94Å; G133-A136 VanDerWaalsContact O-CB 3.26Å; G133-A136 WeakPolarHBondContact O-CB 3.5Å; G133-A136 PolarHBondContact O-N 3.44Å
137Q79.8Confident86.4Confident62 Ų6258.4 Ų58.429%0.2931%0.306SS..PPolyproline II helixtrans-67.7144.7174.3-67.7177.33.300110.6F96 R132F96-Q137 HydrophobicContact CD2-CB 4.28Å; F96-Q137 HydrophobicContact CE2-CB 3.99Å; R132-Q137 PolarHBondContact NH1-O 2.86Å
138D84.9Confident86.4Confident102 Ų10256.7 Ų56.755%0.54530%0.3SS..PPolyproline II helixtrans-63.1143.9173.9-71.2-28.7000111.2P62 R65P62-D138 HydrophobicContact CG-CB 3.62Å; R65-D138 PolarHBondContact NH1-O 3.42Å; R65-D138 PolarHBondContact NH2-O 3.32Å
139V90.8Very high86.3Confident8 Ų862.7 Ų62.75%0.04833%0.326CS..  trans-122.7128.6-177.6-177.50000108.4F96 L100 H125 L129 D143 L144F96-V139 HydrophobicContact CE2-CG2 4.37Å; F96-V139 HydrophobicContact CZ-CG2 4.18Å; L100-V139 HydrophobicContact CD1-CG1 3.87Å; L100-V139 HydrophobicContact CD1-CG2 4.11Å; L100-V139 HydrophobicContact CD2-CG1 3.95Å; H125-V139 PolarHBondContact NE2-O 2.86Å; L129-V139 HydrophobicContact CD2-CB 4.18Å; V139-D143 HydrophobicContact CG1-CB 3.92Å; V139-L144 HydrophobicContact CG1-CD2 4.03Å; V139-L144 HydrophobicContact CG1-CG 4.14Å
140S92Very high86Confident26 Ų2662.5 Ų62.518%0.18232%0.322CS..  trans-94.7165.6168.867.10000111.3D142 D143 L144S140-D142 PolarHBondContact O-N 3.23Å; S140-D143 WeakPolarHBondContact CB-OD2 3.09Å; S140-D143 PolarHBondContact N-OD2 3.3Å; S140-D143 WeakPolarHBondContact O-CB 3.3Å; S140-D143 PolarHBondContact O-N 2.89Å; S140-D143 VanDerWaalsContact O-N 3.15Å; S140-D143 VanDerWaalsContact OG-CG 3.24Å; S140-D143 PolarHBondContact OG-N 3.22Å; S140-D143 PolarHBondContact OG-OD2 3.1Å; S140-L144 PolarHBondContact O-N 3.1Å
141Q91.4Very high86Confident74 Ų7456.3 Ų56.335%0.34630%0.296SS..Hα-helixtrans-62.1-34.2172.8-67.7-173.9-1700112.6L121 D122 H125 D143 L144 V145L121-Q141 HydrophobicContact CD2-CB 4.19Å; D122-Q141 PolarHBondContact OD1-NE2 2.88Å; H125-Q141 HydrophobicContact CB-CG 4.35Å; Q141-D143 VanDerWaalsContact C-N 3.27Å; Q141-D143 PolarHBondContact O-N 3.21Å; Q141-L144 WeakPolarHBondContact O-CB 3.48Å; Q141-L144 PolarHBondContact O-N 3.13Å; Q141-L144 VanDerWaalsContact O-N 3.16Å; Q141-V145 WeakPolarHBondContact O-CG2 3.49Å; Q141-V145 PolarHBondContact O-N 3.17Å
142D91.1Very high86Confident51 Ų5159.5 Ų59.527%0.27329%0.29SS..Hα-helixtrans-62.8-36.3175.4-179.465.1000111.3V66 S140 L144 V145 R146V66-D142 HydrophobicContact CG2-CB 4.11Å; V66-D142 WeakPolarHBondContact CG2-OD2 3.07Å; S140-D142 PolarHBondContact O-N 3.23Å; D142-L144 VanDerWaalsContact C-N 3.33Å; D142-L144 PolarHBondContact O-N 3.29Å; D142-V145 PolarHBondContact O-N 2.76Å; D142-R146 VanDerWaalsContact CG-NE 3.34Å; D142-R146 VanDerWaalsContact O-CG 3.28Å; D142-R146 WeakPolarHBondContact O-CG 3.33Å; D142-R146 PolarHBondContact O-N 2.93Å; D142-R146 IonicContact OD1-CZ 2.76Å; D142-R146 IonicContact OD1-NE 2.71Å; D142-R146 PolarHBondContact OD1-NE 3.19Å; D142-R146 IonicContact OD1-NH2 2.93Å; D142-R146 PolarHBondContact OD1-NH2 3.4Å; D142-R146 IonicContact OD2-CZ 2.69Å; D142-R146 IonicContact OD2-NE 3.89Å; D142-R146 PolarHBondContact OD2-NE 2.74Å; D142-R146 IonicContact OD2-NH2 2.97Å; D142-R146 PolarHBondContact OD2-NH2 3.35Å
143D91.9Very high85.8Confident0 Ų064.2 Ų64.20%032%0.322CS..Hα-helixtrans-61.1-42.1173.6-64.3-62.1000112.3R65 F96 Y97 L100 V139 S140 Q141 R146 A147R65-D143 VanDerWaalsContact CD-OD1 3.23Å; R65-D143 WeakPolarHBondContact CD-OD1 3.18Å; R65-D143 IonicContact CZ-OD1 2.71Å; R65-D143 IonicContact NH1-OD1 3.09Å; R65-D143 PolarHBondContact NH1-OD1 3.29Å; R65-D143 IonicContact NH1-OD2 3.19Å; R65-D143 PolarHBondContact NH1-OD2 3.11Å; F96-D143 HydrophobicContact CE1-CB 4.3Å; F96-D143 HydrophobicContact CZ-CB 4.5Å; Y97-D143 HydrophobicContact CE1-CB 3.99Å; Y97-D143 WeakPolarHBondContact CE1-O 3.23Å; Y97-D143 PolarHBondContact OH-OD1 3.46Å; L100-D143 HydrophobicContact CD2-CB 3.72Å; V139-D143 HydrophobicContact CG1-CB 3.92Å; S140-D143 WeakPolarHBondContact CB-OD2 3.09Å; S140-D143 PolarHBondContact N-OD2 3.3Å; S140-D143 WeakPolarHBondContact O-CB 3.3Å; S140-D143 PolarHBondContact O-N 2.89Å; S140-D143 VanDerWaalsContact O-N 3.15Å; S140-D143 VanDerWaalsContact OG-CG 3.24Å; S140-D143 PolarHBondContact OG-N 3.22Å; S140-D143 PolarHBondContact OG-OD2 3.1Å; Q141-D143 VanDerWaalsContact C-N 3.27Å; Q141-D143 PolarHBondContact O-N 3.21Å; D143-R146 PolarHBondContact O-N 3Å; D143-A147 WeakPolarHBondContact O-CB 3.4Å; D143-A147 PolarHBondContact O-N 3.27Å
144L93.6Very high85.7Confident0 Ų069 Ų690%033%0.331CS..Hα-helixtrans-63.8-47.5176.8-61.5173.1000111.2L100 I104 L121 L124 H125 V128 V139 S140 Q141 D142 R146 A147 I148L100-L144 HydrophobicContact CD1-CD2 3.81Å; L100-L144 HydrophobicContact CD2-CD2 4.29Å; L100-L144 HydrophobicContact CG-CD2 4.24Å; I104-L144 HydrophobicContact CD1-CB 4.5Å; I104-L144 HydrophobicContact CD1-CD2 3.78Å; I104-L144 HydrophobicContact CG1-CD2 3.9Å; L121-L144 HydrophobicContact CD1-CB 3.95Å; L121-L144 HydrophobicContact CD1-CD1 4.11Å; L124-L144 HydrophobicContact CG-CD1 4.48Å; H125-L144 VanDerWaalsContact CA-CD1 3.5Å; H125-L144 HydrophobicContact CB-CD1 3.5Å; H125-L144 VanDerWaalsContact CB-CD1 3.5Å; V128-L144 HydrophobicContact CB-CD2 4.48Å; V128-L144 HydrophobicContact CG1-CD2 4.37Å; V128-L144 HydrophobicContact CG2-CD2 4.21Å; V139-L144 HydrophobicContact CG1-CD2 4.03Å; V139-L144 HydrophobicContact CG1-CG 4.14Å; S140-L144 PolarHBondContact O-N 3.1Å; Q141-L144 WeakPolarHBondContact O-CB 3.48Å; Q141-L144 PolarHBondContact O-N 3.13Å; Q141-L144 VanDerWaalsContact O-N 3.16Å; D142-L144 VanDerWaalsContact C-N 3.33Å; D142-L144 PolarHBondContact O-N 3.29Å; L144-R146 PolarHBondContact O-N 2.93Å; L144-A147 PolarHBondContact O-N 2.96Å; L144-I148 WeakPolarHBondContact O-CB 3.46Å; L144-I148 WeakPolarHBondContact O-CD1 3.45Å; L144-I148 VanDerWaalsContact O-CG1 3.22Å; L144-I148 WeakPolarHBondContact O-CG1 3.49Å; L144-I148 PolarHBondContact O-N 3.33Å
145V92.6Very high85.8Confident16 Ų1661.2 Ų61.210%0.09731%0.307CS..Hα-helixtrans-56.1-42.3177.9167.40000110.7L121 Q141 D142 K149 M160L121-V145 HydrophobicContact CD1-CG2 4.23Å; L121-V145 HydrophobicContact CD2-CG2 3.75Å; Q141-V145 WeakPolarHBondContact O-CG2 3.49Å; Q141-V145 PolarHBondContact O-N 3.17Å; D142-V145 PolarHBondContact O-N 2.76Å; V145-K149 HydrophobicContact CG1-CD 4.28Å; V145-K149 VanDerWaalsContact O-CG 3.3Å; V145-K149 WeakPolarHBondContact O-CG 3.34Å; V145-K149 PolarHBondContact O-N 2.93Å; V145-M160 HydrophobicContact CB-SD 4.29Å; V145-M160 HydrophobicContact CG1-CE 3.92Å; V145-M160 HydrophobicContact CG1-SD 3.89Å; V145-M160 HydrophobicContact CG2-SD 4.16Å
146R89.4Confident85.8Confident45 Ų4558 Ų5817%0.1730%0.304CS..Hα-helixtrans-69.1-44177.6-67.7-178.9-157.9-113.60.1112.4Y97 D142 D143 L144 I148 K149 K150Y97-R146 HydrophobicContact CD1-CB 4.38Å; Y97-R146 HydrophobicContact CE1-CB 3.9Å; D142-R146 VanDerWaalsContact CG-NE 3.34Å; D142-R146 VanDerWaalsContact O-CG 3.28Å; D142-R146 WeakPolarHBondContact O-CG 3.33Å; D142-R146 PolarHBondContact O-N 2.93Å; D142-R146 IonicContact OD1-CZ 2.76Å; D142-R146 IonicContact OD1-NE 2.71Å; D142-R146 PolarHBondContact OD1-NE 3.19Å; D142-R146 IonicContact OD1-NH2 2.93Å; D142-R146 PolarHBondContact OD1-NH2 3.4Å; D142-R146 IonicContact OD2-CZ 2.69Å; D142-R146 IonicContact OD2-NE 3.89Å; D142-R146 PolarHBondContact OD2-NE 2.74Å; D142-R146 IonicContact OD2-NH2 2.97Å; D142-R146 PolarHBondContact OD2-NH2 3.35Å; D143-R146 PolarHBondContact O-N 3Å; L144-R146 PolarHBondContact O-N 2.93Å; R146-I148 VanDerWaalsContact C-N 3.33Å; R146-I148 PolarHBondContact O-N 2.71Å; R146-K149 PolarHBondContact O-N 3.09Å; R146-K150 WeakPolarHBondContact O-CG 3.48Å; R146-K150 PolarHBondContact O-N 3.03Å; R146-K150 VanDerWaalsContact O-N 3.08Å
147A91.9Very high85.9Confident2 Ų257.2 Ų57.22%0.01730%0.3CS..Hα-helixtrans-58.2-45.6174.800000111.3Y97 L100 I104 D143 L144 K149 K150 L151Y97-A147 HydrophobicContact CD1-CB 4.22Å; L100-A147 HydrophobicContact CB-CB 4.44Å; L100-A147 HydrophobicContact CD2-CB 4.03Å; L100-A147 HydrophobicContact CG-CB 4.06Å; I104-A147 HydrophobicContact CD1-CB 3.55Å; D143-A147 WeakPolarHBondContact O-CB 3.4Å; D143-A147 PolarHBondContact O-N 3.27Å; L144-A147 PolarHBondContact O-N 2.96Å; A147-K149 PolarHBondContact O-N 3.22Å; A147-K150 CarbonylContact O-C 3.56Å; A147-K150 WeakPolarHBondContact O-CA 3.29Å; A147-K150 WeakPolarHBondContact O-CB 3.33Å; A147-K150 PolarHBondContact O-N 3.27Å; A147-L151 WeakPolarHBondContact O-CG 3.36Å; A147-L151 PolarHBondContact O-N 2.92Å
