A0AA82N812_SCHMA Loading...

Uncharacterized protein AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N812, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 94 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
1M50Low59.6Low189 Ų189103.1 Ų103.193%0.93155%0.545SS*.  0-370-107.6179.3-8600114N3 L4 I5M1-N3 VanDerWaalsContact C-N 3.25Å; M1-N3 PolarHBondContact O-N 3.02Å; M1-N3 VanDerWaalsContact O-N 3.16Å; M1-L4 PolarHBondContact O-N 3.13Å; M1-I5 PolarHBondContact O-N 3.28Å
2G51.7Low60.5Low45 Ų45101.2 Ų101.246%0.46455%0.546SS..Hα-helixtrans-49.7-42.6178.600000114.3L4 I5 F6G2-L4 VanDerWaalsContact C-N 3.32Å; G2-L4 PolarHBondContact O-N 2.88Å; G2-I5 PolarHBondContact O-N 3.08Å; G2-F6 VanDerWaalsContact O-CD2 3.28Å; G2-F6 WeakPolarHBondContact O-CD2 3.1Å; G2-F6 PolarHBondContact O-N 2.8Å; G2-F6 VanDerWaalsContact O-N 3.12Å
3N56.4Low61.1Low131 Ų13197.6 Ų97.670%0.70153%0.527SS*.Hα-helixtrans-61.4-34.6179.2-156.113.9000114M1 T7M1-N3 VanDerWaalsContact C-N 3.25Å; M1-N3 PolarHBondContact O-N 3.02Å; M1-N3 VanDerWaalsContact O-N 3.16Å; N3-T7 VanDerWaalsContact O-CB 3.31Å; N3-T7 WeakPolarHBondContact O-CB 3.28Å; N3-T7 PolarHBondContact O-N 3.27Å; N3-T7 PolarHBondContact O-OG1 3.44Å
4L57.1Low61.9Low114 Ų114100.4 Ų100.460%0.59753%0.531SS*.Hα-helixtrans-69.9-41.7178.5-97.3148.1000111.8M1 G2 T7 L8M1-L4 PolarHBondContact O-N 3.13Å; G2-L4 VanDerWaalsContact C-N 3.32Å; G2-L4 PolarHBondContact O-N 2.88Å; L4-T7 PolarHBondContact O-N 3.02Å; L4-L8 WeakPolarHBondContact O-CB 3.21Å; L4-L8 VanDerWaalsContact O-CG 3.32Å; L4-L8 WeakPolarHBondContact O-CG 3.45Å; L4-L8 PolarHBondContact O-N 3.25Å
5I58.9Low62.9Low73 Ų7398.6 Ų98.637%0.37452%0.522SS..Hα-helixtrans-64.2-48.1177.6-65.5170000109.9M1 G2 T7 L8 L9M1-I5 PolarHBondContact O-N 3.28Å; G2-I5 PolarHBondContact O-N 3.08Å; I5-T7 VanDerWaalsContact C-N 3.3Å; I5-T7 PolarHBondContact O-N 2.86Å; I5-L8 PolarHBondContact O-N 3.24Å; I5-L9 HydrophobicContact CG2-CD1 3.68Å; I5-L9 HydrophobicContact CG2-CG 4.25Å; I5-L9 WeakPolarHBondContact O-CB 3.25Å; I5-L9 VanDerWaalsContact O-CG 3.28Å; I5-L9 WeakPolarHBondContact O-CG 3.18Å; I5-L9 PolarHBondContact O-N 3.34Å
6F58.5Low63.7Low123 Ų12396 Ų9654%0.53951%0.508SS..Hα-helixtrans-59.2-41.3175.7-84.3-75.1000112G2 S10G2-F6 VanDerWaalsContact O-CD2 3.28Å; G2-F6 WeakPolarHBondContact O-CD2 3.1Å; G2-F6 PolarHBondContact O-N 2.8Å; G2-F6 VanDerWaalsContact O-N 3.12Å; F6-S10 VanDerWaalsContact O-CB 3.24Å; F6-S10 WeakPolarHBondContact O-CB 3.3Å; F6-S10 PolarHBondContact O-N 3.4Å; F6-S10 PolarHBondContact O-OG 3.32Å
7T64.6Low64.4Low73 Ų7394.5 Ų94.545%0.44850%0.497SS..Hα-helixtrans-64.9-47.5178.3-570000111.4N3 L4 I5 S10 Y11N3-T7 VanDerWaalsContact O-CB 3.31Å; N3-T7 WeakPolarHBondContact O-CB 3.28Å; N3-T7 PolarHBondContact O-N 3.27Å; N3-T7 PolarHBondContact O-OG1 3.44Å; L4-T7 PolarHBondContact O-N 3.02Å; I5-T7 VanDerWaalsContact C-N 3.3Å; I5-T7 PolarHBondContact O-N 2.86Å; T7-S10 PolarHBondContact O-N 2.96Å; T7-S10 PolarHBondContact O-OG 3.26Å; T7-Y11 WeakPolarHBondContact O-CB 3.24Å; T7-Y11 PolarHBondContact O-N 3.47Å
8L60.1Low64.8Low114 Ų11492.7 Ų92.760%0.59749%0.493SS*.Hα-helixtrans-64.2-43.6179.3-72.3170.8000112.1L4 I5 Y11 S12L4-L8 WeakPolarHBondContact O-CB 3.21Å; L4-L8 VanDerWaalsContact O-CG 3.32Å; L4-L8 WeakPolarHBondContact O-CG 3.45Å; L4-L8 PolarHBondContact O-N 3.25Å; I5-L8 PolarHBondContact O-N 3.24Å; L8-Y11 PolarHBondContact O-N 3.4Å; L8-S12 WeakPolarHBondContact O-CB 3.26Å; L8-S12 PolarHBondContact O-N 2.8Å
9L62.8Low65.5Low54 Ų5493.7 Ų93.728%0.28349%0.494SS..Hα-helixtrans-60.3-46.4173.7-73.1171.1000110.7I5 Y11 S12 L13 L61I5-L9 HydrophobicContact CG2-CD1 3.68Å; I5-L9 HydrophobicContact CG2-CG 4.25Å; I5-L9 WeakPolarHBondContact O-CB 3.25Å; I5-L9 VanDerWaalsContact O-CG 3.28Å; I5-L9 WeakPolarHBondContact O-CG 3.18Å; I5-L9 PolarHBondContact O-N 3.34Å; L9-Y11 VanDerWaalsContact C-N 3.32Å; L9-Y11 PolarHBondContact O-N 3.39Å; L9-S12 PolarHBondContact O-N 3.06Å; L9-L13 WeakPolarHBondContact O-CB 3.42Å; L9-L13 PolarHBondContact O-N 3.38Å; L9-L61 HydrophobicContact CD1-CD1 4.1Å
10S67.7Low66Low68 Ų6894.5 Ų94.548%0.47649%0.49SS..Hα-helixtrans-63.4-37.1179.275.20000112.8F6 T7 K14F6-S10 VanDerWaalsContact O-CB 3.24Å; F6-S10 WeakPolarHBondContact O-CB 3.3Å; F6-S10 PolarHBondContact O-N 3.4Å; F6-S10 PolarHBondContact O-OG 3.32Å; T7-S10 PolarHBondContact O-N 2.96Å; T7-S10 PolarHBondContact O-OG 3.26Å; S10-K14 VanDerWaalsContact O-CB 3.27Å; S10-K14 WeakPolarHBondContact O-CB 3.39Å; S10-K14 PolarHBondContact O-N 3.46Å
11Y67.7Low66.4Low150 Ų15093.2 Ų93.259%0.58848%0.484SS*.Hα-helixtrans-71.8-47.6179.6-174.3-96.7000111.5T7 L8 L9 L13 K14 N15T7-Y11 WeakPolarHBondContact O-CB 3.24Å; T7-Y11 PolarHBondContact O-N 3.47Å; L8-Y11 PolarHBondContact O-N 3.4Å; L9-Y11 VanDerWaalsContact C-N 3.32Å; L9-Y11 PolarHBondContact O-N 3.39Å; Y11-L13 VanDerWaalsContact C-N 3.31Å; Y11-L13 PolarHBondContact O-N 3.14Å; Y11-K14 PolarHBondContact O-N 3.02Å; Y11-N15 WeakPolarHBondContact CE1-ND2 3.49Å; Y11-N15 PolarHBondContact O-N 2.93Å; Y11-N15 VanDerWaalsContact O-N 3.1Å
12S70.3Confident67.6Low80 Ų8093.6 Ų93.656%0.55948%0.475SS*.Hα-helixtrans-60-43.2175.6-178.30000111.1L8 L9 N15 D16L8-S12 WeakPolarHBondContact O-CB 3.26Å; L8-S12 PolarHBondContact O-N 2.8Å; L9-S12 PolarHBondContact O-N 3.06Å; S12-N15 PolarHBondContact O-N 3.03Å; S12-D16 PolarHBondContact O-N 3Å; S12-D16 VanDerWaalsContact O-N 3.08Å
13L68.4Low68.9Low55 Ų5596.5 Ų96.529%0.28848%0.476SS..Hα-helixtrans-61.6-48176.7-169.681000112.3L9 Y11 N15 D16 F17 F53 F57L9-L13 WeakPolarHBondContact O-CB 3.42Å; L9-L13 PolarHBondContact O-N 3.38Å; Y11-L13 VanDerWaalsContact C-N 3.31Å; Y11-L13 PolarHBondContact O-N 3.14Å; L13-N15 VanDerWaalsContact C-N 3.26Å; L13-N15 PolarHBondContact O-N 3.11Å; L13-D16 PolarHBondContact O-N 3.23Å; L13-F17 VanDerWaalsContact O-CB 3.3Å; L13-F17 WeakPolarHBondContact O-CB 3.29Å; L13-F17 PolarHBondContact O-N 2.82Å; L13-F53 HydrophobicContact CD1-CE1 4.36Å; L13-F53 HydrophobicContact CD1-CZ 3.77Å; L13-F53 HydrophobicContact CG-CZ 4.18Å; L13-F57 HydrophobicContact CD1-CB 4.23Å; L13-F57 HydrophobicContact CD1-CD2 3.12Å; L13-F57 HydrophobicContact CD1-CE2 3.59Å; L13-F57 HydrophobicContact CD1-CG 3.9Å; L13-F57 HydrophobicContact CD2-CD2 3.97Å; L13-F57 HydrophobicContact CD2-CE2 3.66Å; L13-F57 HydrophobicContact CD2-CZ 4.15Å; L13-F57 HydrophobicContact CG-CD2 4.14Å; L13-F57 HydrophobicContact CG-CE2 4.18Å
14K71.8Confident69.7Low137 Ų13791 Ų9160%0.59645%0.447SS*.Hα-helixtrans-59-42.6-178.9-178.5179.7176.6-178.10110.7S10 Y11 C18S10-K14 VanDerWaalsContact O-CB 3.27Å; S10-K14 WeakPolarHBondContact O-CB 3.39Å; S10-K14 PolarHBondContact O-N 3.46Å; Y11-K14 PolarHBondContact O-N 3.02Å; K14-C18 VanDerWaalsContact O-CB 3.25Å; K14-C18 WeakPolarHBondContact O-CB 3.28Å; K14-C18 PolarHBondContact O-N 2.06Å; K14-C18 PolarHBondContact O-SG 3.12Å
15N77.6Confident70.4Confident73 Ų7390.2 Ų90.239%0.3944%0.443SS..Hα-helixtrans-66.9-45.7179.7-70.8-12.3000111.8Y11 S12 L13 C18 Q19Y11-N15 WeakPolarHBondContact CE1-ND2 3.49Å; Y11-N15 PolarHBondContact O-N 2.93Å; Y11-N15 VanDerWaalsContact O-N 3.1Å; S12-N15 PolarHBondContact O-N 3.03Å; L13-N15 VanDerWaalsContact C-N 3.26Å; L13-N15 PolarHBondContact O-N 3.11Å; N15-C18 PolarHBondContact O-N 3.44Å; N15-Q19 VanDerWaalsContact O-CB 3.31Å; N15-Q19 WeakPolarHBondContact O-CB 2.96Å; N15-Q19 PolarHBondContact O-N 3.46Å
16D76.2Confident71.3Confident57 Ų5792.9 Ų92.931%0.30545%0.452SS..Hα-helixtrans-64.8-44.2178.9-167.256.5000111.5S12 L13 Q19 R20 F53S12-D16 PolarHBondContact O-N 3Å; S12-D16 VanDerWaalsContact O-N 3.08Å; L13-D16 PolarHBondContact O-N 3.23Å; D16-Q19 PolarHBondContact O-N 3.38Å; D16-R20 VanDerWaalsContact O-CG 3.29Å; D16-R20 WeakPolarHBondContact O-CG 3.43Å; D16-R20 PolarHBondContact O-N 2.95Å; D16-R20 IonicContact OD1-CZ 3.93Å; D16-R20 IonicContact OD1-NE 3.44Å; D16-R20 PolarHBondContact OD1-NE 2.77Å; D16-R20 IonicContact OD1-NH2 3.58Å; D16-R20 PolarHBondContact OD1-NH2 2.67Å; D16-R20 IonicContact OD2-CZ 3.8Å; D16-R20 IonicContact OD2-NE 3.33Å; D16-R20 PolarHBondContact OD2-NE 3.47Å; D16-R20 IonicContact OD2-NH2 3.47Å; D16-R20 PolarHBondContact OD2-NH2 2.79Å; D16-F53 WeakPolarHBondContact OD2-CE2 3.49Å
17F74.7Confident72.1Confident70 Ų7087.5 Ų87.531%0.30743%0.43SS..Hα-helixtrans-58.9-51.6174.8178.6-98.9000112.1L13 Q19 R20 L21 F48 L50 F53L13-F17 VanDerWaalsContact O-CB 3.3Å; L13-F17 WeakPolarHBondContact O-CB 3.29Å; L13-F17 PolarHBondContact O-N 2.82Å; F17-Q19 VanDerWaalsContact C-N 3.3Å; F17-Q19 PolarHBondContact O-N 3.2Å; F17-R20 PolarHBondContact O-N 3.43Å; F17-L21 HydrophobicContact CE1-CD2 4.1Å; F17-L21 HydrophobicContact CZ-CD2 4.37Å; F17-L21 VanDerWaalsContact O-CB 3.31Å; F17-L21 WeakPolarHBondContact O-CB 3.16Å; F17-L21 PolarHBondContact O-N 2.95Å; F17-F48 HydrophobicContact CD2-CE1 4.21Å; F17-F48 HydrophobicContact CD2-CE2 4.5Å; F17-F48 AromaticContact CD2-CZ 3.62Å; F17-F48 HydrophobicContact CD2-CZ 3.62Å; F17-F48 AromaticContact CE2-CE1 3.74Å; F17-F48 HydrophobicContact CE2-CE1 3.74Å; F17-F48 AromaticContact CE2-CZ 3.6Å; F17-F48 HydrophobicContact CE2-CZ 3.6Å; F17-L50 HydrophobicContact CE2-CD1 4.07Å; F17-F53 HydrophobicContact CB-CE1 4.13Å; F17-F53 HydrophobicContact CB-CE2 4.4Å; F17-F53 HydrophobicContact CB-CZ 3.71Å; F17-F53 HydrophobicContact CD2-CD1 4.02Å; F17-F53 AromaticContact CD2-CE1 3.6Å; F17-F53 HydrophobicContact CD2-CE1 3.6Å; F17-F53 HydrophobicContact CD2-CZ 4.02Å; F17-F53 HydrophobicContact CG-CE1 4.31Å; F17-F53 HydrophobicContact CG-CZ 4.36Å
18C72.4Confident72.4Confident63 Ų6389.5 Ų89.543%0.42643%0.43SS..Hα-helixtrans-62.8-38-179.4-75.40000112K14 N15 R22K14-C18 VanDerWaalsContact O-CB 3.25Å; K14-C18 WeakPolarHBondContact O-CB 3.28Å; K14-C18 PolarHBondContact O-N 2.06Å; K14-C18 PolarHBondContact O-SG 3.12Å; N15-C18 PolarHBondContact O-N 3.44Å; C18-R22 VanDerWaalsContact O-CB 3.28Å; C18-R22 WeakPolarHBondContact O-CB 3.27Å; C18-R22 PolarHBondContact O-N 2.85Å
19Q78.1Confident73Confident111 Ų11189 Ų8952%0.51943%0.427SS..Hα-helixtrans-64.1-51.5176.7-179.1176.8-19.200111.1N15 D16 F17 L21 R22 E23N15-Q19 VanDerWaalsContact O-CB 3.31Å; N15-Q19 WeakPolarHBondContact O-CB 2.96Å; N15-Q19 PolarHBondContact O-N 3.46Å; D16-Q19 PolarHBondContact O-N 3.38Å; F17-Q19 VanDerWaalsContact C-N 3.3Å; F17-Q19 PolarHBondContact O-N 3.2Å; Q19-L21 VanDerWaalsContact C-N 3.34Å; Q19-L21 PolarHBondContact O-N 3.16Å; Q19-R22 WeakPolarHBondContact O-CB 3.09Å; Q19-R22 PolarHBondContact O-N 3.28Å; Q19-R22 VanDerWaalsContact O-N 3.16Å; Q19-E23 WeakPolarHBondContact CG-OE1 3.41Å; Q19-E23 PolarHBondContact NE2-OE1 3.28Å; Q19-E23 WeakPolarHBondContact O-CG 2.99Å; Q19-E23 PolarHBondContact O-N 3.01Å
20R75.3Confident73.5Confident110 Ų11088 Ų8842%0.41542%0.422SS..Hα-helixtrans-63.6-39.4-179.1-67.6175.3-174.8-78.5-6.3112.8D16 F17 R22 E23 T24 F48D16-R20 VanDerWaalsContact O-CG 3.29Å; D16-R20 WeakPolarHBondContact O-CG 3.43Å; D16-R20 PolarHBondContact O-N 2.95Å; D16-R20 IonicContact OD1-CZ 3.93Å; D16-R20 IonicContact OD1-NE 3.44Å; D16-R20 PolarHBondContact OD1-NE 2.77Å; D16-R20 IonicContact OD1-NH2 3.58Å; D16-R20 PolarHBondContact OD1-NH2 2.67Å; D16-R20 IonicContact OD2-CZ 3.8Å; D16-R20 IonicContact OD2-NE 3.33Å; D16-R20 PolarHBondContact OD2-NE 3.47Å; D16-R20 IonicContact OD2-NH2 3.47Å; D16-R20 PolarHBondContact OD2-NH2 2.79Å; F17-R20 PolarHBondContact O-N 3.43Å; R20-R22 VanDerWaalsContact C-N 3.34Å; R20-E23 PolarHBondContact O-N 2.91Å; R20-T24 WeakPolarHBondContact O-CB 3.2Å; R20-T24 PolarHBondContact O-N 2.84Å; R20-T24 PolarHBondContact O-OG1 3.06Å; R20-F48 HydrophobicContact CB-CB 4.48Å; R20-F48 HydrophobicContact CB-CD2 3.4Å; R20-F48 HydrophobicContact CB-CE2 3.75Å; R20-F48 HydrophobicContact CB-CG 4.14Å; R20-F48 HydrophobicContact CG-CD2 4.22Å; R20-F48 HydrophobicContact CG-CE2 4.44Å