148I92.3Very high86.4Confident3 Ų355.7 Ų55.72%0.01529%0.293CS..Hα-helixtrans-62.5-43.5178.1-65.7160000111.5I104 L121 L124 L144 R146 K150 L151 K152 F158 M160 V169I104-I148 HydrophobicContact CD1-CG1 4.15Å; I104-I148 HydrophobicContact CG2-CG1 4.25Å; L121-I148 HydrophobicContact CD1-CD1 4.49Å; L124-I148 HydrophobicContact CD2-CD1 3.99Å; L144-I148 WeakPolarHBondContact O-CB 3.46Å; L144-I148 WeakPolarHBondContact O-CD1 3.45Å; L144-I148 VanDerWaalsContact O-CG1 3.22Å; L144-I148 WeakPolarHBondContact O-CG1 3.49Å; L144-I148 PolarHBondContact O-N 3.33Å; R146-I148 VanDerWaalsContact C-N 3.33Å; R146-I148 PolarHBondContact O-N 2.71Å; I148-K150 PolarHBondContact O-N 3.13Å; I148-L151 WeakPolarHBondContact O-CB 3.42Å; I148-L151 PolarHBondContact O-N 3.27Å; I148-L151 VanDerWaalsContact O-N 3.1Å; I148-K152 PolarHBondContact O-N 3.42Å; I148-K152 VanDerWaalsContact O-N 3.1Å; I148-F158 HydrophobicContact CG2-CB 4.46Å; I148-M160 HydrophobicContact CB-SD 4.45Å; I148-M160 HydrophobicContact CG2-CG 3.71Å; I148-M160 HydrophobicContact CG2-SD 4.23Å; I148-V169 HydrophobicContact CD1-CB 4.32Å; I148-V169 HydrophobicContact CD1-CG1 3.76Å; I148-V169 HydrophobicContact CD1-CG2 3.55Å; I148-V169 HydrophobicContact CG1-CG1 4.27Å; I148-V169 HydrophobicContact CG2-CG1 4.46Å
149K88.9Confident86.6Confident128 Ų12851.5 Ų51.556%0.55727%0.273SS*.Hα-helixtrans-57.6-34174-76.4172.6-178.2174.70111.9V145 R146 A147 K152V145-K149 HydrophobicContact CG1-CD 4.28Å; V145-K149 VanDerWaalsContact O-CG 3.3Å; V145-K149 WeakPolarHBondContact O-CG 3.34Å; V145-K149 PolarHBondContact O-N 2.93Å; R146-K149 PolarHBondContact O-N 3.09Å; A147-K149 PolarHBondContact O-N 3.22Å; K149-K152 WeakPolarHBondContact O-CB 3.41Å
150K84.7Confident86.6Confident55 Ų5553.8 Ų53.824%0.23928%0.284CS..Hα-helixtrans-75.2-38.4174.8-64.2-69.1172.3164.90112.3D78 L80 R146 A147 I148 K152 V153D78-K150 VanDerWaalsContact CG-NZ 3.26Å; D78-K150 IonicContact OD1-NZ 2.77Å; D78-K150 PolarHBondContact OD1-NZ 2.88Å; D78-K150 IonicContact OD2-NZ 3.24Å; D78-K150 PolarHBondContact OD2-NZ 3.27Å; L80-K150 VanDerWaalsContact C-NZ 3.34Å; L80-K150 HydrophobicContact CB-CD 4.35Å; L80-K150 PolarHBondContact O-NZ 2.98Å; R146-K150 WeakPolarHBondContact O-CG 3.48Å; R146-K150 PolarHBondContact O-N 3.03Å; R146-K150 VanDerWaalsContact O-N 3.08Å; A147-K150 CarbonylContact O-C 3.56Å; A147-K150 WeakPolarHBondContact O-CA 3.29Å; A147-K150 WeakPolarHBondContact O-CB 3.33Å; A147-K150 PolarHBondContact O-N 3.27Å; I148-K150 PolarHBondContact O-N 3.13Å; K150-K152 PolarHBondContact O-N 3.43Å; K150-V153 WeakPolarHBondContact O-CG2 3.26Å; K150-V153 PolarHBondContact O-N 3.29Å; K150-V153 VanDerWaalsContact O-N 3.13Å
151L87.4Confident86.6Confident16 Ų1653.1 Ų53.18%0.08428%0.278CS..Hα-helixtrans-59.7-29.5174.1-67.5-180000112.7I104 I105 A147 I148 V153 M154 F158I104-L151 HydrophobicContact CB-CD1 4.4Å; I104-L151 HydrophobicContact CG2-CD1 4.05Å; I105-L151 HydrophobicContact CD1-CD1 4.34Å; I105-L151 HydrophobicContact CD1-CD2 3.78Å; I105-L151 HydrophobicContact CG1-CD1 3.99Å; I105-L151 HydrophobicContact CG1-CD2 4.36Å; A147-L151 WeakPolarHBondContact O-CG 3.36Å; A147-L151 PolarHBondContact O-N 2.92Å; I148-L151 WeakPolarHBondContact O-CB 3.42Å; I148-L151 PolarHBondContact O-N 3.27Å; I148-L151 VanDerWaalsContact O-N 3.1Å; L151-V153 PolarHBondContact O-N 2.8Å; L151-V153 VanDerWaalsContact O-N 3.11Å; L151-M154 HydrophobicContact CD2-SD 4.07Å; L151-M154 WeakPolarHBondContact O-CB 3.36Å; L151-M154 PolarHBondContact O-N 3.43Å; L151-F158 HydrophobicContact CB-CB 4.06Å; L151-F158 HydrophobicContact CB-CD2 4.21Å; L151-F158 HydrophobicContact CB-CG 4.06Å; L151-F158 HydrophobicContact CD1-CD1 4.01Å; L151-F158 HydrophobicContact CD1-CD2 4.27Å; L151-F158 HydrophobicContact CD1-CE1 4.06Å; L151-F158 HydrophobicContact CD1-CE2 4.34Å; L151-F158 HydrophobicContact CD1-CG 4.11Å; L151-F158 HydrophobicContact CD1-CZ 4.24Å
152K83.3Confident86.5Confident137 Ų13752.8 Ų52.860%0.59628%0.283SS*.G310 helixtrans-57.8-24.4176.2-165.8173.3-178.3176.80113.9I148 K149 K150 M154 G155I148-K152 PolarHBondContact O-N 3.42Å; I148-K152 VanDerWaalsContact O-N 3.1Å; K149-K152 WeakPolarHBondContact O-CB 3.41Å; K150-K152 PolarHBondContact O-N 3.43Å; K152-M154 PolarHBondContact O-N 2.82Å; K152-G155 PolarHBondContact O-N 3.17Å
153V78Confident86.2Confident124 Ų12450.5 Ų50.575%0.75227%0.271SS*.G310 helixtrans-69.3-17.9176.2-50.30000112.8K150 L151 G155K150-V153 WeakPolarHBondContact O-CG2 3.26Å; K150-V153 PolarHBondContact O-N 3.29Å; K150-V153 VanDerWaalsContact O-N 3.13Å; L151-V153 PolarHBondContact O-N 2.8Å; L151-V153 VanDerWaalsContact O-N 3.11Å; V153-G155 PolarHBondContact O-N 3.34Å
154M74.5Confident85.6Confident152 Ų15253.5 Ų53.575%0.74930%0.302SS*.G310 helixtrans-80.1-6.1177.7-59-17966.400112.9L151 K152L151-M154 HydrophobicContact CD2-SD 4.07Å; L151-M154 WeakPolarHBondContact O-CB 3.36Å; L151-M154 PolarHBondContact O-N 3.43Å; K152-M154 PolarHBondContact O-N 2.82Å
155G75.5Confident85Confident32 Ų3257.5 Ų57.533%0.3334%0.343SS..  trans129.1-167.4178.100000113K152 V153 G157K152-G155 PolarHBondContact O-N 3.17Å; V153-G155 PolarHBondContact O-N 3.34Å; G155-G157 PolarHBondContact O-N 3.04Å
156N71.1Confident84.7Confident147 Ų14758 Ų5879%0.78635%0.347SS*.THydrogen-bonded Turntrans-79.424.6-173.5-65.4-17.4000114.4
157G79.4Confident84.8Confident22 Ų2260.6 Ų60.623%0.22736%0.358CS..THydrogen-bonded Turntrans-84.9-33.3-177.500000114G155 S171 V172G155-G157 PolarHBondContact O-N 3.04Å; G157-S171 CarbonylContact O-C 3.55Å; G157-S171 VanDerWaalsContact O-CA 3.22Å; G157-S171 WeakPolarHBondContact O-CA 3.29Å; G157-V172 PolarHBondContact O-N 2.77Å
158F89.8Confident84.8Confident30 Ų3060.6 Ų60.613%0.13236%0.357CS..  trans-115.6129.6-176.8-80.6-94.5000112.5I104 I105 C108 I148 L151 V169 Q170I104-F158 HydrophobicContact CG2-CE1 3.9Å; I105-F158 HydrophobicContact CB-CZ 4.37Å; I105-F158 HydrophobicContact CG1-CE2 3.82Å; I105-F158 HydrophobicContact CG1-CZ 3.68Å; C108-F158 HydrophobicContact CB-CE1 4.38Å; C108-F158 HydrophobicContact CB-CZ 4.37Å; I148-F158 HydrophobicContact CG2-CB 4.46Å; L151-F158 HydrophobicContact CB-CB 4.06Å; L151-F158 HydrophobicContact CB-CD2 4.21Å; L151-F158 HydrophobicContact CB-CG 4.06Å; L151-F158 HydrophobicContact CD1-CD1 4.01Å; L151-F158 HydrophobicContact CD1-CD2 4.27Å; L151-F158 HydrophobicContact CD1-CE1 4.06Å; L151-F158 HydrophobicContact CD1-CE2 4.34Å; L151-F158 HydrophobicContact CD1-CG 4.11Å; L151-F158 HydrophobicContact CD1-CZ 4.24Å; F158-V169 HydrophobicContact CD1-CG1 4.36Å; F158-Q170 CarbonylContact C-O 3.53Å; F158-Q170 VanDerWaalsContact CA-O 3.24Å; F158-Q170 WeakPolarHBondContact CA-O 3.47Å
159G89.4Confident84.9Confident14 Ų1460.4 Ų60.414%0.14436%0.356CS..EExtended strand (participates in β ladder)trans-140.7160-179.400000111.8V169 Q170G159-V169 WeakPolarHBondContact O-CA 3.28Å; G159-Q170 PolarHBondContact N-O 2.92Å; G159-Q170 PolarHBondContact O-N 3.48Å
160M91.1Very high85.1Confident55 Ų5555.8 Ų55.827%0.27134%0.336SS..EExtended strand (participates in β ladder)trans-122.3128.1169.2-59.5-171.2-31.700108.5V145 I148 Y167 L168V145-M160 HydrophobicContact CB-SD 4.29Å; V145-M160 HydrophobicContact CG1-CE 3.92Å; V145-M160 HydrophobicContact CG1-SD 3.89Å; V145-M160 HydrophobicContact CG2-SD 4.16Å; I148-M160 HydrophobicContact CB-SD 4.45Å; I148-M160 HydrophobicContact CG2-CG 3.71Å; I148-M160 HydrophobicContact CG2-SD 4.23Å; M160-Y167 HydrophobicContact CB-CD1 4.31Å; M160-Y167 HydrophobicContact CE-CD1 4.35Å; M160-Y167 HydrophobicContact CE-CE1 4.39Å; M160-L168 CarbonylContact C-O 3.41Å; M160-L168 WeakPolarHBondContact CA-O 3.3Å
161I90.6Very high85.4Confident12 Ų1254.1 Ų54.16%0.06233%0.332CS..EExtended strand (participates in β ladder)trans-112.1118-179.9-55.4173.4000107L118 V163 Y167 L168 Q170 L176 T181 L184L118-I161 HydrophobicContact CD2-CD1 3.99Å; I161-V163 HydrophobicContact CG2-CG1 4.41Å; I161-V163 PolarHBondContact O-N 3.05Å; I161-Y167 WeakPolarHBondContact O-CA 3.15Å; I161-L168 HydrophobicContact CB-CB 4.24Å; I161-L168 PolarHBondContact N-O 3.44Å; I161-L168 PolarHBondContact O-N 3.06Å; I161-Q170 HydrophobicContact CD1-CB 4.41Å; I161-L176 HydrophobicContact CD1-CD1 3.56Å; I161-T181 HydrophobicContact CG2-CG2 3.75Å; I161-L184 HydrophobicContact CD1-CD1 4.09Å; I161-L184 HydrophobicContact CG2-CD1 4.32Å
162P89.7Confident85.3Confident68 Ų6854.9 Ų54.944%0.44234%0.337SS..EExtended strand (participates in β ladder)trans-68.7123.417727.9-32.3000109.8Y167 Q185P162-Y167 HydrophobicContact CB-CD1 4.32Å; P162-Y167 HydrophobicContact CB-CE1 4.11Å; P162-Q185 PolarHBondContact O-NE2 3.42Å