21L74.5Confident73.8Confident68 Ų6888.6 Ų88.636%0.35642%0.418SS..Hα-helixtrans-62.7-43174.8-173.569.1000111.1F17 Q19 T24 L25 F48F17-L21 HydrophobicContact CE1-CD2 4.1Å; F17-L21 HydrophobicContact CZ-CD2 4.37Å; F17-L21 VanDerWaalsContact O-CB 3.31Å; F17-L21 WeakPolarHBondContact O-CB 3.16Å; F17-L21 PolarHBondContact O-N 2.95Å; Q19-L21 VanDerWaalsContact C-N 3.34Å; Q19-L21 PolarHBondContact O-N 3.16Å; L21-T24 PolarHBondContact O-N 3.44Å; L21-L25 HydrophobicContact CG-CD1 4.23Å; L21-L25 WeakPolarHBondContact O-CG 3.31Å; L21-L25 PolarHBondContact O-N 3.42Å; L21-F48 HydrophobicContact CD1-CD1 4.47Å
22R74.9Confident74.1Confident196 Ų19684.6 Ų84.674%0.7441%0.406SS*.Hα-helixtrans-63.1-45.5177.5-178.6-178-177.4174.41.7112C18 Q19 R20 T24 L25 K26C18-R22 VanDerWaalsContact O-CB 3.28Å; C18-R22 WeakPolarHBondContact O-CB 3.27Å; C18-R22 PolarHBondContact O-N 2.85Å; Q19-R22 WeakPolarHBondContact O-CB 3.09Å; Q19-R22 PolarHBondContact O-N 3.28Å; Q19-R22 VanDerWaalsContact O-N 3.16Å; R20-R22 VanDerWaalsContact C-N 3.34Å; R22-T24 PolarHBondContact O-N 3.44Å; R22-L25 PolarHBondContact O-N 2.89Å; R22-K26 WeakPolarHBondContact O-CB 3.5Å; R22-K26 PolarHBondContact O-N 3.3Å
23E77.9Confident74.3Confident106 Ų10685 Ų8550%0.49540%0.401SS..Hα-helixtrans-60.5-39.2177.6-73.4172-171.700111Q19 R20 K26 C27Q19-E23 WeakPolarHBondContact CG-OE1 3.41Å; Q19-E23 PolarHBondContact NE2-OE1 3.28Å; Q19-E23 WeakPolarHBondContact O-CG 2.99Å; Q19-E23 PolarHBondContact O-N 3.01Å; R20-E23 PolarHBondContact O-N 2.91Å; E23-K26 PolarHBondContact O-N 3.42Å; E23-C27 WeakPolarHBondContact O-CB 3.33Å; E23-C27 PolarHBondContact O-N 2.94Å
24T74.1Confident74.6Confident15 Ų1586.3 Ų86.39%0.09241%0.413CS..Hα-helixtrans-71-42.6178.3-61.30000113.1R20 L21 R22 K26 C27 Y28 I47 F48R20-T24 WeakPolarHBondContact O-CB 3.2Å; R20-T24 PolarHBondContact O-N 2.84Å; R20-T24 PolarHBondContact O-OG1 3.06Å; L21-T24 PolarHBondContact O-N 3.44Å; R22-T24 PolarHBondContact O-N 3.44Å; T24-K26 VanDerWaalsContact C-N 3.31Å; T24-K26 PolarHBondContact O-N 2.91Å; T24-C27 VanDerWaalsContact O-CB 3.32Å; T24-C27 WeakPolarHBondContact O-CB 3.39Å; T24-C27 PolarHBondContact O-N 3.01Å; T24-Y28 HydrophobicContact CG2-CD2 3.79Å; T24-Y28 HydrophobicContact CG2-CE2 3.5Å; T24-Y28 WeakPolarHBondContact O-CD2 3.31Å; T24-Y28 PolarHBondContact O-N 3.12Å; T24-I47 HydrophobicContact CG2-CB 4.39Å; T24-I47 HydrophobicContact CG2-CG2 3.62Å; T24-F48 HydrophobicContact CG2-CB 4.03Å; T24-F48 WeakPolarHBondContact OG1-CA 3.39Å; T24-F48 WeakPolarHBondContact OG1-CB 3.27Å; T24-F48 PolarHBondContact OG1-N 3.02Å
25L72.8Confident75.1Confident98 Ų9884.6 Ų84.651%0.51342%0.419SS..Hα-helixtrans-64-39.7174-75.4170.6000111.4L21 R22 C27 Y28 L29L21-L25 HydrophobicContact CG-CD1 4.23Å; L21-L25 WeakPolarHBondContact O-CG 3.31Å; L21-L25 PolarHBondContact O-N 3.42Å; R22-L25 PolarHBondContact O-N 2.89Å; L25-C27 VanDerWaalsContact C-N 3.34Å; L25-Y28 PolarHBondContact O-N 2.89Å; L25-L29 WeakPolarHBondContact O-CB 3.15Å; L25-L29 VanDerWaalsContact O-CG 3.26Å; L25-L29 WeakPolarHBondContact O-CG 3.42Å; L25-L29 PolarHBondContact O-N 3.32Å
26K76.1Confident75Confident129 Ų12988 Ų8856%0.56144%0.436SS*.Hα-helixtrans-61.2-46.1175.2-173.9-178.9175.7-171.10111R22 E23 T24 Y28 L29 D30R22-K26 WeakPolarHBondContact O-CB 3.5Å; R22-K26 PolarHBondContact O-N 3.3Å; E23-K26 PolarHBondContact O-N 3.42Å; T24-K26 VanDerWaalsContact C-N 3.31Å; T24-K26 PolarHBondContact O-N 2.91Å; K26-Y28 PolarHBondContact O-N 3.32Å; K26-L29 PolarHBondContact O-N 3.28Å; K26-D30 WeakPolarHBondContact O-CB 3.48Å; K26-D30 VanDerWaalsContact O-CG 3.25Å; K26-D30 PolarHBondContact O-N 3.49Å
27C75.5Confident74.5Confident10 Ų1088.7 Ų88.77%0.06846%0.457CS..Hα-helixtrans-55-49.8174.7177.10000111.9E23 T24 L25 L29 D30 E31 C43E23-C27 WeakPolarHBondContact O-CB 3.33Å; E23-C27 PolarHBondContact O-N 2.94Å; T24-C27 VanDerWaalsContact O-CB 3.32Å; T24-C27 WeakPolarHBondContact O-CB 3.39Å; T24-C27 PolarHBondContact O-N 3.01Å; L25-C27 VanDerWaalsContact C-N 3.34Å; C27-L29 PolarHBondContact O-N 3.44Å; C27-D30 PolarHBondContact O-N 3.44Å; C27-E31 PolarHBondContact O-N 3.13Å; C27-C43 HydrophobicContact CB-CB 4.04Å; C27-C43 WeakPolarHBondContact CB-SG 3.44Å; C27-C43 WeakPolarHBondContact SG-CB 3.43Å; C27-C43 CovalentContact SG-SG 2Å; C27-C43 PolarHBondContact SG-SG 3.19Å
28Y71.7Confident74.3Confident115 Ų11586.2 Ų86.245%0.45145%0.451SS..Hα-helixtrans-62.5-39.7175.3-78.2-58.9000113.4T24 L25 K26 E31 I32 I47T24-Y28 HydrophobicContact CG2-CD2 3.79Å; T24-Y28 HydrophobicContact CG2-CE2 3.5Å; T24-Y28 WeakPolarHBondContact O-CD2 3.31Å; T24-Y28 PolarHBondContact O-N 3.12Å; L25-Y28 PolarHBondContact O-N 2.89Å; K26-Y28 PolarHBondContact O-N 3.32Å; Y28-E31 PolarHBondContact O-N 3.37Å; Y28-I32 WeakPolarHBondContact O-CG1 3.28Å; Y28-I32 PolarHBondContact O-N 2.89Å; Y28-I47 HydrophobicContact CE1-CD1 3.96Å; Y28-I47 HydrophobicContact CE2-CG2 3.83Å; Y28-I47 WeakPolarHBondContact OH-CG2 3.17Å
29L71.9Confident74.6Confident104 Ų10488.3 Ų88.355%0.54545%0.454SS..Hα-helixtrans-67.5-37.3177.6-73.3169.3000112.1L25 K26 C27 E31 I32L25-L29 WeakPolarHBondContact O-CB 3.15Å; L25-L29 VanDerWaalsContact O-CG 3.26Å; L25-L29 WeakPolarHBondContact O-CG 3.42Å; L25-L29 PolarHBondContact O-N 3.32Å; K26-L29 PolarHBondContact O-N 3.28Å; C27-L29 PolarHBondContact O-N 3.44Å; L29-E31 VanDerWaalsContact C-N 3.31Å; L29-I32 HydrophobicContact CD2-CD1 3.92Å; L29-I32 PolarHBondContact O-N 2.92Å
30D74.4Confident74.1Confident34 Ų3485.1 Ų85.118%0.18245%0.451CS..Hα-helixtrans-69.8-30.6178.1-69.9-20.5000111.1K26 C27 Q39 G40 H41K26-D30 WeakPolarHBondContact O-CB 3.48Å; K26-D30 VanDerWaalsContact O-CG 3.25Å; K26-D30 PolarHBondContact O-N 3.49Å; C27-D30 PolarHBondContact O-N 3.44Å; D30-Q39 HydrophobicContact CB-CB 4.5Å; D30-Q39 CarbonylContact O-C 3.4Å; D30-Q39 PolarHBondContact O-N 3.12Å; D30-Q39 VanDerWaalsContact OD1-CD 3.23Å; D30-Q39 PolarHBondContact OD1-NE2 2.92Å; D30-Q39 PolarHBondContact OD1-OE1 3.27Å; D30-G40 PolarHBondContact O-N 3.03Å; D30-H41 HydrophobicContact CB-CB 4.44Å; D30-H41 PolarHBondContact O-N 3.4Å
31E74.6Confident74.1Confident80 Ų8085.4 Ų85.437%0.37446%0.457SS..Hα-helixtrans-74.1-18.3174.9-80.7-172.617100114.8C27 Y28 L29 D33 H41 C43C27-E31 PolarHBondContact O-N 3.13Å; Y28-E31 PolarHBondContact O-N 3.37Å; L29-E31 VanDerWaalsContact C-N 3.31Å; E31-D33 PolarHBondContact O-N 3.49Å; E31-H41 WeakPolarHBondContact CA-O 3.33Å; E31-H41 WeakPolarHBondContact CG-O 3.41Å; E31-C43 HydrophobicContact CG-CB 3.97Å; E31-C43 VanDerWaalsContact OE1-CB 3.25Å; E31-C43 WeakPolarHBondContact OE1-CB 3.39Å; E31-C43 PolarHBondContact OE1-N 2.9Å
32I72.5Confident73.7Confident66 Ų6686.2 Ų86.234%0.33847%0.473SS..SBendtrans-57.4139.3179.3-69.5173000109.6Y28 L29 L36 G38 Q39 G40Y28-I32 WeakPolarHBondContact O-CG1 3.28Å; Y28-I32 PolarHBondContact O-N 2.89Å; L29-I32 HydrophobicContact CD2-CD1 3.92Å; L29-I32 PolarHBondContact O-N 2.92Å; I32-L36 HydrophobicContact CG2-CB 3.77Å; I32-G38 CarbonylContact O-C 3.35Å; I32-G38 WeakPolarHBondContact O-CA 3.28Å; I32-Q39 PolarHBondContact O-N 3.32Å; I32-G40 PolarHBondContact O-N 3.39Å
33D74Confident73.3Confident87 Ų8779 Ų7947%0.46545%0.453SS..  trans-53.3133177.7-171.1-69.3000110.7E31 S35 L36 G37 G38E31-D33 PolarHBondContact O-N 3.49Å; D33-S35 PolarHBondContact O-N 3.17Å; D33-S35 VanDerWaalsContact O-N 3.11Å; D33-S35 WeakPolarHBondContact OD1-CA 3.35Å; D33-S35 WeakPolarHBondContact OD1-CB 3.24Å; D33-S35 PolarHBondContact OD1-N 2.95Å; D33-S35 PolarHBondContact OD1-OG 2.87Å; D33-L36 WeakPolarHBondContact O-CA 3.32Å; D33-L36 PolarHBondContact O-N 2.76Å; D33-G37 PolarHBondContact O-N 3.45Å; D33-G38 PolarHBondContact O-N 2.87Å
34P76.3Confident72.6Confident83 Ų8381 Ų8154%0.53947%0.472SS..G310 helixtrans-55.9-28.5179-26.634.8000114.4L36 G37 G38P34-L36 PolarHBondContact O-N 2.89Å; P34-G37 PolarHBondContact O-N 3.28Å; P34-G38 WeakPolarHBondContact CA-O 3.43Å
35S81.5Confident71.9Confident102 Ų10282.4 Ų82.471%0.71349%0.49SS*.G310 helixtrans-67.1-23.117569.50000113.6D33D33-S35 PolarHBondContact O-N 3.17Å; D33-S35 VanDerWaalsContact O-N 3.11Å; D33-S35 WeakPolarHBondContact OD1-CA 3.35Å; D33-S35 WeakPolarHBondContact OD1-CB 3.24Å; D33-S35 PolarHBondContact OD1-N 2.95Å; D33-S35 PolarHBondContact OD1-OG 2.87Å
36L75.3Confident71.2Confident144 Ų14483.7 Ų83.775%0.75450%0.501SS*.G310 helixtrans-955172.8-61.2177.4000112.4I32 D33 P34I32-L36 HydrophobicContact CG2-CB 3.77Å; D33-L36 WeakPolarHBondContact O-CA 3.32Å; D33-L36 PolarHBondContact O-N 2.76Å; P34-L36 PolarHBondContact O-N 2.89Å
37G66.8Low70.6Confident72 Ų7280.7 Ų80.774%0.74249%0.49SS*.THydrogen-bonded Turntrans89.812.2-179.800000115.2D33 P34D33-G37 PolarHBondContact O-N 3.45Å; P34-G37 PolarHBondContact O-N 3.28Å
38G70.8Confident70.2Confident17 Ų1781.7 Ų81.718%0.17549%0.494CS..  trans-83.4-174.3170.700000113.3I32 D33 P34I32-G38 CarbonylContact O-C 3.35Å; I32-G38 WeakPolarHBondContact O-CA 3.28Å; D33-G38 PolarHBondContact O-N 2.87Å; P34-G38 WeakPolarHBondContact CA-O 3.43Å
39Q77Confident70.1Confident108 Ų10879.3 Ų79.351%0.50549%0.489SS..  trans-98.6-12178.6-57.5-171.96.700113.5D30 I32 H41D30-Q39 HydrophobicContact CB-CB 4.5Å; D30-Q39 CarbonylContact O-C 3.4Å; D30-Q39 PolarHBondContact O-N 3.12Å; D30-Q39 VanDerWaalsContact OD1-CD 3.23Å; D30-Q39 PolarHBondContact OD1-NE2 2.92Å; D30-Q39 PolarHBondContact OD1-OE1 3.27Å; I32-Q39 PolarHBondContact O-N 3.32Å; Q39-H41 WeakPolarHBondContact CB-ND1 3.49Å; Q39-H41 PolarHBondContact O-N 3.48Å; Q39-H41 PolarHBondContact OE1-CE1 3.34Å; Q39-H41 PolarHBondContact OE1-ND1 2.94Å
40G68.4Low70Confident43 Ų4378.6 Ų78.644%0.44349%0.485SS..  trans61.520.5-175.300000114.2D30 I32D30-G40 PolarHBondContact O-N 3.03Å; I32-G40 PolarHBondContact O-N 3.39Å
41H74.9Confident70Confident116 Ų11683.4 Ų83.454%0.53751%0.507SS..  trans-86.4121.8179.6-70.5134000109.8D30 E31 Q39 C43D30-H41 HydrophobicContact CB-CB 4.44Å; D30-H41 PolarHBondContact O-N 3.4Å; E31-H41 WeakPolarHBondContact CA-O 3.33Å; E31-H41 WeakPolarHBondContact CG-O 3.41Å; Q39-H41 WeakPolarHBondContact CB-ND1 3.49Å; Q39-H41 PolarHBondContact O-N 3.48Å; Q39-H41 PolarHBondContact OE1-CE1 3.34Å; Q39-H41 PolarHBondContact OE1-ND1 2.94Å; H41-C43 PolarHBondContact O-N 3.15Å
42A67.1Low70.1Confident86 Ų8685.1 Ų85.171%0.71152%0.515SS*.  trans-63.2122.4170.100000109.4T44A42-T44 PolarHBondContact O-N 2.73Å
43C65.9Low70.2Confident45 Ų4583.2 Ų83.230%0.30450%0.504SS..  trans-83.7114.7178.9-165.70000108.9C27 E31 H41 G45C27-C43 HydrophobicContact CB-CB 4.04Å; C27-C43 WeakPolarHBondContact CB-SG 3.44Å; C27-C43 WeakPolarHBondContact SG-CB 3.43Å; C27-C43 CovalentContact SG-SG 2Å; C27-C43 PolarHBondContact SG-SG 3.19Å; E31-C43 HydrophobicContact CG-CB 3.97Å; E31-C43 VanDerWaalsContact OE1-CB 3.25Å; E31-C43 WeakPolarHBondContact OE1-CB 3.39Å; E31-C43 PolarHBondContact OE1-N 2.9Å; H41-C43 PolarHBondContact O-N 3.15Å; C43-G45 VanDerWaalsContact C-N 3.27Å
44T63.9Low70.2Confident148 Ų14882.5 Ų82.591%0.90850%0.499SS*.  trans-84.8-4.3-179.651.50000113A42A42-T44 PolarHBondContact O-N 2.73Å
45G58.8Low70.2Confident44 Ų4483 Ų8345%0.45450%0.497SS..SBendtrans-86.1150-17900000112.7C43 I47C43-G45 VanDerWaalsContact C-N 3.27Å; G45-I47 PolarHBondContact O-N 3.33Å
46V57.7Low69.9Low124 Ų12481 Ų8175%0.75248%0.483SS*.  trans-61111.2171.5177.10000108.8F48V46-F48 PolarHBondContact O-N 3.24Å
47I63.5Low69.9Low66 Ų6677.2 Ų77.234%0.33846%0.46SS..  trans-49128.9164.1-65.8169000107.3T24 Y28 G45 N49T24-I47 HydrophobicContact CG2-CB 4.39Å; T24-I47 HydrophobicContact CG2-CG2 3.62Å; Y28-I47 HydrophobicContact CE1-CD1 3.96Å; Y28-I47 HydrophobicContact CE2-CG2 3.83Å; Y28-I47 WeakPolarHBondContact OH-CG2 3.17Å; G45-I47 PolarHBondContact O-N 3.33Å; I47-N49 PolarHBondContact O-N 3.43Å