163V86.1Confident85.2Confident3 Ų352.5 Ų52.52%0.01834%0.336CS..EExtended strand (participates in β ladder)trans-127.8115.8172.8-67.60000109.5I161 G165 S166 L168 L184 Q185 E188I161-V163 HydrophobicContact CG2-CG1 4.41Å; I161-V163 PolarHBondContact O-N 3.05Å; V163-G165 PolarHBondContact O-N 3.29Å; V163-S166 PolarHBondContact N-O 3.43Å; V163-S166 VanDerWaalsContact N-O 3.11Å; V163-S166 CarbonylContact O-C 3.55Å; V163-S166 PolarHBondContact O-N 3.16Å; V163-L168 HydrophobicContact CG1-CD1 3.68Å; V163-L168 HydrophobicContact CG1-CG 4.16Å; V163-L168 HydrophobicContact CG2-CB 4.42Å; V163-L168 HydrophobicContact CG2-CD1 4.12Å; V163-L168 HydrophobicContact CG2-CG 3.74Å; V163-L184 HydrophobicContact CG1-CB 4.17Å; V163-Q185 HydrophobicContact CB-CG 4.32Å; V163-Q185 HydrophobicContact CG1-CG 4.06Å; V163-E188 HydrophobicContact CB-CG 4.49Å; V163-E188 VanDerWaalsContact O-OE1 3.14Å
164G78.8Confident85.3Confident63 Ų6347.7 Ų47.765%0.64931%0.309SS*.THydrogen-bonded Turntrans48-111.8-176.800000114.2E188G164-E188 WeakPolarHBondContact CA-OE2 3.33Å; G164-E188 PolarHBondContact N-OE2 2.64Å
165G80.6Confident85.6Confident84 Ų8448.9 Ų48.987%0.86631%0.312SS*.THydrogen-bonded Turntrans-95.8-0.9-178.200000115.1V163V163-G165 PolarHBondContact O-N 3.29Å
166S85.8Confident86Confident26 Ų2648.8 Ų48.818%0.18230%0.304CS..EExtended strand (participates in β ladder)trans-135.9-165.6-175.4-166.20000111.2D122 V163D122-S166 PolarHBondContact OD2-OG 3.03Å; V163-S166 PolarHBondContact N-O 3.43Å; V163-S166 VanDerWaalsContact N-O 3.11Å; V163-S166 CarbonylContact O-C 3.55Å; V163-S166 PolarHBondContact O-N 3.16Å
167Y91.4Very high86.9Confident100 Ų10045.8 Ų45.839%0.39229%0.288SS..EExtended strand (participates in β ladder)trans-128.9140.7179.5-66.3-86.2000111.2L121 M160 I161 P162L121-Y167 WeakPolarHBondContact CB-O 3.42Å; L121-Y167 HydrophobicContact CD2-CD2 4.32Å; L121-Y167 PolarHBondContact N-O 3.39Å; M160-Y167 HydrophobicContact CB-CD1 4.31Å; M160-Y167 HydrophobicContact CE-CD1 4.35Å; M160-Y167 HydrophobicContact CE-CE1 4.39Å; I161-Y167 WeakPolarHBondContact O-CA 3.15Å; P162-Y167 HydrophobicContact CB-CD1 4.32Å; P162-Y167 HydrophobicContact CB-CE1 4.11Å
168L92.8Very high87.4Confident1 Ų151.4 Ų51.41%0.00531%0.31CS..EExtended strand (participates in β ladder)trans-91.7134.7160.1-78.7169.9000109.2I119 T120 M160 I161 V163 L184 A238 L239I119-L168 CarbonylContact O-C 3.56Å; I119-L168 WeakPolarHBondContact O-CA 3.11Å; T120-L168 HydrophobicContact CG2-CD2 3.88Å; M160-L168 CarbonylContact C-O 3.41Å; M160-L168 WeakPolarHBondContact CA-O 3.3Å; I161-L168 HydrophobicContact CB-CB 4.24Å; I161-L168 PolarHBondContact N-O 3.44Å; I161-L168 PolarHBondContact O-N 3.06Å; V163-L168 HydrophobicContact CG1-CD1 3.68Å; V163-L168 HydrophobicContact CG1-CG 4.16Å; V163-L168 HydrophobicContact CG2-CB 4.42Å; V163-L168 HydrophobicContact CG2-CD1 4.12Å; V163-L168 HydrophobicContact CG2-CG 3.74Å; L168-L184 HydrophobicContact CD1-CB 4.39Å; L168-L184 HydrophobicContact CD1-CD1 4.25Å; L168-A238 HydrophobicContact CD2-CB 4.3Å; L168-L239 HydrophobicContact CD1-CD2 4.29Å; L168-L239 HydrophobicContact CD2-CD2 4.02Å; L168-L239 HydrophobicContact CG-CD2 4.45Å
169V93.9Very high87.6Confident0 Ų051.6 Ų51.60%031%0.313CS..EExtended strand (participates in β ladder)trans-96.4121.5173.1-175.70000108.1L118 I119 L121 L124 I148 F158 G159L118-V169 WeakPolarHBondContact CA-O 3.44Å; I119-V169 HydrophobicContact CG2-CB 3.89Å; I119-V169 PolarHBondContact N-O 3.19Å; I119-V169 VanDerWaalsContact N-O 3.07Å; I119-V169 PolarHBondContact O-N 3.41Å; L121-V169 HydrophobicContact CD1-CG2 4.28Å; L124-V169 HydrophobicContact CD2-CB 4.31Å; L124-V169 HydrophobicContact CD2-CG1 4.31Å; L124-V169 HydrophobicContact CD2-CG2 3.86Å; I148-V169 HydrophobicContact CD1-CB 4.32Å; I148-V169 HydrophobicContact CD1-CG1 3.76Å; I148-V169 HydrophobicContact CD1-CG2 3.55Å; I148-V169 HydrophobicContact CG1-CG1 4.27Å; I148-V169 HydrophobicContact CG2-CG1 4.46Å; F158-V169 HydrophobicContact CD1-CG1 4.36Å; G159-V169 WeakPolarHBondContact O-CA 3.28Å
170Q92.9Very high87.8Confident30 Ų3051.3 Ų51.314%0.1431%0.307CS..EExtended strand (participates in β ladder)trans-93.3128.7171.7-178179.617.800108.5G117 L118 F158 G159 I161 V172 A174G117-Q170 WeakPolarHBondContact O-CA 3.47Å; L118-Q170 HydrophobicContact CD2-CB 3.88Å; L118-Q170 HydrophobicContact CD2-CG 4.24Å; F158-Q170 CarbonylContact C-O 3.53Å; F158-Q170 VanDerWaalsContact CA-O 3.24Å; F158-Q170 WeakPolarHBondContact CA-O 3.47Å; G159-Q170 PolarHBondContact N-O 2.92Å; G159-Q170 PolarHBondContact O-N 3.48Å; I161-Q170 HydrophobicContact CD1-CB 4.41Å; Q170-V172 VanDerWaalsContact CG-O 3.25Å; Q170-V172 WeakPolarHBondContact CG-O 3.24Å; Q170-V172 PolarHBondContact NE2-O 2.57Å; Q170-A174 VanDerWaalsContact NE2-N 3.17Å; Q170-A174 PolarHBondContact NE2-O 3.37Å
171S91.4Very high87.8Confident20 Ų2049.7 Ų49.714%0.1430%0.301CS..  trans-119.6-1.3-179.462.20000114.2C108 G117 G157C108-S171 VanDerWaalsContact CB-CB 3.47Å; G117-S171 PolarHBondContact O-N 3.28Å; G117-S171 PolarHBondContact O-OG 3.26Å; G157-S171 CarbonylContact O-C 3.55Å; G157-S171 VanDerWaalsContact O-CA 3.22Å; G157-S171 WeakPolarHBondContact O-CA 3.29Å
172V86Confident88Confident32 Ų3250.9 Ų50.919%0.19431%0.309CS..SBendtrans-125.6135.7178.2-169.10000108K112 G157 Q170 A174K112-V172 HydrophobicContact CD-CG2 3.91Å; K112-V172 HydrophobicContact CG-CG2 4.08Å; G157-V172 PolarHBondContact O-N 2.77Å; Q170-V172 VanDerWaalsContact CG-O 3.25Å; Q170-V172 WeakPolarHBondContact CG-O 3.24Å; Q170-V172 PolarHBondContact NE2-O 2.57Å; V172-A174 PolarHBondContact O-N 3.07Å
173P80.9Confident88.2Confident88 Ų8847.7 Ų47.757%0.57129%0.288SS*.  trans-58.3115173.2-20.531000109.8
174A79.6Confident88.5Confident22 Ų2247.6 Ų47.618%0.18229%0.287CS..  trans-141.6136.6169.700000108.1Q170 V172 L176Q170-A174 VanDerWaalsContact NE2-N 3.17Å; Q170-A174 PolarHBondContact NE2-O 3.37Å; V172-A174 PolarHBondContact O-N 3.07Å; A174-L176 HydrophobicContact CB-CG 4.3Å; A174-L176 PolarHBondContact O-N 2.95Å
175E80.2Confident89.1Confident177 Ų17748.1 Ų48.183%0.82727%0.273SS*.  trans-79.275.5180-66.9-170.6175.200110.3N177E175-N177 PolarHBondContact O-N 3.37Å
176L85.6Confident89.7Confident31 Ų3145.9 Ų45.916%0.16224%0.241CC..  trans-84.7104.3174.7-60.2177.7000109.4I161 A174 H180 L184 L216 L221I161-L176 HydrophobicContact CD1-CD1 3.56Å; A174-L176 HydrophobicContact CB-CG 4.3Å; A174-L176 PolarHBondContact O-N 2.95Å; L176-H180 HydrophobicContact CB-CB 4.12Å; L176-H180 HydrophobicContact CD2-CB 3.81Å; L176-L184 HydrophobicContact CD1-CD1 4.39Å; L176-L216 HydrophobicContact CD2-CD2 4.26Å; L176-L221 HydrophobicContact CD1-CD1 4.25Å; L176-L221 HydrophobicContact CD2-CD1 3.86Å
177N89.1Confident90Very high84 Ų8444.6 Ų44.645%0.44923%0.232SC..  trans-76178.5170.173.617.9000111.8E175 D179 H180 T181E175-N177 PolarHBondContact O-N 3.37Å; N177-D179 PolarHBondContact O-N 3.02Å; N177-D179 WeakPolarHBondContact OD1-CA 3.26Å; N177-D179 VanDerWaalsContact OD1-CB 3.3Å; N177-D179 WeakPolarHBondContact OD1-CB 3.37Å; N177-D179 PolarHBondContact OD1-N 3.06Å; N177-H180 VanDerWaalsContact CG-ND1 3.29Å; N177-H180 PolarHBondContact N-ND1 3.21Å; N177-H180 PolarHBondContact O-N 3.23Å; N177-H180 PolarHBondContact OD1-CE1 3.04Å; N177-H180 PolarHBondContact OD1-N 3.33Å; N177-H180 PolarHBondContact OD1-ND1 3.02Å; N177-T181 PolarHBondContact O-N 3.46Å; N177-T181 PolarHBondContact O-OG1 2.91Å
178M90.4Very high89.9Confident140 Ų14042.9 Ų42.969%0.6923%0.227SC*.Hα-helixtrans-56-34.6179.5-171.565.274.100113.1H180 T181 V182M178-H180 PolarHBondContact O-N 3.4Å; M178-T181 WeakPolarHBondContact O-CB 3.48Å; M178-T181 PolarHBondContact O-N 3.19Å; M178-V182 HydrophobicContact CG-CG2 4.42Å; M178-V182 WeakPolarHBondContact O-CG2 3.43Å; M178-V182 PolarHBondContact O-N 3.34Å
179D93.9Very high89.4Confident33 Ų3352 Ų5218%0.17627%0.267CS..Hα-helixtrans-65.6-42.4-178.6-71.94.6000111.4N177 T181 V182 V183 W204 R208 V212N177-D179 PolarHBondContact O-N 3.02Å; N177-D179 WeakPolarHBondContact OD1-CA 3.26Å; N177-D179 VanDerWaalsContact OD1-CB 3.3Å; N177-D179 WeakPolarHBondContact OD1-CB 3.37Å; N177-D179 PolarHBondContact OD1-N 3.06Å; D179-T181 VanDerWaalsContact C-N 3.35Å; D179-V182 PolarHBondContact O-N 3.32Å; D179-V183 WeakPolarHBondContact O-CG2 3.22Å; D179-V183 PolarHBondContact O-N 2.9Å; D179-W204 HydrophobicContact CB-CH2 3.4Å; D179-W204 HydrophobicContact CB-CZ2 4.16Å; D179-W204 HydrophobicContact CB-CZ3 4Å; D179-W204 VanDerWaalsContact CG-CH2 3.5Å; D179-R208 IonicContact OD1-CZ 2.67Å; D179-R208 IonicContact OD1-NE 3.45Å; D179-R208 IonicContact OD1-NH2 3.33Å; D179-R208 PolarHBondContact OD1-NH2 3.06Å; D179-R208 IonicContact OD2-CZ 3.74Å; D179-R208 VanDerWaalsContact OD2-CZ 3.27Å; D179-R208 IonicContact OD2-NE 2.59Å; D179-R208 PolarHBondContact OD2-NE 3.41Å; D179-R208 IonicContact OD2-NH2 3.39Å; D179-R208 PolarHBondContact OD2-NH2 3.33Å; D179-V212 HydrophobicContact CB-CG2 3.75Å
180H93.1Very high89.1Confident8 Ų856.7 Ų56.74%0.03729%0.287CS..Hα-helixtrans-60.7-46.2173.3-5793.1000110.7L176 N177 M178 V182 V183 L184 H215L176-H180 HydrophobicContact CB-CB 4.12Å; L176-H180 HydrophobicContact CD2-CB 3.81Å; N177-H180 VanDerWaalsContact CG-ND1 3.29Å; N177-H180 PolarHBondContact N-ND1 3.21Å; N177-H180 PolarHBondContact O-N 3.23Å; N177-H180 PolarHBondContact OD1-CE1 3.04Å; N177-H180 PolarHBondContact OD1-N 3.33Å; N177-H180 PolarHBondContact OD1-ND1 3.02Å; M178-H180 PolarHBondContact O-N 3.4Å; H180-V182 VanDerWaalsContact C-N 3.31Å; H180-V182 PolarHBondContact O-N 3.37Å; H180-V183 PolarHBondContact O-N 3.27Å; H180-V183 VanDerWaalsContact O-N 3.15Å; H180-L184 VanDerWaalsContact O-CG 3.28Å; H180-L184 WeakPolarHBondContact O-CG 3.24Å; H180-L184 PolarHBondContact O-N 3.47Å; H180-H215 AromaticContact CD2-ND1 3.67Å; H180-H215 AromaticContact CE1-ND1 3.71Å; H180-H215 WeakPolarHBondContact NE2-CB 3.25Å; H180-H215 AromaticContact NE2-CE1 3.86Å; H180-H215 AromaticContact NE2-CG 3.32Å; H180-H215 VanDerWaalsContact NE2-CG 3.32Å; H180-H215 AromaticContact NE2-ND1 3.05Å; H180-H215 PolarHBondContact NE2-ND1 2.8Å
181T91.6Very high89Confident22 Ų2255.4 Ų55.414%0.13528%0.282CS..Hα-helixtrans-57.2-43.2178.8-56.40000112.2I161 N177 M178 D179 L184 Q185I161-T181 HydrophobicContact CG2-CG2 3.75Å; N177-T181 PolarHBondContact O-N 3.46Å; N177-T181 PolarHBondContact O-OG1 2.91Å; M178-T181 WeakPolarHBondContact O-CB 3.48Å; M178-T181 PolarHBondContact O-N 3.19Å; D179-T181 VanDerWaalsContact C-N 3.35Å; T181-L184 PolarHBondContact O-N 3.35Å; T181-Q185 VanDerWaalsContact O-CG 3.32Å; T181-Q185 WeakPolarHBondContact O-CG 3.45Å; T181-Q185 PolarHBondContact O-N 2.88Å
182V93.6Very high89.1Confident37 Ų3756.8 Ų56.822%0.22429%0.285CS..Hα-helixtrans-68.4-36.8179178.80000111.4M178 D179 H180 Q185 L186 L202M178-V182 HydrophobicContact CG-CG2 4.42Å; M178-V182 WeakPolarHBondContact O-CG2 3.43Å; M178-V182 PolarHBondContact O-N 3.34Å; D179-V182 PolarHBondContact O-N 3.32Å; H180-V182 VanDerWaalsContact C-N 3.31Å; H180-V182 PolarHBondContact O-N 3.37Å; V182-Q185 WeakPolarHBondContact O-CB 3.47Å; V182-Q185 PolarHBondContact O-N 3.35Å; V182-L186 PolarHBondContact O-N 3.05Å; V182-L202 HydrophobicContact CB-CD1 4.42Å; V182-L202 HydrophobicContact CG1-CD1 3.52Å; V182-L202 HydrophobicContact CG1-CD2 3.45Å; V182-L202 VanDerWaalsContact CG1-CD2 3.45Å; V182-L202 HydrophobicContact CG1-CG 4.14Å
183V94.4Very high89.6Confident0 Ų055.3 Ų55.30%028%0.276CS..Hα-helixtrans-67.9-39.9174.4172.40000111.7D179 H180 Q185 L186 A187 V193 I198 L202 W204 V212 L213 L216D179-V183 WeakPolarHBondContact O-CG2 3.22Å; D179-V183 PolarHBondContact O-N 2.9Å; H180-V183 PolarHBondContact O-N 3.27Å; H180-V183 VanDerWaalsContact O-N 3.15Å; V183-Q185 VanDerWaalsContact C-N 3.31Å; V183-Q185 PolarHBondContact O-N 3.22Å; V183-L186 WeakPolarHBondContact O-CB 3.42Å; V183-L186 PolarHBondContact O-N 2.95Å; V183-A187 PolarHBondContact O-N 3.26Å; V183-V193 HydrophobicContact CG1-CG1 3.93Å; V183-V193 HydrophobicContact CG1-CG2 4.4Å; V183-I198 HydrophobicContact CG1-CD1 4.11Å; V183-I198 HydrophobicContact CG2-CD1 3.99Å; V183-I198 HydrophobicContact CG2-CG1 4.35Å; V183-L202 HydrophobicContact CG2-CD1 4.43Å; V183-W204 HydrophobicContact CG2-CH2 4.24Å; V183-W204 HydrophobicContact CG2-CZ3 3.95Å; V183-V212 HydrophobicContact CB-CG1 4.09Å; V183-V212 HydrophobicContact CG1-CG1 4.42Å; V183-V212 HydrophobicContact CG2-CG1 3.78Å; V183-L213 HydrophobicContact CG1-CD2 4.43Å; V183-L216 HydrophobicContact CG1-CD1 4.07Å
184L92.9Very high90.3Very high1 Ų151.6 Ų51.61%0.00525%0.252CS..Hα-helixtrans-59.8-42173-67.8177.5000111.5L118 I161 V163 L168 L176 H180 T181 A187 E188 L236L118-L184 HydrophobicContact CD1-CD1 4.21Å; L118-L184 HydrophobicContact CD1-CD2 4.17Å; I161-L184 HydrophobicContact CD1-CD1 4.09Å; I161-L184 HydrophobicContact CG2-CD1 4.32Å; V163-L184 HydrophobicContact CG1-CB 4.17Å; L168-L184 HydrophobicContact CD1-CB 4.39Å; L168-L184 HydrophobicContact CD1-CD1 4.25Å; L176-L184 HydrophobicContact CD1-CD1 4.39Å; H180-L184 VanDerWaalsContact O-CG 3.28Å; H180-L184 WeakPolarHBondContact O-CG 3.24Å; H180-L184 PolarHBondContact O-N 3.47Å; T181-L184 PolarHBondContact O-N 3.35Å; L184-A187 PolarHBondContact O-N 2.92Å; L184-E188 PolarHBondContact O-N 3.05Å; L184-L236 HydrophobicContact CD2-CD2 3.13Å
185Q91.9Very high91.1Very high74 Ų7451.5 Ų51.535%0.34625%0.249SC..Hα-helixtrans-63-40.1174.7-76.3172-2.800112.4P162 V163 T181 V182 V183 A187 E188P162-Q185 PolarHBondContact O-NE2 3.42Å; V163-Q185 HydrophobicContact CB-CG 4.32Å; V163-Q185 HydrophobicContact CG1-CG 4.06Å; T181-Q185 VanDerWaalsContact O-CG 3.32Å; T181-Q185 WeakPolarHBondContact O-CG 3.45Å; T181-Q185 PolarHBondContact O-N 2.88Å; V182-Q185 WeakPolarHBondContact O-CB 3.47Å; V182-Q185 PolarHBondContact O-N 3.35Å; V183-Q185 VanDerWaalsContact C-N 3.31Å; V183-Q185 PolarHBondContact O-N 3.22Å; Q185-A187 VanDerWaalsContact C-N 3.3Å; Q185-A187 PolarHBondContact O-N 3.36Å; Q185-E188 WeakPolarHBondContact O-CB 3.45Å; Q185-E188 PolarHBondContact O-N 3.04Å
186L92.7Very high91.8Very high37 Ų3746.4 Ų46.419%0.19423%0.232CC..Hα-helixtrans-64.8-38.3177.9-171.161.5000111.5V182 V183 V193 E197 I198V182-L186 PolarHBondContact O-N 3.05Å; V183-L186 WeakPolarHBondContact O-CB 3.42Å; V183-L186 PolarHBondContact O-N 2.95Å; L186-V193 HydrophobicContact CD2-CG2 3.99Å; L186-V193 HydrophobicContact CG-CG2 4.46Å; L186-E197 HydrophobicContact CD1-CG 4.42Å; L186-E197 HydrophobicContact CD2-CG 4.02Å; L186-E197 HydrophobicContact CG-CG 4.27Å; L186-I198 HydrophobicContact CD2-CG1 3.96Å
187A92.1Very high92.2Very high0 Ų046.7 Ų46.70%023%0.233CC..Hα-helixtrans-76.8-17.3-179.800000114.3V183 L184 Q185 K189 K190 G191 V193 L236 L239V183-A187 PolarHBondContact O-N 3.26Å; L184-A187 PolarHBondContact O-N 2.92Å; Q185-A187 VanDerWaalsContact C-N 3.3Å; Q185-A187 PolarHBondContact O-N 3.36Å; A187-K189 PolarHBondContact O-N 3.05Å; A187-K190 PolarHBondContact O-N 3.05Å; A187-K190 VanDerWaalsContact O-N 3.09Å; A187-G191 WeakPolarHBondContact O-CA 3.48Å; A187-G191 PolarHBondContact O-N 3.32Å; A187-V193 HydrophobicContact CB-CB 4.28Å; A187-L236 HydrophobicContact CB-CD1 3.52Å; A187-L239 HydrophobicContact CB-CD1 3.78Å
188E88.4Confident92.5Very high64 Ų6442.7 Ų42.730%0.29921%0.212SC..THydrogen-bonded Turntrans-47.6-40.2-174.8-172.6-165.6-175.700113.2V163 G164 L184 Q185V163-E188 HydrophobicContact CB-CG 4.49Å; V163-E188 VanDerWaalsContact O-OE1 3.14Å; G164-E188 WeakPolarHBondContact CA-OE2 3.33Å; G164-E188 PolarHBondContact N-OE2 2.64Å; L184-E188 PolarHBondContact O-N 3.05Å; Q185-E188 WeakPolarHBondContact O-CB 3.45Å; Q185-E188 PolarHBondContact O-N 3.04Å
189K82.9Confident92.8Very high193 Ų19340.2 Ų40.284%0.83920%0.197SC*.THydrogen-bonded Turntrans-80.3-30.6-175.4-66.4-175.7179.5178.90114.6A187A187-K189 PolarHBondContact O-N 3.05Å
190K88.6Confident92.9Very high97 Ų9741.5 Ų41.542%0.42222%0.218SC..THydrogen-bonded Turntrans-108.1-20.4-172.5-69178.1-178.8166.80113.1A187 Y192 E197A187-K190 PolarHBondContact O-N 3.05Å; A187-K190 VanDerWaalsContact O-N 3.09Å; K190-Y192 HydrophobicContact CB-CD1 4.01Å; K190-Y192 HydrophobicContact CB-CE1 3.97Å; K190-Y192 HydrophobicContact CD-CE1 4.49Å; K190-Y192 HydrophobicContact CD-CE2 4.41Å; K190-Y192 WeakPolarHBondContact O-CD1 3.29Å; K190-Y192 PolarHBondContact O-N 3.26Å; K190-E197 IonicContact NZ-OE1 2.83Å; K190-E197 PolarHBondContact NZ-OE1 2.96Å; K190-E197 IonicContact NZ-OE2 3.17Å; K190-E197 PolarHBondContact NZ-OE2 3.36Å
191G90.6Very high92.9Very high3 Ų344.4 Ų44.43%0.03124%0.239CC..SBendtrans78.1-7.9-169.400000114.2A187 L236A187-G191 WeakPolarHBondContact O-CA 3.48Å; A187-G191 PolarHBondContact O-N 3.32Å; G191-L236 PolarHBondContact O-N 3.49Å
192Y93.6Very high93.1Very high50 Ų5045.5 Ų45.520%0.19624%0.244CC..EExtended strand (participates in β ladder)trans-140168.5175.969.7-90.3000111.3K190 T194 Q233 Y234 W235K190-Y192 HydrophobicContact CB-CD1 4.01Å; K190-Y192 HydrophobicContact CB-CE1 3.97Å; K190-Y192 HydrophobicContact CD-CE1 4.49Å; K190-Y192 HydrophobicContact CD-CE2 4.41Å; K190-Y192 WeakPolarHBondContact O-CD1 3.29Å; K190-Y192 PolarHBondContact O-N 3.26Å; Y192-T194 HydrophobicContact CD2-CG2 4.29Å; Y192-T194 HydrophobicContact CE2-CG2 4.19Å; Y192-Q233 HydrophobicContact CD2-CB 3.91Å; Y192-Q233 HydrophobicContact CD2-CG 3.76Å; Y192-Q233 HydrophobicContact CE2-CB 4.47Å; Y192-Q233 VanDerWaalsContact CE2-CD 3.5Å; Y192-Q233 HydrophobicContact CE2-CG 3.81Å; Y192-Q233 HydrophobicContact CG-CB 4.38Å; Y192-Y234 CarbonylContact C-O 3.53Å; Y192-Y234 WeakPolarHBondContact CA-O 3.26Å; Y192-Y234 WeakPolarHBondContact CB-O 3.44Å; Y192-W235 HydrophobicContact CD1-CD2 4.11Å; Y192-W235 AromaticContact CD1-CE2 3.89Å; Y192-W235 AromaticContact CD1-CE3 3.94Å; Y192-W235 HydrophobicContact CD1-CE3 3.94Å; Y192-W235 AromaticContact CD1-CH2 3.36Å; Y192-W235 HydrophobicContact CD1-CH2 3.36Å; Y192-W235 AromaticContact CD1-CZ2 3.53Å; Y192-W235 HydrophobicContact CD1-CZ2 3.53Å; Y192-W235 AromaticContact CD1-CZ3 3.58Å; Y192-W235 HydrophobicContact CD1-CZ3 3.58Å; Y192-W235 AromaticContact CE1-CH2 3.77Å; Y192-W235 HydrophobicContact CE1-CH2 3.77Å; Y192-W235 AromaticContact CE1-CZ2 3.94Å; Y192-W235 HydrophobicContact CE1-CZ2 3.94Å; Y192-W235 HydrophobicContact CE1-CZ3 4.36Å; Y192-W235 HydrophobicContact CG-CD2 4.15Å; Y192-W235 HydrophobicContact CG-CE3 4.32Å; Y192-W235 HydrophobicContact CG-CH2 4.29Å; Y192-W235 HydrophobicContact CG-CZ2 4.1Å; Y192-W235 HydrophobicContact CG-CZ3 4.39Å