48F66.2Low70.4Confident32 Ų3281 Ų8114%0.1445%0.453CS..  trans-46.7105.3179.9170.2-111.8000110.8F17 R20 L21 T24 V46 L50 F53F17-F48 HydrophobicContact CD2-CE1 4.21Å; F17-F48 HydrophobicContact CD2-CE2 4.5Å; F17-F48 AromaticContact CD2-CZ 3.62Å; F17-F48 HydrophobicContact CD2-CZ 3.62Å; F17-F48 AromaticContact CE2-CE1 3.74Å; F17-F48 HydrophobicContact CE2-CE1 3.74Å; F17-F48 AromaticContact CE2-CZ 3.6Å; F17-F48 HydrophobicContact CE2-CZ 3.6Å; R20-F48 HydrophobicContact CB-CB 4.48Å; R20-F48 HydrophobicContact CB-CD2 3.4Å; R20-F48 HydrophobicContact CB-CE2 3.75Å; R20-F48 HydrophobicContact CB-CG 4.14Å; R20-F48 HydrophobicContact CG-CD2 4.22Å; R20-F48 HydrophobicContact CG-CE2 4.44Å; L21-F48 HydrophobicContact CD1-CD1 4.47Å; T24-F48 HydrophobicContact CG2-CB 4.03Å; T24-F48 WeakPolarHBondContact OG1-CA 3.39Å; T24-F48 WeakPolarHBondContact OG1-CB 3.27Å; T24-F48 PolarHBondContact OG1-N 3.02Å; V46-F48 PolarHBondContact O-N 3.24Å; F48-L50 HydrophobicContact CD1-CB 4.49Å; F48-L50 HydrophobicContact CE1-CB 4.03Å; F48-L50 HydrophobicContact CE1-CD1 3.73Å; F48-L50 HydrophobicContact CE1-CG 4.49Å; F48-L50 HydrophobicContact CZ-CD1 3.94Å; F48-L50 PolarHBondContact O-N 3.02Å; F48-F53 HydrophobicContact CD2-CB 4.41Å; F48-F53 HydrophobicContact CE2-CB 3.45Å; F48-F53 VanDerWaalsContact CE2-CB 3.45Å; F48-F53 HydrophobicContact CE2-CD1 4.17Å; F48-F53 AromaticContact CE2-CD2 3.76Å; F48-F53 HydrophobicContact CE2-CD2 3.76Å; F48-F53 AromaticContact CE2-CG 3.51Å; F48-F53 HydrophobicContact CE2-CG 3.51Å; F48-F53 HydrophobicContact CZ-CB 3.74Å; F48-F53 AromaticContact CZ-CD1 3.88Å; F48-F53 HydrophobicContact CZ-CD1 3.88Å; F48-F53 HydrophobicContact CZ-CD2 4.28Å; F48-F53 AromaticContact CZ-CG 3.68Å; F48-F53 HydrophobicContact CZ-CG 3.68Å
49N71Confident70.7Confident65 Ų6585 Ų8535%0.34847%0.47SS..  trans-82.899.6175.6-175.3-30.9000107.3I47 E51 Q52 F53I47-N49 PolarHBondContact O-N 3.43Å; N49-E51 PolarHBondContact O-N 3.44Å; N49-E51 VanDerWaalsContact OD1-CB 3.26Å; N49-E51 WeakPolarHBondContact OD1-CB 3.26Å; N49-E51 PolarHBondContact OD1-N 2.8Å; N49-Q52 HydrophobicContact CB-CB 4.12Å; N49-Q52 HydrophobicContact CB-CG 4.22Å; N49-Q52 PolarHBondContact O-N 3.31Å; N49-Q52 PolarHBondContact OD1-N 3.08Å; N49-Q52 VanDerWaalsContact OD1-N 3.15Å; N49-F53 PolarHBondContact O-N 3.2Å
50L69.1Low70.7Confident88 Ų8883.9 Ų83.946%0.46147%0.467SS..Hα-helixtrans-55.9-35.9-179.6178.562.1000111.9F17 F48 F53 I54F17-L50 HydrophobicContact CE2-CD1 4.07Å; F48-L50 HydrophobicContact CD1-CB 4.49Å; F48-L50 HydrophobicContact CE1-CB 4.03Å; F48-L50 HydrophobicContact CE1-CD1 3.73Å; F48-L50 HydrophobicContact CE1-CG 4.49Å; F48-L50 HydrophobicContact CZ-CD1 3.94Å; F48-L50 PolarHBondContact O-N 3.02Å; L50-F53 PolarHBondContact O-N 2.76Å; L50-I54 HydrophobicContact CD1-CD1 3.95Å; L50-I54 HydrophobicContact CD1-CG1 4.19Å; L50-I54 HydrophobicContact CG-CD1 3.83Å; L50-I54 HydrophobicContact CG-CG1 4.46Å; L50-I54 WeakPolarHBondContact O-CB 3.3Å; L50-I54 VanDerWaalsContact O-CG1 3.24Å; L50-I54 WeakPolarHBondContact O-CG1 3.42Å; L50-I54 PolarHBondContact O-N 3.1Å
51E75Confident71.1Confident136 Ų13683 Ų8364%0.63645%0.452SS*.Hα-helixtrans-63.9-50.9177.5-175.4-172.9164.500111.1N49 F53 I54 L55N49-E51 PolarHBondContact O-N 3.44Å; N49-E51 VanDerWaalsContact OD1-CB 3.26Å; N49-E51 WeakPolarHBondContact OD1-CB 3.26Å; N49-E51 PolarHBondContact OD1-N 2.8Å; E51-F53 VanDerWaalsContact C-N 3.27Å; E51-F53 PolarHBondContact O-N 2.87Å; E51-I54 PolarHBondContact O-N 2.94Å; E51-I54 VanDerWaalsContact O-N 3.17Å; E51-L55 HydrophobicContact CG-CD1 4.27Å; E51-L55 WeakPolarHBondContact O-CG 3.11Å; E51-L55 PolarHBondContact O-N 2.95Å
52Q76.5Confident71.2Confident116 Ų11685.5 Ų85.554%0.54246%0.458SS..Hα-helixtrans-60.2-39.1177.3-75.8-175-18.500112N49 L55 S56N49-Q52 HydrophobicContact CB-CB 4.12Å; N49-Q52 HydrophobicContact CB-CG 4.22Å; N49-Q52 PolarHBondContact O-N 3.31Å; N49-Q52 PolarHBondContact OD1-N 3.08Å; N49-Q52 VanDerWaalsContact OD1-N 3.15Å; Q52-L55 PolarHBondContact O-N 3.34Å; Q52-S56 VanDerWaalsContact O-CB 3.31Å; Q52-S56 WeakPolarHBondContact O-CB 3.24Å; Q52-S56 PolarHBondContact O-N 3.47Å; Q52-S56 PolarHBondContact O-OG 3.36Å
53F75.2Confident71.6Confident25 Ų2587.7 Ų87.711%0.1145%0.454CS..Hα-helixtrans-62.7-45.9175.5177.5-96.7000112L13 D16 F17 F48 N49 L50 E51 S56 F57L13-F53 HydrophobicContact CD1-CE1 4.36Å; L13-F53 HydrophobicContact CD1-CZ 3.77Å; L13-F53 HydrophobicContact CG-CZ 4.18Å; D16-F53 WeakPolarHBondContact OD2-CE2 3.49Å; F17-F53 HydrophobicContact CB-CE1 4.13Å; F17-F53 HydrophobicContact CB-CE2 4.4Å; F17-F53 HydrophobicContact CB-CZ 3.71Å; F17-F53 HydrophobicContact CD2-CD1 4.02Å; F17-F53 AromaticContact CD2-CE1 3.6Å; F17-F53 HydrophobicContact CD2-CE1 3.6Å; F17-F53 HydrophobicContact CD2-CZ 4.02Å; F17-F53 HydrophobicContact CG-CE1 4.31Å; F17-F53 HydrophobicContact CG-CZ 4.36Å; F48-F53 HydrophobicContact CD2-CB 4.41Å; F48-F53 HydrophobicContact CE2-CB 3.45Å; F48-F53 VanDerWaalsContact CE2-CB 3.45Å; F48-F53 HydrophobicContact CE2-CD1 4.17Å; F48-F53 AromaticContact CE2-CD2 3.76Å; F48-F53 HydrophobicContact CE2-CD2 3.76Å; F48-F53 AromaticContact CE2-CG 3.51Å; F48-F53 HydrophobicContact CE2-CG 3.51Å; F48-F53 HydrophobicContact CZ-CB 3.74Å; F48-F53 AromaticContact CZ-CD1 3.88Å; F48-F53 HydrophobicContact CZ-CD1 3.88Å; F48-F53 HydrophobicContact CZ-CD2 4.28Å; F48-F53 AromaticContact CZ-CG 3.68Å; F48-F53 HydrophobicContact CZ-CG 3.68Å; N49-F53 PolarHBondContact O-N 3.2Å; L50-F53 PolarHBondContact O-N 2.76Å; E51-F53 VanDerWaalsContact C-N 3.27Å; E51-F53 PolarHBondContact O-N 2.87Å; F53-S56 PolarHBondContact O-N 3.33Å; F53-F57 WeakPolarHBondContact O-CB 3.31Å; F53-F57 PolarHBondContact O-N 3.41Å
54I72.5Confident72.1Confident73 Ų7390.5 Ų90.537%0.37446%0.462SS..Hα-helixtrans-63.2-43.3178.2-70.8167.3000111L50 E51 F57 W58L50-I54 HydrophobicContact CD1-CD1 3.95Å; L50-I54 HydrophobicContact CD1-CG1 4.19Å; L50-I54 HydrophobicContact CG-CD1 3.83Å; L50-I54 HydrophobicContact CG-CG1 4.46Å; L50-I54 WeakPolarHBondContact O-CB 3.3Å; L50-I54 VanDerWaalsContact O-CG1 3.24Å; L50-I54 WeakPolarHBondContact O-CG1 3.42Å; L50-I54 PolarHBondContact O-N 3.1Å; E51-I54 PolarHBondContact O-N 2.94Å; E51-I54 VanDerWaalsContact O-N 3.17Å; I54-F57 WeakPolarHBondContact O-CB 3.25Å; I54-F57 PolarHBondContact O-N 3.26Å; I54-W58 PolarHBondContact O-N 2.93Å