193V95.3Very high93.2Very high0 Ų052.8 Ų52.80%027%0.273CS..EExtended strand (participates in β ladder)trans-138.7151.7175.663.10000110.3V183 L186 A187 I198 L213 Y234 L236V183-V193 HydrophobicContact CG1-CG1 3.93Å; V183-V193 HydrophobicContact CG1-CG2 4.4Å; L186-V193 HydrophobicContact CD2-CG2 3.99Å; L186-V193 HydrophobicContact CG-CG2 4.46Å; A187-V193 HydrophobicContact CB-CB 4.28Å; V193-I198 HydrophobicContact CG1-CD1 4.46Å; V193-I198 HydrophobicContact CG2-CD1 3.64Å; V193-I198 HydrophobicContact CG2-CG1 3.38Å; V193-L213 HydrophobicContact CG1-CD2 3.62Å; V193-Y234 PolarHBondContact N-O 3.24Å; V193-Y234 PolarHBondContact O-N 2.92Å; V193-L236 HydrophobicContact CG1-CD1 4.35Å
194T95.9Very high93.3Very high11 Ų1154.2 Ų54.27%0.06728%0.278CS..EExtended strand (participates in β ladder)trans-119.8161172.372.50000112.3Y192 S196 E197 I198 E231 Q233Y192-T194 HydrophobicContact CD2-CG2 4.29Å; Y192-T194 HydrophobicContact CE2-CG2 4.19Å; T194-S196 VanDerWaalsContact C-N 3.32Å; T194-S196 PolarHBondContact O-N 3.28Å; T194-E197 PolarHBondContact O-N 2.97Å; T194-E197 WeakPolarHBondContact OG1-CB 3.39Å; T194-E197 PolarHBondContact OG1-N 3.38Å; T194-I198 WeakPolarHBondContact O-CG1 3.17Å; T194-I198 PolarHBondContact O-N 3.49Å; T194-E231 WeakPolarHBondContact CB-OE1 3.45Å; T194-E231 HydrophobicContact CG2-CG 3.78Å; T194-E231 PolarHBondContact OG1-OE1 2.91Å; T194-Q233 HydrophobicContact CG2-CG 3.81Å
195V96.2Very high93.4Very high20 Ų2060.9 Ų60.912%0.12131%0.309CS..Hα-helixtrans-60.7-43.8178178.10000110.6E197 I198 K199 K206 A209 L213 Y234V195-E197 VanDerWaalsContact C-N 3.32Å; V195-E197 PolarHBondContact O-N 3.19Å; V195-I198 PolarHBondContact O-N 3.37Å; V195-K199 HydrophobicContact CG1-CD 4.18Å; V195-K199 HydrophobicContact CG1-CG 4.45Å; V195-K199 VanDerWaalsContact O-CG 3.3Å; V195-K199 WeakPolarHBondContact O-CG 3.24Å; V195-K199 PolarHBondContact O-N 2.93Å; V195-K206 HydrophobicContact CG1-CG 4.02Å; V195-A209 HydrophobicContact CG1-CB 4.4Å; V195-L213 HydrophobicContact CG2-CD1 3.68Å; V195-Y234 HydrophobicContact CG2-CE2 4.2Å
196S94.9Very high93.6Very high69 Ų6963.4 Ų63.448%0.48332%0.319SS..Hα-helixtrans-66.5-34.9-180-52.80000112.4T194 K199 G200 E231T194-S196 VanDerWaalsContact C-N 3.32Å; T194-S196 PolarHBondContact O-N 3.28Å; S196-K199 PolarHBondContact O-N 2.81Å; S196-G200 PolarHBondContact O-N 3.18Å; S196-E231 WeakPolarHBondContact CB-OE1 3.13Å; S196-E231 WeakPolarHBondContact CB-OE2 3.45Å; S196-E231 PolarHBondContact N-OE2 2.93Å; S196-E231 VanDerWaalsContact N-OE2 3.16Å; S196-E231 VanDerWaalsContact OG-CD 3.28Å; S196-E231 PolarHBondContact OG-OE1 3.5Å; S196-E231 PolarHBondContact OG-OE2 2.92Å
197E94.7Very high93.8Very high38 Ų3869 Ų6918%0.17834%0.344CS..Hα-helixtrans-66.7-42175.8179.9165.4-15300112.5L186 K190 T194 V195 G200 S201L186-E197 HydrophobicContact CD1-CG 4.42Å; L186-E197 HydrophobicContact CD2-CG 4.02Å; L186-E197 HydrophobicContact CG-CG 4.27Å; K190-E197 IonicContact NZ-OE1 2.83Å; K190-E197 PolarHBondContact NZ-OE1 2.96Å; K190-E197 IonicContact NZ-OE2 3.17Å; K190-E197 PolarHBondContact NZ-OE2 3.36Å; T194-E197 PolarHBondContact O-N 2.97Å; T194-E197 WeakPolarHBondContact OG1-CB 3.39Å; T194-E197 PolarHBondContact OG1-N 3.38Å; V195-E197 VanDerWaalsContact C-N 3.32Å; V195-E197 PolarHBondContact O-N 3.19Å; E197-G200 PolarHBondContact O-N 2.99Å; E197-S201 VanDerWaalsContact O-CB 3.24Å; E197-S201 WeakPolarHBondContact O-CB 3.48Å; E197-S201 PolarHBondContact O-N 2.82Å; E197-S201 PolarHBondContact O-OG 2.89Å
198I95.8Very high94Very high0 Ų074.1 Ų74.10%036%0.363CS..Hα-helixtrans-61.6-48174.7-67.8171000110.1V183 L186 V193 T194 V195 G200 L202 W204 A209 L213V183-I198 HydrophobicContact CG1-CD1 4.11Å; V183-I198 HydrophobicContact CG2-CD1 3.99Å; V183-I198 HydrophobicContact CG2-CG1 4.35Å; L186-I198 HydrophobicContact CD2-CG1 3.96Å; V193-I198 HydrophobicContact CG1-CD1 4.46Å; V193-I198 HydrophobicContact CG2-CD1 3.64Å; V193-I198 HydrophobicContact CG2-CG1 3.38Å; T194-I198 WeakPolarHBondContact O-CG1 3.17Å; T194-I198 PolarHBondContact O-N 3.49Å; V195-I198 PolarHBondContact O-N 3.37Å; I198-G200 PolarHBondContact O-N 3.1Å; I198-L202 HydrophobicContact CG2-CD1 4.06Å; I198-L202 WeakPolarHBondContact O-CA 3.06Å; I198-L202 VanDerWaalsContact O-CB 3.28Å; I198-L202 WeakPolarHBondContact O-CB 3.34Å; I198-L202 PolarHBondContact O-N 2.78Å; I198-W204 HydrophobicContact CG2-CB 4.4Å; I198-W204 HydrophobicContact CG2-CD2 4.3Å; I198-W204 HydrophobicContact CG2-CE3 3.7Å; I198-W204 HydrophobicContact CG2-CZ3 4.26Å; I198-A209 HydrophobicContact CB-CB 4.09Å; I198-A209 HydrophobicContact CD1-CB 4.31Å; I198-A209 HydrophobicContact CG2-CB 3.59Å; I198-L213 HydrophobicContact CD1-CD1 3.93Å; I198-L213 HydrophobicContact CD1-CD2 3.94Å; I198-L213 HydrophobicContact CD1-CG 4Å
199K96.6Very high94.3Very high87 Ų8771 Ų7138%0.37835%0.349SS..Hα-helixtrans-60.8-45.1178.3-69.9-177.668.9-171.50111.8V195 S196 K203 W204 K206V195-K199 HydrophobicContact CG1-CD 4.18Å; V195-K199 HydrophobicContact CG1-CG 4.45Å; V195-K199 VanDerWaalsContact O-CG 3.3Å; V195-K199 WeakPolarHBondContact O-CG 3.24Å; V195-K199 PolarHBondContact O-N 2.93Å; S196-K199 PolarHBondContact O-N 2.81Å; K199-K203 WeakPolarHBondContact O-CA 3.35Å; K199-K203 PolarHBondContact O-N 3.08Å; K199-W204 WeakPolarHBondContact CG-O 3.38Å; K199-K206 HydrophobicContact CD-CB 4.14Å
200G95.1Very high94.9Very high60 Ų6063.3 Ų63.362%0.61932%0.319SS*.Hα-helixtrans-67.9-45.9-178.500000112.9S196 E197 I198S196-G200 PolarHBondContact O-N 3.18Å; E197-G200 PolarHBondContact O-N 2.99Å; I198-G200 PolarHBondContact O-N 3.1Å
201S94.3Very high95.3Very high70 Ų7065.3 Ų65.349%0.4933%0.33SS..Hα-helixtrans-80.3-41.4-174.1-53.20000112.5E197E197-S201 VanDerWaalsContact O-CB 3.24Å; E197-S201 WeakPolarHBondContact O-CB 3.48Å; E197-S201 PolarHBondContact O-N 2.82Å; E197-S201 PolarHBondContact O-OG 2.89Å
202L94.3Very high95.6Very high44 Ų4465.5 Ų65.523%0.2333%0.33CS..Hα-helixtrans-99.9-7-175.3-52-175000113.6V182 V183 I198 W204V182-L202 HydrophobicContact CB-CD1 4.42Å; V182-L202 HydrophobicContact CG1-CD1 3.52Å; V182-L202 HydrophobicContact CG1-CD2 3.45Å; V182-L202 VanDerWaalsContact CG1-CD2 3.45Å; V182-L202 HydrophobicContact CG1-CG 4.14Å; V183-L202 HydrophobicContact CG2-CD1 4.43Å; I198-L202 HydrophobicContact CG2-CD1 4.06Å; I198-L202 WeakPolarHBondContact O-CA 3.06Å; I198-L202 VanDerWaalsContact O-CB 3.28Å; I198-L202 WeakPolarHBondContact O-CB 3.34Å; I198-L202 PolarHBondContact O-N 2.78Å; L202-W204 HydrophobicContact CB-CD2 4.05Å; L202-W204 HydrophobicContact CB-CG 3.89Å; L202-W204 HydrophobicContact CD1-CD2 4.05Å; L202-W204 HydrophobicContact CD1-CE3 4.19Å; L202-W204 HydrophobicContact CD1-CH2 3.83Å; L202-W204 HydrophobicContact CD1-CZ2 3.74Å; L202-W204 HydrophobicContact CD1-CZ3 4.08Å; L202-W204 PolarHBondContact O-N 3.49Å
203K95.3Very high95.7Very high190 Ų19063.1 Ų63.183%0.82632%0.32SS*.  trans55.637.2-175-56.9-178.71801790112.6K199K199-K203 WeakPolarHBondContact O-CA 3.35Å; K199-K203 PolarHBondContact O-N 3.08Å
204W96.6Very high95.7Very high30 Ų3066.1 Ų66.111%0.11434%0.337CS..  trans-88.6154.9178.9-73.57.2000112.4D179 V183 I198 K199 L202 R208 V212D179-W204 HydrophobicContact CB-CH2 3.4Å; D179-W204 HydrophobicContact CB-CZ2 4.16Å; D179-W204 HydrophobicContact CB-CZ3 4Å; D179-W204 VanDerWaalsContact CG-CH2 3.5Å; V183-W204 HydrophobicContact CG2-CH2 4.24Å; V183-W204 HydrophobicContact CG2-CZ3 3.95Å; I198-W204 HydrophobicContact CG2-CB 4.4Å; I198-W204 HydrophobicContact CG2-CD2 4.3Å; I198-W204 HydrophobicContact CG2-CE3 3.7Å; I198-W204 HydrophobicContact CG2-CZ3 4.26Å; K199-W204 WeakPolarHBondContact CG-O 3.38Å; L202-W204 HydrophobicContact CB-CD2 4.05Å; L202-W204 HydrophobicContact CB-CG 3.89Å; L202-W204 HydrophobicContact CD1-CD2 4.05Å; L202-W204 HydrophobicContact CD1-CE3 4.19Å; L202-W204 HydrophobicContact CD1-CH2 3.83Å; L202-W204 HydrophobicContact CD1-CZ2 3.74Å; L202-W204 HydrophobicContact CD1-CZ3 4.08Å; L202-W204 PolarHBondContact O-N 3.49Å; W204-R208 HydrophobicContact CD2-CG 4.18Å; W204-R208 HydrophobicContact CE3-CG 3.85Å; W204-R208 HydrophobicContact CZ3-CG 4.37Å; W204-V212 HydrophobicContact CZ3-CG2 4.05Å
205E96.6Very high95.7Very high141 Ų14168 Ų6866%0.65935%0.345SS*.  trans-68.9150.7167.1-66.5-54.6146.600111.3E207 R208 A209E205-E207 VanDerWaalsContact C-N 3.27Å; E205-E207 PolarHBondContact O-N 2.97Å; E205-R208 PolarHBondContact O-N 3.33Å; E205-A209 PolarHBondContact O-N 3.06Å; E205-A209 VanDerWaalsContact O-N 3.17Å
206K95.5Very high95.6Very high128 Ų12867.1 Ų67.156%0.55734%0.339SS*.Hα-helixtrans-56.6-43.2-177.6-175.5-177.8176.5-1760111.6V195 K199 R208 A209 C210V195-K206 HydrophobicContact CG1-CG 4.02Å; K199-K206 HydrophobicContact CD-CB 4.14Å; K206-R208 PolarHBondContact O-N 2.98Å; K206-A209 PolarHBondContact O-N 3.49Å; K206-C210 PolarHBondContact O-N 3.32Å; K206-C210 PolarHBondContact O-SG 3.03Å; K206-C210 VanDerWaalsContact O-SG 3.35Å
207E96.3Very high95.6Very high153 Ų15366.2 Ų66.272%0.71533%0.329SS*.Hα-helixtrans-62-42.7-177.9-69.5152.7-169.800112E205 C210 H211E205-E207 VanDerWaalsContact C-N 3.27Å; E205-E207 PolarHBondContact O-N 2.97Å; E207-C210 PolarHBondContact O-N 3Å; E207-H211 WeakPolarHBondContact O-CB 3.13Å; E207-H211 PolarHBondContact O-CD2 3.32Å; E207-H211 PolarHBondContact O-N 3.1Å
208R96Very high95.5Very high108 Ų10872.3 Ų72.341%0.40835%0.354SS..Hα-helixtrans-63.3-43.9176-175.2-179.7-178.8-178.70.8111.6D179 W204 E205 K206 H211 V212D179-R208 IonicContact OD1-CZ 2.67Å; D179-R208 IonicContact OD1-NE 3.45Å; D179-R208 IonicContact OD1-NH2 3.33Å; D179-R208 PolarHBondContact OD1-NH2 3.06Å; D179-R208 IonicContact OD2-CZ 3.74Å; D179-R208 VanDerWaalsContact OD2-CZ 3.27Å; D179-R208 IonicContact OD2-NE 2.59Å; D179-R208 PolarHBondContact OD2-NE 3.41Å; D179-R208 IonicContact OD2-NH2 3.39Å; D179-R208 PolarHBondContact OD2-NH2 3.33Å; W204-R208 HydrophobicContact CD2-CG 4.18Å; W204-R208 HydrophobicContact CE3-CG 3.85Å; W204-R208 HydrophobicContact CZ3-CG 4.37Å; E205-R208 PolarHBondContact O-N 3.33Å; K206-R208 PolarHBondContact O-N 2.98Å; R208-H211 PolarHBondContact O-N 3.48Å; R208-V212 WeakPolarHBondContact O-CG2 3.28Å; R208-V212 PolarHBondContact O-N 3.39Å
209A96.2Very high95.3Very high0 Ų076.1 Ų76.10%037%0.372CS..Hα-helixtrans-61.7-47.5176.100000111.4V195 I198 E205 K206 H211 V212 L213V195-A209 HydrophobicContact CG1-CB 4.4Å; I198-A209 HydrophobicContact CB-CB 4.09Å; I198-A209 HydrophobicContact CD1-CB 4.31Å; I198-A209 HydrophobicContact CG2-CB 3.59Å; E205-A209 PolarHBondContact O-N 3.06Å; E205-A209 VanDerWaalsContact O-N 3.17Å; K206-A209 PolarHBondContact O-N 3.49Å; A209-H211 PolarHBondContact O-N 2.86Å; A209-V212 PolarHBondContact O-N 3.36Å; A209-L213 VanDerWaalsContact O-CG 3.26Å; A209-L213 WeakPolarHBondContact O-CG 3.48Å; A209-L213 PolarHBondContact O-N 3.4Å
210C95.6Very high95.1Very high30 Ų3073.5 Ų73.520%0.20337%0.37CS..Hα-helixtrans-60.6-43176.9-70.20000112.1K206 E207 V212 L213 D214K206-C210 PolarHBondContact O-N 3.32Å; K206-C210 PolarHBondContact O-SG 3.03Å; K206-C210 VanDerWaalsContact O-SG 3.35Å; E207-C210 PolarHBondContact O-N 3Å; C210-V212 VanDerWaalsContact C-N 3.33Å; C210-V212 PolarHBondContact O-N 2.91Å; C210-L213 PolarHBondContact O-N 2.93Å; C210-D214 WeakPolarHBondContact O-CB 3.34Å; C210-D214 PolarHBondContact O-N 3.34Å
211H96Very high95Very high140 Ų14070.9 Ų70.965%0.64834%0.341SS*.Hα-helixtrans-57.8-43.6177.5-84-155.9000113E207 R208 A209 H215E207-H211 WeakPolarHBondContact O-CB 3.13Å; E207-H211 PolarHBondContact O-CD2 3.32Å; E207-H211 PolarHBondContact O-N 3.1Å; R208-H211 PolarHBondContact O-N 3.48Å; A209-H211 PolarHBondContact O-N 2.86Å; H211-H215 WeakPolarHBondContact O-CB 3.12Å; H211-H215 PolarHBondContact O-N 3.02Å
212V96.3Very high95Very high6 Ų667.7 Ų67.74%0.03632%0.32CS..Hα-helixtrans-66.5-44.8178.11740000110.6D179 V183 W204 R208 A209 C210 H215 L216D179-V212 HydrophobicContact CB-CG2 3.75Å; V183-V212 HydrophobicContact CB-CG1 4.09Å; V183-V212 HydrophobicContact CG1-CG1 4.42Å; V183-V212 HydrophobicContact CG2-CG1 3.78Å; W204-V212 HydrophobicContact CZ3-CG2 4.05Å; R208-V212 WeakPolarHBondContact O-CG2 3.28Å; R208-V212 PolarHBondContact O-N 3.39Å; A209-V212 PolarHBondContact O-N 3.36Å; C210-V212 VanDerWaalsContact C-N 3.33Å; C210-V212 PolarHBondContact O-N 2.91Å; V212-H215 WeakPolarHBondContact O-CB 3.44Å; V212-H215 PolarHBondContact O-N 3.08Å; V212-L216 HydrophobicContact CG1-CD1 4.42Å; V212-L216 WeakPolarHBondContact O-CG 3.39Å; V212-L216 PolarHBondContact O-N 3.2Å
213L96.3Very high95Very high0 Ų072.4 Ų72.40%034%0.335CS..Hα-helixtrans-64.7-42.7179.4-67.1171.1000112.1V183 V193 V195 I198 A209 C210 H215 L216 L217 Y234V183-L213 HydrophobicContact CG1-CD2 4.43Å; V193-L213 HydrophobicContact CG1-CD2 3.62Å; V195-L213 HydrophobicContact CG2-CD1 3.68Å; I198-L213 HydrophobicContact CD1-CD1 3.93Å; I198-L213 HydrophobicContact CD1-CD2 3.94Å; I198-L213 HydrophobicContact CD1-CG 4Å; A209-L213 VanDerWaalsContact O-CG 3.26Å; A209-L213 WeakPolarHBondContact O-CG 3.48Å; A209-L213 PolarHBondContact O-N 3.4Å; C210-L213 PolarHBondContact O-N 2.93Å; L213-H215 VanDerWaalsContact C-N 3.28Å; L213-H215 PolarHBondContact O-N 3.19Å; L213-L216 PolarHBondContact O-N 3.35Å; L213-L217 WeakPolarHBondContact O-CG 3.32Å; L213-L217 PolarHBondContact O-N 3.49Å; L213-Y234 HydrophobicContact CB-CD1 3.84Å; L213-Y234 HydrophobicContact CB-CE1 3.66Å; L213-Y234 HydrophobicContact CB-CG 4.36Å; L213-Y234 HydrophobicContact CD1-CD1 4.39Å; L213-Y234 HydrophobicContact CD1-CD2 3.81Å; L213-Y234 HydrophobicContact CD1-CE1 4.22Å; L213-Y234 HydrophobicContact CD1-CE2 3.67Å; L213-Y234 HydrophobicContact CD1-CG 4.18Å; L213-Y234 HydrophobicContact CD2-CD1 4.01Å; L213-Y234 HydrophobicContact CD2-CD2 4.13Å; L213-Y234 HydrophobicContact CD2-CG 3.75Å; L213-Y234 HydrophobicContact CG-CD1 4.3Å; L213-Y234 HydrophobicContact CG-CD2 4.43Å; L213-Y234 HydrophobicContact CG-CE1 4.37Å; L213-Y234 HydrophobicContact CG-CG 4.31Å
214D95.9Very high95Very high63 Ų6367.9 Ų67.934%0.33732%0.319SS..Hα-helixtrans-62.7-36.8175.7-70.6-17.9000111.4C210 L217 K218C210-D214 WeakPolarHBondContact O-CB 3.34Å; C210-D214 PolarHBondContact O-N 3.34Å; D214-L217 PolarHBondContact O-N 2.98Å; D214-K218 WeakPolarHBondContact O-CB 3.41Å; D214-K218 WeakPolarHBondContact O-CG 3.4Å; D214-K218 PolarHBondContact O-N 2.89Å
215H95.2Very high95Very high52 Ų5268.6 Ų68.624%0.24133%0.325CS..Hα-helixtrans-65.8-45.6173.6-170.6-89.1000111.4H180 H211 V212 L213 L217 K218 E219H180-H215 AromaticContact CD2-ND1 3.67Å; H180-H215 AromaticContact CE1-ND1 3.71Å; H180-H215 WeakPolarHBondContact NE2-CB 3.25Å; H180-H215 AromaticContact NE2-CE1 3.86Å; H180-H215 AromaticContact NE2-CG 3.32Å; H180-H215 VanDerWaalsContact NE2-CG 3.32Å; H180-H215 AromaticContact NE2-ND1 3.05Å; H180-H215 PolarHBondContact NE2-ND1 2.8Å; H211-H215 WeakPolarHBondContact O-CB 3.12Å; H211-H215 PolarHBondContact O-N 3.02Å; V212-H215 WeakPolarHBondContact O-CB 3.44Å; V212-H215 PolarHBondContact O-N 3.08Å; L213-H215 VanDerWaalsContact C-N 3.28Å; L213-H215 PolarHBondContact O-N 3.19Å; H215-L217 VanDerWaalsContact C-N 3.29Å; H215-L217 PolarHBondContact O-N 3.45Å; H215-K218 PolarHBondContact O-N 3.33Å; H215-E219 WeakPolarHBondContact O-CG 3.43Å; H215-E219 PolarHBondContact O-N 3.23Å
216L94.4Very high94.8Very high0 Ų066.4 Ų66.40%033%0.325CS..Hα-helixtrans-60.5-37.2175.9-66.5177.3000112.5L176 V183 V212 L213 G220 L221 A222L176-L216 HydrophobicContact CD2-CD2 4.26Å; V183-L216 HydrophobicContact CG1-CD1 4.07Å; V212-L216 HydrophobicContact CG1-CD1 4.42Å; V212-L216 WeakPolarHBondContact O-CG 3.39Å; V212-L216 PolarHBondContact O-N 3.2Å; L213-L216 PolarHBondContact O-N 3.35Å; L216-G220 PolarHBondContact O-N 3.17Å; L216-L221 HydrophobicContact CB-CB 4.5Å; L216-L221 HydrophobicContact CD2-CB 4.19Å; L216-L221 HydrophobicContact CD2-CD1 3.9Å; L216-L221 PolarHBondContact O-N 2.97Å; L216-A222 HydrophobicContact CB-CB 3.91Å; L216-A222 PolarHBondContact O-N 3.04Å
217L94.7Very high94.7Very high50 Ų5068.9 Ų68.926%0.26234%0.339SS..Hα-helixtrans-66-45.4173.6-70179.6000111.9L213 D214 H215 E219 G220 A222 L224 Y234L213-L217 WeakPolarHBondContact O-CG 3.32Å; L213-L217 PolarHBondContact O-N 3.49Å; D214-L217 PolarHBondContact O-N 2.98Å; H215-L217 VanDerWaalsContact C-N 3.29Å; H215-L217 PolarHBondContact O-N 3.45Å; L217-E219 VanDerWaalsContact C-N 3.33Å; L217-E219 PolarHBondContact O-N 2.88Å; L217-G220 PolarHBondContact O-N 3.23Å; L217-A222 HydrophobicContact CD2-CB 4.08Å; L217-A222 VanDerWaalsContact CD2-O 3.27Å; L217-A222 WeakPolarHBondContact CD2-O 3.22Å; L217-L224 HydrophobicContact CD1-CB 4.48Å; L217-L224 HydrophobicContact CD2-CB 4.2Å; L217-Y234 HydrophobicContact CD1-CD1 4.08Å; L217-Y234 HydrophobicContact CD1-CE1 3.7Å; L217-Y234 HydrophobicContact CD2-CD1 4.18Å; L217-Y234 HydrophobicContact CG-CD1 4.12Å; L217-Y234 HydrophobicContact CG-CE1 4.21Å