55L77.2Confident72.7Confident94 Ų9486.6 Ų86.649%0.49244%0.435SS..Hα-helixtrans-61.5-49.2176.5-70.4173.7000111.1E51 Q52 F57 W58 D59E51-L55 HydrophobicContact CG-CD1 4.27Å; E51-L55 WeakPolarHBondContact O-CG 3.11Å; E51-L55 PolarHBondContact O-N 2.95Å; Q52-L55 PolarHBondContact O-N 3.34Å; L55-F57 PolarHBondContact O-N 2.82Å; L55-W58 PolarHBondContact O-N 3.42Å; L55-W58 VanDerWaalsContact O-N 3.12Å; L55-D59 PolarHBondContact O-N 3.37Å
56S75.5Confident73.6Confident60 Ų6086.4 Ų86.442%0.4243%0.429SS..Hα-helixtrans-59.9-37.2177.8-57.80000111.6Q52 F53 N60Q52-S56 VanDerWaalsContact O-CB 3.31Å; Q52-S56 WeakPolarHBondContact O-CB 3.24Å; Q52-S56 PolarHBondContact O-N 3.47Å; Q52-S56 PolarHBondContact O-OG 3.36Å; F53-S56 PolarHBondContact O-N 3.33Å; S56-N60 WeakPolarHBondContact O-CB 2.86Å; S56-N60 PolarHBondContact O-N 3.45Å; S56-N60 PolarHBondContact O-ND2 2.93Å
57F76Confident74.4Confident63 Ų6382 Ų8228%0.27641%0.41SS..Hα-helixtrans-62.2-49.7174.6168.2-110.3000112.1L13 F53 I54 L55 D59 N60 L61L13-F57 HydrophobicContact CD1-CB 4.23Å; L13-F57 HydrophobicContact CD1-CD2 3.12Å; L13-F57 HydrophobicContact CD1-CE2 3.59Å; L13-F57 HydrophobicContact CD1-CG 3.9Å; L13-F57 HydrophobicContact CD2-CD2 3.97Å; L13-F57 HydrophobicContact CD2-CE2 3.66Å; L13-F57 HydrophobicContact CD2-CZ 4.15Å; L13-F57 HydrophobicContact CG-CD2 4.14Å; L13-F57 HydrophobicContact CG-CE2 4.18Å; F53-F57 WeakPolarHBondContact O-CB 3.31Å; F53-F57 PolarHBondContact O-N 3.41Å; I54-F57 WeakPolarHBondContact O-CB 3.25Å; I54-F57 PolarHBondContact O-N 3.26Å; L55-F57 PolarHBondContact O-N 2.82Å; F57-D59 VanDerWaalsContact C-N 3.34Å; F57-D59 PolarHBondContact O-N 2.97Å; F57-N60 PolarHBondContact O-N 3.4Å; F57-L61 HydrophobicContact CE1-CD2 4.26Å; F57-L61 HydrophobicContact CZ-CD2 4.01Å; F57-L61 WeakPolarHBondContact O-CB 3.29Å; F57-L61 PolarHBondContact O-N 2.85Å
58W76Confident74.9Confident153 Ų15381.3 Ų81.358%0.5841%0.408SS*.Hα-helixtrans-63.7-40.4-179.8-80.4114.7000112.2I54 L55 L61 Y62I54-W58 PolarHBondContact O-N 2.93Å; L55-W58 PolarHBondContact O-N 3.42Å; L55-W58 VanDerWaalsContact O-N 3.12Å; W58-L61 HydrophobicContact CE3-CD2 4.05Å; W58-L61 HydrophobicContact CZ3-CD2 3.86Å; W58-L61 PolarHBondContact O-N 3.34Å; W58-Y62 WeakPolarHBondContact O-CB 3.31Å; W58-Y62 PolarHBondContact O-N 2.9Å
59D78.4Confident75.3Confident100 Ų10087.2 Ų87.254%0.53543%0.43SS..Hα-helixtrans-61.8-49.7176.7-71-21000111.1L55 F57 L61 Y62 E63L55-D59 PolarHBondContact O-N 3.37Å; F57-D59 VanDerWaalsContact C-N 3.34Å; F57-D59 PolarHBondContact O-N 2.97Å; D59-L61 PolarHBondContact O-N 3.06Å; D59-Y62 PolarHBondContact O-N 3.04Å; D59-E63 WeakPolarHBondContact O-CG 3.28Å; D59-E63 PolarHBondContact O-N 3.02Å
60N76Confident75.4Confident85 Ų8590.6 Ų90.646%0.45544%0.442SS..Hα-helixtrans-62.2-43.3178-80.9-71.7000112.3S56 F57 Y62 E63 H64S56-N60 WeakPolarHBondContact O-CB 2.86Å; S56-N60 PolarHBondContact O-N 3.45Å; S56-N60 PolarHBondContact O-ND2 2.93Å; F57-N60 PolarHBondContact O-N 3.4Å; N60-Y62 VanDerWaalsContact C-N 3.35Å; N60-E63 PolarHBondContact O-N 3.45Å; N60-H64 WeakPolarHBondContact O-CB 3.41Å; N60-H64 PolarHBondContact O-CD2 3.37Å; N60-H64 PolarHBondContact O-N 2.9Å
61L76.8Confident75.5Confident25 Ų2587.7 Ų87.713%0.13143%0.428CS..Hα-helixtrans-63.2-44.4177.7178.563.1000110.9L9 F57 W58 D59 H64 L65L9-L61 HydrophobicContact CD1-CD1 4.1Å; F57-L61 HydrophobicContact CE1-CD2 4.26Å; F57-L61 HydrophobicContact CZ-CD2 4.01Å; F57-L61 WeakPolarHBondContact O-CB 3.29Å; F57-L61 PolarHBondContact O-N 2.85Å; W58-L61 HydrophobicContact CE3-CD2 4.05Å; W58-L61 HydrophobicContact CZ3-CD2 3.86Å; W58-L61 PolarHBondContact O-N 3.34Å; D59-L61 PolarHBondContact O-N 3.06Å; L61-H64 PolarHBondContact O-N 3.4Å; L61-L65 HydrophobicContact CD1-CD1 3.88Å; L61-L65 HydrophobicContact CD1-CG 4.06Å; L61-L65 HydrophobicContact CD2-CD1 4.5Å; L61-L65 HydrophobicContact CG-CD1 3.85Å; L61-L65 HydrophobicContact CG-CG 4.4Å; L61-L65 WeakPolarHBondContact O-CB 3.19Å; L61-L65 VanDerWaalsContact O-CG 3.31Å; L61-L65 WeakPolarHBondContact O-CG 3.17Å; L61-L65 PolarHBondContact O-N 2.9Å
62Y76.3Confident75.3Confident168 Ų16885.1 Ų85.166%0.65942%0.418SS*.Hα-helixtrans-60.3-48177.2175.1-98.8000111.1W58 D59 N60 H64 L65 A66W58-Y62 WeakPolarHBondContact O-CB 3.31Å; W58-Y62 PolarHBondContact O-N 2.9Å; D59-Y62 PolarHBondContact O-N 3.04Å; N60-Y62 VanDerWaalsContact C-N 3.35Å; Y62-H64 PolarHBondContact O-N 3.41Å; Y62-L65 PolarHBondContact O-N 3.33Å; Y62-A66 WeakPolarHBondContact O-CB 3.42Å; Y62-A66 PolarHBondContact O-N 3.41Å
63E76.3Confident75.1Confident131 Ų13183.9 Ų83.961%0.61242%0.415SS*.Hα-helixtrans-60-45.9178.1-75.1-170.6170.200112.2D59 N60 A66 G67D59-E63 WeakPolarHBondContact O-CG 3.28Å; D59-E63 PolarHBondContact O-N 3.02Å; N60-E63 PolarHBondContact O-N 3.45Å; E63-A66 PolarHBondContact O-N 2.94Å; E63-G67 PolarHBondContact O-N 2.97Å
64H76.5Confident75.2Confident105 Ų10583.9 Ų83.949%0.48642%0.415SS..Hα-helixtrans-66.3-41.7178.9-78.5-56.1000112.8N60 L61 Y62 T68N60-H64 WeakPolarHBondContact O-CB 3.41Å; N60-H64 PolarHBondContact O-CD2 3.37Å; N60-H64 PolarHBondContact O-N 2.9Å; L61-H64 PolarHBondContact O-N 3.4Å; Y62-H64 PolarHBondContact O-N 3.41Å; H64-T68 WeakPolarHBondContact O-CB 3.31Å; H64-T68 PolarHBondContact O-N 3.07Å; H64-T68 PolarHBondContact O-OG1 2.94Å
65L77.1Confident75.3Confident65 Ų6583.1 Ų83.134%0.3441%0.414SS..Hα-helixtrans-66.2-46.7175.7-75.3174000110.9L61 Y62 G67 T68 W69L61-L65 HydrophobicContact CD1-CD1 3.88Å; L61-L65 HydrophobicContact CD1-CG 4.06Å; L61-L65 HydrophobicContact CD2-CD1 4.5Å; L61-L65 HydrophobicContact CG-CD1 3.85Å; L61-L65 HydrophobicContact CG-CG 4.4Å; L61-L65 WeakPolarHBondContact O-CB 3.19Å; L61-L65 VanDerWaalsContact O-CG 3.31Å; L61-L65 WeakPolarHBondContact O-CG 3.17Å; L61-L65 PolarHBondContact O-N 2.9Å; Y62-L65 PolarHBondContact O-N 3.33Å; L65-G67 VanDerWaalsContact C-N 3.32Å; L65-G67 PolarHBondContact O-N 3.16Å; L65-T68 PolarHBondContact O-N 2Å; L65-W69 WeakPolarHBondContact O-CB 3.4Å; L65-W69 PolarHBondContact O-N 3.38Å