218K93.6Very high94.4Very high166 Ų16662.6 Ų62.672%0.72231%0.312SS*.Hα-helixtrans-62.4-39.3179.7-76.1168.3-174.2171.90112.6D214 H215 G220D214-K218 WeakPolarHBondContact O-CB 3.41Å; D214-K218 WeakPolarHBondContact O-CG 3.4Å; D214-K218 PolarHBondContact O-N 2.89Å; H215-K218 PolarHBondContact O-N 3.33Å; K218-G220 PolarHBondContact O-N 2.77Å
219E91.1Very high93.9Very high81 Ų8162.2 Ų62.238%0.37933%0.332SS..THydrogen-bonded Turntrans-76.6-3176.3-64.4-57.9137.800112.8H215 L217 L221H215-E219 WeakPolarHBondContact O-CG 3.43Å; H215-E219 PolarHBondContact O-N 3.23Å; L217-E219 VanDerWaalsContact C-N 3.33Å; L217-E219 PolarHBondContact O-N 2.88Å; E219-L221 HydrophobicContact CB-CD1 4.01Å; E219-L221 HydrophobicContact CB-CG 3.85Å; E219-L221 PolarHBondContact O-N 3.05Å
220G91.2Very high93.6Very high31 Ų3166.5 Ų66.532%0.3238%0.377SS..THydrogen-bonded Turntrans69.418-178.400000114G116 L216 L217 K218G116-G220 WeakPolarHBondContact CA-O 3.39Å; L216-G220 PolarHBondContact O-N 3.17Å; L217-G220 PolarHBondContact O-N 3.23Å; K218-G220 PolarHBondContact O-N 2.77Å
221L92.8Very high93.5Very high5 Ų568.1 Ų68.13%0.02638%0.381CS..SBendtrans-85.1-18.1179.6-60.2-179.9000112.7G116 L118 L176 L216 E219 P237G116-L221 WeakPolarHBondContact O-CD2 3.39Å; L118-L221 HydrophobicContact CB-CD2 4.44Å; L118-L221 HydrophobicContact CD1-CB 4.45Å; L118-L221 HydrophobicContact CD1-CD1 3.99Å; L118-L221 HydrophobicContact CD1-CD2 3.83Å; L118-L221 HydrophobicContact CD1-CG 4.31Å; L118-L221 HydrophobicContact CG-CD2 3.76Å; L176-L221 HydrophobicContact CD1-CD1 4.25Å; L176-L221 HydrophobicContact CD2-CD1 3.86Å; L216-L221 HydrophobicContact CB-CB 4.5Å; L216-L221 HydrophobicContact CD2-CB 4.19Å; L216-L221 HydrophobicContact CD2-CD1 3.9Å; L216-L221 PolarHBondContact O-N 2.97Å; E219-L221 HydrophobicContact CB-CD1 4.01Å; E219-L221 HydrophobicContact CB-CG 3.85Å; E219-L221 PolarHBondContact O-N 3.05Å; L221-P237 WeakPolarHBondContact O-CD 3.34Å
222A94.5Very high93.5Very high4 Ų463.2 Ų63.23%0.03337%0.365CS..  trans-133.2153.917800000112.1L216 L217 W235 L236L216-A222 HydrophobicContact CB-CB 3.91Å; L216-A222 PolarHBondContact O-N 3.04Å; L217-A222 HydrophobicContact CD2-CB 4.08Å; L217-A222 VanDerWaalsContact CD2-O 3.27Å; L217-A222 WeakPolarHBondContact CD2-O 3.22Å; A222-W235 CarbonylContact C-O 3.57Å; A222-W235 WeakPolarHBondContact CA-O 3.27Å; A222-L236 HydrophobicContact CB-CG 4.46Å
223W94.6Very high93.4Very high143 Ų14364.3 Ų64.354%0.54237%0.37SS..EExtended strand (participates in β ladder)trans-114.8143171-63.1-7000109.8Y234 W235 P237W223-Y234 CarbonylContact O-C 3.42Å; W223-Y234 WeakPolarHBondContact O-CA 3.34Å; W223-W235 PolarHBondContact N-O 2.85Å; W223-W235 PolarHBondContact O-N 3.1Å; W223-P237 HydrophobicContact CD2-CG 3.96Å; W223-P237 HydrophobicContact CG-CG 4.25Å; W223-P237 HydrophobicContact CZ2-CG 4.08Å
224L96.1Very high93.5Very high94 Ų9465.5 Ų65.549%0.49238%0.375SS..EExtended strand (participates in β ladder)trans-93.6121.1177.5-179.364.3000110.3L217 A232 Y234L217-L224 HydrophobicContact CD1-CB 4.48Å; L217-L224 HydrophobicContact CD2-CB 4.2Å; L224-A232 HydrophobicContact CD1-CB 3.92Å; L224-Y234 HydrophobicContact CD1-CD1 4.14Å; L224-Y234 HydrophobicContact CD1-CD2 4.41Å; L224-Y234 HydrophobicContact CD1-CE1 3.82Å; L224-Y234 HydrophobicContact CD1-CE2 4.07Å; L224-Y234 HydrophobicContact CD1-CG 4.44Å
225D95.6Very high93.4Very high46 Ų4665.9 Ų65.925%0.24637%0.371CS..EExtended strand (participates in β ladder)trans-104.8105.6167.4177.310.8000109.6Q227 A228 A232 Q233D225-Q227 WeakPolarHBondContact OD1-CA 3.46Å; D225-Q227 WeakPolarHBondContact OD1-CB 3.35Å; D225-Q227 PolarHBondContact OD1-N 3.19Å; D225-A228 PolarHBondContact OD1-N 2.79Å; D225-A232 WeakPolarHBondContact O-CA 3.36Å; D225-Q233 HydrophobicContact CB-CB 4.33Å; D225-Q233 PolarHBondContact N-O 2.82Å; D225-Q233 PolarHBondContact O-N 2.9Å
226S93.8Very high93.3Very high94 Ų9463.5 Ų63.566%0.65736%0.36SS*.SBendtrans-89.9-2.8176.357.60000113.7
227Q93.3Very high93.2Very high181 Ų18164 Ų6485%0.84636%0.363SS*.SBendtrans-98.1-10.7-177.1-58.6177.34100112.2D225D225-Q227 WeakPolarHBondContact OD1-CA 3.46Å; D225-Q227 WeakPolarHBondContact OD1-CB 3.35Å; D225-Q227 PolarHBondContact OD1-N 3.19Å
228A89.8Confident92.9Very high20 Ų2061.7 Ų61.717%0.16535%0.352CS..SBendtrans-54.8142.2174.400000112.7D225 G230 Q233D225-A228 PolarHBondContact OD1-N 2.79Å; A228-G230 PolarHBondContact O-N 3.37Å; A228-Q233 HydrophobicContact CB-CB 4.16Å; A228-Q233 HydrophobicContact CB-CG 3.56Å
229A86.1Confident92.7Very high100 Ų10054.7 Ų54.783%0.82632%0.322SS*.SBendtrans-66.8127.1177.400000111
230G89Confident92.2Very high90 Ų9054.3 Ų54.393%0.92832%0.319SS*.SBendtrans100-76.2175.900000113.1A228A228-G230 PolarHBondContact O-N 3.37Å
231E94Very high90.7Very high64 Ų6457.3 Ų57.330%0.29934%0.336SS..SBendtrans-139.5160.6179.672.9-177.4146.800111.7T194 S196 Q233T194-E231 WeakPolarHBondContact CB-OE1 3.45Å; T194-E231 HydrophobicContact CG2-CG 3.78Å; T194-E231 PolarHBondContact OG1-OE1 2.91Å; S196-E231 WeakPolarHBondContact CB-OE1 3.13Å; S196-E231 WeakPolarHBondContact CB-OE2 3.45Å; S196-E231 PolarHBondContact N-OE2 2.93Å; S196-E231 VanDerWaalsContact N-OE2 3.16Å; S196-E231 VanDerWaalsContact OG-CD 3.28Å; S196-E231 PolarHBondContact OG-OE1 3.5Å; S196-E231 PolarHBondContact OG-OE2 2.92Å; E231-Q233 PolarHBondContact O-N 3.44Å
232A94.6Very high88.8Confident38 Ų3864.3 Ų64.331%0.31437%0.368SS..  trans-61.1133.3179.100000111.4L224 D225L224-A232 HydrophobicContact CD1-CB 3.92Å; D225-A232 WeakPolarHBondContact O-CA 3.36Å
233Q96Very high86.7Confident28 Ų2866.8 Ų66.813%0.13138%0.38CS..EExtended strand (participates in β ladder)trans-104.8138.7-178.8-67.6178.6-3.300110.6Y192 T194 D225 A228 E231 W235Y192-Q233 HydrophobicContact CD2-CB 3.91Å; Y192-Q233 HydrophobicContact CD2-CG 3.76Å; Y192-Q233 HydrophobicContact CE2-CB 4.47Å; Y192-Q233 VanDerWaalsContact CE2-CD 3.5Å; Y192-Q233 HydrophobicContact CE2-CG 3.81Å; Y192-Q233 HydrophobicContact CG-CB 4.38Å; T194-Q233 HydrophobicContact CG2-CG 3.81Å; D225-Q233 HydrophobicContact CB-CB 4.33Å; D225-Q233 PolarHBondContact N-O 2.82Å; D225-Q233 PolarHBondContact O-N 2.9Å; A228-Q233 HydrophobicContact CB-CB 4.16Å; A228-Q233 HydrophobicContact CB-CG 3.56Å; E231-Q233 PolarHBondContact O-N 3.44Å; Q233-W235 VanDerWaalsContact OE1-CZ2 3.24Å
234Y96.4Very high84.4Confident26 Ų2665 Ų6510%0.10239%0.385CS..EExtended strand (participates in β ladder)trans-109101.3177.6-63.8-104.9000108.1Y192 V193 V195 L213 L217 W223 L224Y192-Y234 CarbonylContact C-O 3.53Å; Y192-Y234 WeakPolarHBondContact CA-O 3.26Å; Y192-Y234 WeakPolarHBondContact CB-O 3.44Å; V193-Y234 PolarHBondContact N-O 3.24Å; V193-Y234 PolarHBondContact O-N 2.92Å; V195-Y234 HydrophobicContact CG2-CE2 4.2Å; L213-Y234 HydrophobicContact CB-CD1 3.84Å; L213-Y234 HydrophobicContact CB-CE1 3.66Å; L213-Y234 HydrophobicContact CB-CG 4.36Å; L213-Y234 HydrophobicContact CD1-CD1 4.39Å; L213-Y234 HydrophobicContact CD1-CD2 3.81Å; L213-Y234 HydrophobicContact CD1-CE1 4.22Å; L213-Y234 HydrophobicContact CD1-CE2 3.67Å; L213-Y234 HydrophobicContact CD1-CG 4.18Å; L213-Y234 HydrophobicContact CD2-CD1 4.01Å; L213-Y234 HydrophobicContact CD2-CD2 4.13Å; L213-Y234 HydrophobicContact CD2-CG 3.75Å; L213-Y234 HydrophobicContact CG-CD1 4.3Å; L213-Y234 HydrophobicContact CG-CD2 4.43Å; L213-Y234 HydrophobicContact CG-CE1 4.37Å; L213-Y234 HydrophobicContact CG-CG 4.31Å; L217-Y234 HydrophobicContact CD1-CD1 4.08Å; L217-Y234 HydrophobicContact CD1-CE1 3.7Å; L217-Y234 HydrophobicContact CD2-CD1 4.18Å; L217-Y234 HydrophobicContact CG-CD1 4.12Å; L217-Y234 HydrophobicContact CG-CE1 4.21Å; W223-Y234 CarbonylContact O-C 3.42Å; W223-Y234 WeakPolarHBondContact O-CA 3.34Å; L224-Y234 HydrophobicContact CD1-CD1 4.14Å; L224-Y234 HydrophobicContact CD1-CD2 4.41Å; L224-Y234 HydrophobicContact CD1-CE1 3.82Å; L224-Y234 HydrophobicContact CD1-CE2 4.07Å; L224-Y234 HydrophobicContact CD1-CG 4.44Å
235W94.8Very high81.8Confident71 Ų7164.3 Ų64.327%0.26939%0.389SS..EExtended strand (participates in β ladder)trans-87.4135.5-174.6-7286.9000111.1Y192 A222 W223 Q233 P237 F240Y192-W235 HydrophobicContact CD1-CD2 4.11Å; Y192-W235 AromaticContact CD1-CE2 3.89Å; Y192-W235 AromaticContact CD1-CE3 3.94Å; Y192-W235 HydrophobicContact CD1-CE3 3.94Å; Y192-W235 AromaticContact CD1-CH2 3.36Å; Y192-W235 HydrophobicContact CD1-CH2 3.36Å; Y192-W235 AromaticContact CD1-CZ2 3.53Å; Y192-W235 HydrophobicContact CD1-CZ2 3.53Å; Y192-W235 AromaticContact CD1-CZ3 3.58Å; Y192-W235 HydrophobicContact CD1-CZ3 3.58Å; Y192-W235 AromaticContact CE1-CH2 3.77Å; Y192-W235 HydrophobicContact CE1-CH2 3.77Å; Y192-W235 AromaticContact CE1-CZ2 3.94Å; Y192-W235 HydrophobicContact CE1-CZ2 3.94Å; Y192-W235 HydrophobicContact CE1-CZ3 4.36Å; Y192-W235 HydrophobicContact CG-CD2 4.15Å; Y192-W235 HydrophobicContact CG-CE3 4.32Å; Y192-W235 HydrophobicContact CG-CH2 4.29Å; Y192-W235 HydrophobicContact CG-CZ2 4.1Å; Y192-W235 HydrophobicContact CG-CZ3 4.39Å; A222-W235 CarbonylContact C-O 3.57Å; A222-W235 WeakPolarHBondContact CA-O 3.27Å; W223-W235 PolarHBondContact N-O 2.85Å; W223-W235 PolarHBondContact O-N 3.1Å; Q233-W235 VanDerWaalsContact OE1-CZ2 3.24Å; W235-P237 WeakPolarHBondContact O-CD 3.42Å; W235-F240 HydrophobicContact CZ3-CD2 4.23Å; W235-F240 HydrophobicContact CZ3-CE2 4.27Å