66A76.9Confident75.1Confident40 Ų4081.8 Ų81.833%0.33141%0.407SS..Hα-helixtrans-60.3-43.1177.900000111.2Y62 E63 W69 K70Y62-A66 WeakPolarHBondContact O-CB 3.42Å; Y62-A66 PolarHBondContact O-N 3.41Å; E63-A66 PolarHBondContact O-N 2.94Å; A66-W69 PolarHBondContact O-N 3.48Å; A66-K70 WeakPolarHBondContact O-CB 3.45Å; A66-K70 PolarHBondContact O-N 3.44Å
67G74.9Confident75.1Confident33 Ų3382.5 Ų82.534%0.3441%0.41SS..Hα-helixtrans-61-45.5173.800000112.5E63 L65 K70 C71E63-G67 PolarHBondContact O-N 2.97Å; L65-G67 VanDerWaalsContact C-N 3.32Å; L65-G67 PolarHBondContact O-N 3.16Å; G67-K70 PolarHBondContact O-N 3.33Å; G67-C71 PolarHBondContact O-N 3.49Å; G67-C71 PolarHBondContact O-SG 3.37Å
68T73.6Confident75.2Confident50 Ų5084.9 Ų84.931%0.30742%0.422SS..Hα-helixtrans-61.4-48.9177.1-58.20000111.3H64 L65 C71 L72H64-T68 WeakPolarHBondContact O-CB 3.31Å; H64-T68 PolarHBondContact O-N 3.07Å; H64-T68 PolarHBondContact O-OG1 2.94Å; L65-T68 PolarHBondContact O-N 2Å; T68-C71 PolarHBondContact O-N 3.43Å; T68-L72 HydrophobicContact CG2-CD1 4.22Å; T68-L72 WeakPolarHBondContact O-CG 3.33Å; T68-L72 PolarHBondContact O-N 2.92Å
69W73.8Confident75.3Confident156 Ų15684 Ų8459%0.59143%0.429SS*.Hα-helixtrans-63-42.6177.5-80.5116.4000112L65 A66 C71 L72 L73L65-W69 WeakPolarHBondContact O-CB 3.4Å; L65-W69 PolarHBondContact O-N 3.38Å; A66-W69 PolarHBondContact O-N 3.48Å; W69-C71 VanDerWaalsContact C-N 3.3Å; W69-C71 PolarHBondContact O-N 3.19Å; W69-L72 HydrophobicContact CE3-CD1 4.06Å; W69-L72 HydrophobicContact CZ3-CD1 4.23Å; W69-L72 CarbonylContact O-C 3.6Å; W69-L72 PolarHBondContact O-N 3.3Å; W69-L72 VanDerWaalsContact O-N 3.14Å; W69-L73 WeakPolarHBondContact O-CB 3.45Å; W69-L73 VanDerWaalsContact O-CG 3.26Å; W69-L73 WeakPolarHBondContact O-CG 3.25Å; W69-L73 PolarHBondContact O-N 2.86Å
70K73.1Confident75.3Confident137 Ų13784.9 Ų84.960%0.59643%0.433SS*.Hα-helixtrans-56.8-46.7174.6-176179.1-179.4-179.20110.8A66 G67 L72 L73 Q74A66-K70 WeakPolarHBondContact O-CB 3.45Å; A66-K70 PolarHBondContact O-N 3.44Å; G67-K70 PolarHBondContact O-N 3.33Å; K70-L72 PolarHBondContact O-N 2.91Å; K70-L73 PolarHBondContact O-N 2.97Å; K70-Q74 VanDerWaalsContact O-CG 3.28Å; K70-Q74 WeakPolarHBondContact O-CG 2.81Å; K70-Q74 PolarHBondContact O-N 3.26Å
71C71.2Confident75.1Confident27 Ų2783.7 Ų83.718%0.18244%0.441CS..Hα-helixtrans-64.2-37.3176.5-73.30000113.1G67 T68 W69 C87 Y88G67-C71 PolarHBondContact O-N 3.49Å; G67-C71 PolarHBondContact O-SG 3.37Å; T68-C71 PolarHBondContact O-N 3.43Å; W69-C71 VanDerWaalsContact C-N 3.3Å; W69-C71 PolarHBondContact O-N 3.19Å; C71-C87 WeakPolarHBondContact CA-SG 3.49Å; C71-C87 HydrophobicContact CB-CB 3.5Å; C71-C87 VanDerWaalsContact CB-CB 3.5Å; C71-C87 WeakPolarHBondContact CB-SG 3.4Å; C71-C87 WeakPolarHBondContact SG-CB 3.36Å; C71-C87 CovalentContact SG-SG 2.06Å; C71-C87 PolarHBondContact SG-SG 3.37Å; C71-Y88 HydrophobicContact CB-CD2 4.31Å; C71-Y88 HydrophobicContact CB-CE2 4.1Å
72L70.9Confident75.1Confident81 Ų8183 Ų8342%0.42444%0.439SS..Hα-helixtrans-70-35.8175.2-72.8172.4000112.9T68 W69 K70 Q74 V75T68-L72 HydrophobicContact CG2-CD1 4.22Å; T68-L72 WeakPolarHBondContact O-CG 3.33Å; T68-L72 PolarHBondContact O-N 2.92Å; W69-L72 HydrophobicContact CE3-CD1 4.06Å; W69-L72 HydrophobicContact CZ3-CD1 4.23Å; W69-L72 CarbonylContact O-C 3.6Å; W69-L72 PolarHBondContact O-N 3.3Å; W69-L72 VanDerWaalsContact O-N 3.14Å; K70-L72 PolarHBondContact O-N 2.91Å; L72-Q74 VanDerWaalsContact C-N 3.32Å; L72-V75 WeakPolarHBondContact O-CG2 3.44Å
73L73.6Confident74.9Confident91 Ų9179.9 Ų79.948%0.47643%0.431SS..Hα-helixtrans-75.1-26.9178.6-68.3173.8000111.5W69 K70 V75 L76 G82W69-L73 WeakPolarHBondContact O-CB 3.45Å; W69-L73 VanDerWaalsContact O-CG 3.26Å; W69-L73 WeakPolarHBondContact O-CG 3.25Å; W69-L73 PolarHBondContact O-N 2.86Å; K70-L73 PolarHBondContact O-N 2.97Å; L73-V75 VanDerWaalsContact C-N 3.27Å; L73-V75 PolarHBondContact O-N 3.38Å; L73-L76 HydrophobicContact CB-CD1 4.45Å; L73-L76 HydrophobicContact CD2-CD1 3.63Å; L73-L76 VanDerWaalsContact O-CB 3.24Å; L73-L76 WeakPolarHBondContact O-CB 2.98Å; L73-L76 WeakPolarHBondContact O-CG 3.45Å; L73-L76 PolarHBondContact O-N 3.37Å; L73-L76 VanDerWaalsContact O-N 3.13Å; L73-G82 WeakPolarHBondContact O-CA 3.16Å
74Q77.1Confident74.6Confident25 Ų2581.5 Ų81.512%0.11744%0.436CS..Hα-helixtrans-64-26.9176.4-80.1175.1-17.400113.9K70 L72 L76 Q83 P86 C87K70-Q74 VanDerWaalsContact O-CG 3.28Å; K70-Q74 WeakPolarHBondContact O-CG 2.81Å; K70-Q74 PolarHBondContact O-N 3.26Å; L72-Q74 VanDerWaalsContact C-N 3.32Å; Q74-L76 PolarHBondContact O-N 3.42Å; Q74-Q83 HydrophobicContact CB-CB 4.36Å; Q74-Q83 HydrophobicContact CG-CB 4.19Å; Q74-Q83 HydrophobicContact CG-CG 4.02Å; Q74-Q83 PolarHBondContact O-N 2.75Å; Q74-P86 HydrophobicContact CB-CB 3.93Å; Q74-C87 PolarHBondContact OE1-SG 2.97Å
75V74.5Confident74.2Confident57 Ų5783.2 Ų83.235%0.34545%0.449SS..THydrogen-bonded Turntrans-78.2-6.7176.1-70.40000113.4L72 L73 P86L72-V75 WeakPolarHBondContact O-CG2 3.44Å; L73-V75 VanDerWaalsContact C-N 3.27Å; L73-V75 PolarHBondContact O-N 3.38Å; V75-P86 HydrophobicContact CB-CB 4.38Å; V75-P86 HydrophobicContact CG1-CB 3.46Å; V75-P86 VanDerWaalsContact CG1-CB 3.46Å; V75-P86 HydrophobicContact CG1-CG 3.77Å
76L73.2Confident73.8Confident66 Ų6681.5 Ų81.535%0.34644%0.441SS..SBendtrans-63.2159.2172.2-66.3176.7000110.5L73 Q74 L80 G82L73-L76 HydrophobicContact CB-CD1 4.45Å; L73-L76 HydrophobicContact CD2-CD1 3.63Å; L73-L76 VanDerWaalsContact O-CB 3.24Å; L73-L76 WeakPolarHBondContact O-CB 2.98Å; L73-L76 WeakPolarHBondContact O-CG 3.45Å; L73-L76 PolarHBondContact O-N 3.37Å; L73-L76 VanDerWaalsContact O-N 3.13Å; Q74-L76 PolarHBondContact O-N 3.42Å; L76-L80 HydrophobicContact CB-CB 4.25Å; L76-L80 HydrophobicContact CD1-CB 4.38Å; L76-G82 VanDerWaalsContact O-CA 3.3Å; L76-G82 WeakPolarHBondContact O-CA 3.43Å
77P74.2Confident73.3Confident74 Ų7482.9 Ų82.948%0.48145%0.448SS..  trans-61.8148.6169.326.9-34.8000110.7N79 L80 G82P77-N79 WeakPolarHBondContact CB-OD1 3.45Å; P77-N79 VanDerWaalsContact CG-OD1 3.28Å; P77-N79 WeakPolarHBondContact CG-OD1 3.43Å; P77-N79 PolarHBondContact O-N 2.92Å; P77-N79 VanDerWaalsContact O-N 3.08Å; P77-L80 HydrophobicContact CG-CB 4.4Å; P77-L80 HydrophobicContact CG-CD1 3.93Å; P77-L80 HydrophobicContact CG-CG 4.14Å; P77-L80 PolarHBondContact O-N 3.34Å; P77-G82 PolarHBondContact O-N 3.26Å
78E78.5Confident72.6Confident113 Ų11387.6 Ų87.653%0.52846%0.456SS..G310 helixtrans-56.2-30.6-174-68.3-171143.100113L80 G81 K84E78-L80 PolarHBondContact O-N 2.92Å; E78-G81 PolarHBondContact O-N 3.49Å; E78-K84 VanDerWaalsContact OE1-CD 3.25Å; E78-K84 WeakPolarHBondContact OE1-CD 3.21Å; E78-K84 WeakPolarHBondContact OE1-CE 3.26Å; E78-K84 WeakPolarHBondContact OE1-CG 3.32Å; E78-K84 IonicContact OE1-NZ 2.8Å
79N79.3Confident71.8Confident135 Ų13590.1 Ų90.172%0.72247%0.468SS*.G310 helixtrans-66.8-19.2176.969-29.8000113.9P77P77-N79 WeakPolarHBondContact CB-OD1 3.45Å; P77-N79 VanDerWaalsContact CG-OD1 3.28Å; P77-N79 WeakPolarHBondContact CG-OD1 3.43Å; P77-N79 PolarHBondContact O-N 2.92Å; P77-N79 VanDerWaalsContact O-N 3.08Å
80L77.7Confident70.9Confident118 Ų11888.8 Ų88.862%0.61847%0.472SS*.G310 helixtrans-101.413.3172.8-63.2-179.6000112.3L76 P77 E78L76-L80 HydrophobicContact CB-CB 4.25Å; L76-L80 HydrophobicContact CD1-CB 4.38Å; P77-L80 HydrophobicContact CG-CB 4.4Å; P77-L80 HydrophobicContact CG-CD1 3.93Å; P77-L80 HydrophobicContact CG-CG 4.14Å; P77-L80 PolarHBondContact O-N 3.34Å; E78-L80 PolarHBondContact O-N 2.92Å
81G71.2Confident70.1Confident61 Ų6189 Ų8963%0.62948%0.48SS*.THydrogen-bonded Turntrans88.711.7179.200000114.9E78E78-G81 PolarHBondContact O-N 3.49Å
82G77.2Confident69Low9 Ų993.4 Ų93.49%0.09351%0.505CS..  trans-73.2178.5172.200000113.9L73 L76 P77L73-G82 WeakPolarHBondContact O-CA 3.16Å; L76-G82 VanDerWaalsContact O-CA 3.3Å; L76-G82 WeakPolarHBondContact O-CA 3.43Å; P77-G82 PolarHBondContact O-N 3.26Å
83Q73Confident67.6Low104 Ų10495.4 Ų95.449%0.48652%0.521SS..  trans-129.5146.2-176.8-68.4-172.1-13.200111.2Q74 N85 P86Q74-Q83 HydrophobicContact CB-CB 4.36Å; Q74-Q83 HydrophobicContact CG-CB 4.19Å; Q74-Q83 HydrophobicContact CG-CG 4.02Å; Q74-Q83 PolarHBondContact O-N 2.75Å; Q83-N85 PolarHBondContact O-N 2.55Å; Q83-P86 WeakPolarHBondContact O-CD 3.45Å
84K69.1Low65.8Low164 Ų164103.4 Ų103.471%0.71356%0.556SS**SBendtrans-55.3-34.4174.5-89.2161.6-171.9176.70114.5E78 P86E78-K84 VanDerWaalsContact OE1-CD 3.25Å; E78-K84 WeakPolarHBondContact OE1-CD 3.21Å; E78-K84 WeakPolarHBondContact OE1-CE 3.26Å; E78-K84 WeakPolarHBondContact OE1-CG 3.32Å; E78-K84 IonicContact OE1-NZ 2.8Å; K84-P86 VanDerWaalsContact C-CD 3.47Å; K84-P86 VanDerWaalsContact O-CD 3.29Å; K84-P86 WeakPolarHBondContact O-CD 3.2Å
85N69.1Low65.2Low142 Ų142107.3 Ų107.376%0.75958%0.578SS**SBendtrans-118.578.3-179.3-68.7-16000110Q83Q83-N85 PolarHBondContact O-N 2.55Å
86P67.4Low64.7Low28 Ų28109.9 Ų109.918%0.18259%0.59CS.*  trans-67.8157.6177.827.3-33.7000112.6Q74 V75 Q83 K84 Y88Q74-P86 HydrophobicContact CB-CB 3.93Å; V75-P86 HydrophobicContact CB-CB 4.38Å; V75-P86 HydrophobicContact CG1-CB 3.46Å; V75-P86 VanDerWaalsContact CG1-CB 3.46Å; V75-P86 HydrophobicContact CG1-CG 3.77Å; Q83-P86 WeakPolarHBondContact O-CD 3.45Å; K84-P86 VanDerWaalsContact C-CD 3.47Å; K84-P86 VanDerWaalsContact O-CD 3.29Å; K84-P86 WeakPolarHBondContact O-CD 3.2Å; P86-Y88 VanDerWaalsContact CG-O 3.27Å; P86-Y88 WeakPolarHBondContact CG-O 3.15Å; P86-Y88 PolarHBondContact O-N 3Å; P86-Y88 VanDerWaalsContact O-N 3.12Å
87C66.4Low64.3Low70 Ų70112.4 Ų112.447%0.47360%0.604SS.*SBendtrans-54.4-30172.7-54.70000113C71 Q74C71-C87 WeakPolarHBondContact CA-SG 3.49Å; C71-C87 HydrophobicContact CB-CB 3.5Å; C71-C87 VanDerWaalsContact CB-CB 3.5Å; C71-C87 WeakPolarHBondContact CB-SG 3.4Å; C71-C87 WeakPolarHBondContact SG-CB 3.36Å; C71-C87 CovalentContact SG-SG 2.06Å; C71-C87 PolarHBondContact SG-SG 3.37Å; Q74-C87 PolarHBondContact OE1-SG 2.97Å
88Y60.6Low63.7Low131 Ų131114.6 Ų114.651%0.51461%0.611SS.*SBendtrans-108.3110.7176.5-69-73.6000109.7C71 P86 L90C71-Y88 HydrophobicContact CB-CD2 4.31Å; C71-Y88 HydrophobicContact CB-CE2 4.1Å; P86-Y88 VanDerWaalsContact CG-O 3.27Å; P86-Y88 WeakPolarHBondContact CG-O 3.15Å; P86-Y88 PolarHBondContact O-N 3Å; P86-Y88 VanDerWaalsContact O-N 3.12Å; Y88-L90 PolarHBondContact O-N 2.9Å
89N56Low62.7Low104 Ų104114.8 Ų114.856%0.55662%0.616SS**  trans-74111.2168.6-123.9-25.9000108N91 T92N89-N91 PolarHBondContact O-N 3.25Å; N89-T92 PolarHBondContact O-N 3.42Å; N89-T92 VanDerWaalsContact O-N 3.11Å; N89-T92 PolarHBondContact O-OG1 3.37Å
90L56.1Low61.6Low127 Ų127113.4 Ų113.467%0.66561%0.609SS**G310 helixtrans-56.6-21.8176.4-74.5165.7000112.2Y88 T92 T93Y88-L90 PolarHBondContact O-N 2.9Å; L90-T92 VanDerWaalsContact C-N 3.32Å; L90-T92 PolarHBondContact O-N 3.18Å; L90-T93 PolarHBondContact O-OG1 3.42Å; L90-T93 VanDerWaalsContact O-OG1 3.06Å
91N56.5Low60.5Low143 Ų143113.1 Ų113.177%0.76561%0.609SS**G310 helixtrans-76.8-4.1179.6-68.8-4.1000115.2N89 T93N89-N91 PolarHBondContact O-N 3.25Å; N91-T93 PolarHBondContact O-N 3.06Å
92T47.6Very low59.7Low118 Ų118117.1 Ų117.172%0.72461%0.607SS**G310 helixtrans-89.624.3172.350.90000113.5N89 L90 Q94N89-T92 PolarHBondContact O-N 3.42Å; N89-T92 VanDerWaalsContact O-N 3.11Å; N89-T92 PolarHBondContact O-OG1 3.37Å; L90-T92 VanDerWaalsContact C-N 3.32Å; L90-T92 PolarHBondContact O-N 3.18Å; T92-Q94 PolarHBondContact O-N 3.11Å
93T41.5Very low58.2Low123 Ų123126.1 Ų126.176%0.75565%0.65SS**  trans-86.765.4165.4-32.70000109.5L90 N91L90-T93 PolarHBondContact O-OG1 3.42Å; L90-T93 VanDerWaalsContact O-OG1 3.06Å; N91-T93 PolarHBondContact O-N 3.06Å
94Q35.3Very low56.9Low259 Ų259128.1 Ų128.1100%1.2167%0.665SS**  trans-143.30164.3-77.4-164.4-43.200110T92T92-Q94 PolarHBondContact O-N 3.11Å

Retrieved 94 of 94 residues in 182.7 ms (Link to these results)