236L93.3Very high79.4Confident2 Ų272.3 Ų72.31%0.0142%0.416CS..  trans-107.7105.2177.1-67.798.5000109.4L184 A187 G191 V193 A222 A238 L239L184-L236 HydrophobicContact CD2-CD2 3.13Å; A187-L236 HydrophobicContact CB-CD1 3.52Å; G191-L236 PolarHBondContact O-N 3.49Å; V193-L236 HydrophobicContact CG1-CD1 4.35Å; A222-L236 HydrophobicContact CB-CG 4.46Å; L236-A238 PolarHBondContact O-N 3.27Å; L236-A238 VanDerWaalsContact O-N 3.1Å; L236-L239 HydrophobicContact CB-CD1 4.07Å; L236-L239 HydrophobicContact CB-CG 4.31Å; L236-L239 HydrophobicContact CD2-CD1 4.5Å; L236-L239 PolarHBondContact O-N 3.09Å
237P91.6Very high77.3Confident9 Ų972 Ų726%0.05841%0.406CS..G310 helixtrans-59.2-30.2-175.5-22.532000112.8R114 N115 L221 W223 W235 L239 F240 L243R114-P237 WeakPolarHBondContact O-CB 3.37Å; N115-P237 HydrophobicContact CB-CB 4.4Å; L221-P237 WeakPolarHBondContact O-CD 3.34Å; W223-P237 HydrophobicContact CD2-CG 3.96Å; W223-P237 HydrophobicContact CG-CG 4.25Å; W223-P237 HydrophobicContact CZ2-CG 4.08Å; W235-P237 WeakPolarHBondContact O-CD 3.42Å; P237-L239 PolarHBondContact O-N 3.49Å; P237-F240 PolarHBondContact O-N 3.38Å; P237-F240 VanDerWaalsContact O-N 3.08Å; P237-L243 HydrophobicContact CB-CD1 4.22Å
238A89.9Confident75.1Confident3 Ų365.8 Ų65.83%0.02538%0.381CS..G310 helixtrans-59.2-25176.900000114.4N115 L118 T120 L168 L236N115-A238 HydrophobicContact CB-CB 4.46Å; L118-A238 HydrophobicContact CB-CB 3.55Å; L118-A238 WeakPolarHBondContact O-CB 3.47Å; T120-A238 WeakPolarHBondContact CG2-O 3.24Å; L168-A238 HydrophobicContact CD2-CB 4.3Å; L236-A238 PolarHBondContact O-N 3.27Å; L236-A238 VanDerWaalsContact O-N 3.1Å
239L87.8Confident73.3Confident19 Ų1967.5 Ų67.510%0.09939%0.389CS..G310 helixtrans-99.2-3.3-179.1-63.7175.1000112.2T120 L168 A187 L236 P237 S241T120-L239 HydrophobicContact CG2-CD2 4.2Å; L168-L239 HydrophobicContact CD1-CD2 4.29Å; L168-L239 HydrophobicContact CD2-CD2 4.02Å; L168-L239 HydrophobicContact CG-CD2 4.45Å; A187-L239 HydrophobicContact CB-CD1 3.78Å; L236-L239 HydrophobicContact CB-CD1 4.07Å; L236-L239 HydrophobicContact CB-CG 4.31Å; L236-L239 HydrophobicContact CD2-CD1 4.5Å; L236-L239 PolarHBondContact O-N 3.09Å; P237-L239 PolarHBondContact O-N 3.49Å; L239-S241 PolarHBondContact O-N 3.01Å
240F80.7Confident71.5Confident72 Ų7268 Ų6832%0.31638%0.384SS..  trans-94.1103.1-175.5-166.4-97.6000110.8W235 P237 E242 L243W235-F240 HydrophobicContact CZ3-CD2 4.23Å; W235-F240 HydrophobicContact CZ3-CE2 4.27Å; P237-F240 PolarHBondContact O-N 3.38Å; P237-F240 VanDerWaalsContact O-N 3.08Å; F240-E242 VanDerWaalsContact C-N 3.27Å; F240-E242 HydrophobicContact CD1-CB 4.15Å; F240-E242 HydrophobicContact CE1-CB 3.5Å; F240-E242 VanDerWaalsContact CE1-CB 3.5Å; F240-E242 HydrophobicContact CZ-CB 3.84Å; F240-E242 PolarHBondContact O-N 2.88Å; F240-L243 HydrophobicContact CD1-CB 4.18Å; F240-L243 HydrophobicContact CD1-CD1 4.03Å; F240-L243 HydrophobicContact CD1-CG 3.65Å; F240-L243 HydrophobicContact CE1-CG 4.14Å
241S60.7Low69.5Low95 Ų9570.7 Ų70.766%0.66437%0.373SS*.G310 helixtrans-69-22.8-175.1-29.50000113.7L239 T244L239-S241 PolarHBondContact O-N 3.01Å; S241-T244 VanDerWaalsContact O-CG2 3.29Å; S241-T244 WeakPolarHBondContact O-CG2 3.46Å; S241-T244 PolarHBondContact O-OG1 3.04Å
242E53Low67.2Low152 Ų15271.7 Ų71.771%0.7138%0.377SS*.G310 helixtrans-86.4-2.1-172.9-63.8-169.4169.900114.6F240 T244F240-E242 VanDerWaalsContact C-N 3.27Å; F240-E242 HydrophobicContact CD1-CB 4.15Å; F240-E242 HydrophobicContact CE1-CB 3.5Å; F240-E242 VanDerWaalsContact CE1-CB 3.5Å; F240-E242 HydrophobicContact CZ-CB 3.84Å; F240-E242 PolarHBondContact O-N 2.88Å; E242-T244 PolarHBondContact O-N 2.91Å
243L49Very low65Low55 Ų5572.3 Ų72.329%0.28838%0.382SS..G310 helixtrans-73.212.9165.9-79.7166.3000112.8P237 F240 S245P237-L243 HydrophobicContact CB-CD1 4.22Å; F240-L243 HydrophobicContact CD1-CB 4.18Å; F240-L243 HydrophobicContact CD1-CD1 4.03Å; F240-L243 HydrophobicContact CD1-CG 3.65Å; F240-L243 HydrophobicContact CE1-CG 4.14Å; L243-S245 PolarHBondContact O-N 2.8Å
244T47Very low62.7Low105 Ų10577.6 Ų77.664%0.64441%0.411SS*.G310 helixtrans-64.25.1167.7360000113.6S241 E242 R246S241-T244 VanDerWaalsContact O-CG2 3.29Å; S241-T244 WeakPolarHBondContact O-CG2 3.46Å; S241-T244 PolarHBondContact O-OG1 3.04Å; E242-T244 PolarHBondContact O-N 2.91Å; T244-R246 PolarHBondContact O-N 3.35Å
245S41.6Very low60.2Low81 Ų8184.1 Ų84.157%0.56644%0.443SS*.SBendtrans-75.2108.4170.966.40000111.4L243L243-S245 PolarHBondContact O-N 2.8Å
246R45.3Very low57.7Low214 Ų21487.5 Ų87.581%0.80846%0.463SS*.  trans44.3119.1159.7-67.9-179.1175.1172.7-1.7116T244 V248T244-R246 PolarHBondContact O-N 3.35Å; R246-V248 VanDerWaalsContact C-N 3.29Å; R246-V248 PolarHBondContact O-N 2.85Å
247D48.6Very low55.1Low86 Ų8692.3 Ų92.346%0.4649%0.493SS..  trans-53.7100160.3-56.6-54.6000106.6R127 K130 T249R127-D247 IonicContact NH1-OD1 2.79Å; R127-D247 PolarHBondContact NH1-OD1 3.23Å; K130-D247 IonicContact NZ-OD2 3.89Å; K130-D247 PolarHBondContact NZ-OD2 3.34Å; D247-T249 PolarHBondContact O-N 3.14Å; D247-T249 VanDerWaalsContact O-N 3.14Å
248V48.8Very low52.8Low52 Ų52101.4 Ų101.432%0.31555%0.552SS.*  trans-70.6111.1171.6175.40000103.2R246 E252 A253R246-V248 VanDerWaalsContact C-N 3.29Å; R246-V248 PolarHBondContact O-N 2.85Å; V248-E252 WeakPolarHBondContact CA-OE2 3.44Å; V248-E252 HydrophobicContact CG1-CB 3.5Å; V248-A253 HydrophobicContact CG1-CB 4.19Å
249T50.3Low51Low56 Ų56106.4 Ų106.434%0.34458%0.579SS.*  trans-60.7153177.457.50000108.4D247 E251 E252 A253D247-T249 PolarHBondContact O-N 3.14Å; D247-T249 VanDerWaalsContact O-N 3.14Å; T249-E251 PolarHBondContact O-N 3.43Å; T249-E252 PolarHBondContact N-OE2 2.96Å; T249-E252 PolarHBondContact O-N 3.43Å; T249-E252 WeakPolarHBondContact OG1-CG 3.4Å; T249-E252 PolarHBondContact OG1-N 2.91Å; T249-A253 PolarHBondContact O-N 3.16Å; T249-A253 VanDerWaalsContact O-N 3.16Å
250P49.2Very low49Very low110 Ų110110.9 Ų110.971%0.71460%0.604SS**Hα-helixtrans-51.7-25.8174.6-25.933.8000113.2N254P250-N254 PolarHBondContact O-N 3.5Å
251E47.5Very low47.3Very low147 Ų147113.1 Ų113.169%0.68762%0.62SS**Hα-helixtrans-71.7-37.6176.2-65.1169162.500113.1T249T249-E251 PolarHBondContact O-N 3.43Å
252E44.8Very low46.5Very low85 Ų85114.2 Ų114.240%0.39762%0.617SS.*Hα-helixtrans-75.6-31.5176.6-72.2175.4163.900111.9V248 T249 N254 Q255 M256V248-E252 WeakPolarHBondContact CA-OE2 3.44Å; V248-E252 HydrophobicContact CG1-CB 3.5Å; T249-E252 PolarHBondContact N-OE2 2.96Å; T249-E252 PolarHBondContact O-N 3.43Å; T249-E252 WeakPolarHBondContact OG1-CG 3.4Å; T249-E252 PolarHBondContact OG1-N 2.91Å; E252-N254 VanDerWaalsContact C-N 3.31Å; E252-N254 PolarHBondContact O-N 3.42Å; E252-Q255 PolarHBondContact O-N 3.14Å; E252-Q255 VanDerWaalsContact O-N 3.14Å; E252-M256 PolarHBondContact O-N 3.43Å
253A48.7Very low46.1Very low51 Ų51111.8 Ų111.842%0.42161%0.611SS.*Hα-helixtrans-64.3-34.6175.600000112.6V248 T249 Q255 M256V248-A253 HydrophobicContact CG1-CB 4.19Å; T249-A253 PolarHBondContact O-N 3.16Å; T249-A253 VanDerWaalsContact O-N 3.16Å; A253-Q255 VanDerWaalsContact C-N 3.26Å; A253-Q255 PolarHBondContact O-N 3.41Å; A253-M256 PolarHBondContact O-N 3.49Å
254N46.9Very low45.9Very low138 Ų138115.6 Ų115.674%0.73863%0.633SS**THydrogen-bonded Turntrans-74.4-12175.3-89-6.2000114P250 E252P250-N254 PolarHBondContact O-N 3.5Å; E252-N254 VanDerWaalsContact C-N 3.31Å; E252-N254 PolarHBondContact O-N 3.42Å
255Q44.7Very low45.8Very low163 Ų163116.4 Ų116.476%0.76263%0.632SS**THydrogen-bonded Turntrans-98.6-8.5177.6-67.1-179.61700113.1E252 A253E252-Q255 PolarHBondContact O-N 3.14Å; E252-Q255 VanDerWaalsContact O-N 3.14Å; A253-Q255 VanDerWaalsContact C-N 3.26Å; A253-Q255 PolarHBondContact O-N 3.41Å
256M41.9Very low46.1Very low142 Ų142119.1 Ų119.170%0.764%0.637SS**SBendtrans-99-0.5-176.8-74.4-173.5178.700114.7E252 A253E252-M256 PolarHBondContact O-N 3.43Å; A253-M256 PolarHBondContact O-N 3.49Å
257T38.2Very low46.2Very low103 Ų103111.2 Ų111.263%0.63262%0.623SS**  trans-88.6126.7167.539.10000110.3
258P44.5Very low46Very low201 Ų201113.5 Ų113.5100%1.30564%0.638SS**  trans-65.80169.928.4-32.4000112.4

Retrieved 258 of 258 residues in 47.1 ms (Link to these results)

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