A0A060XPS6_ONCMY Loading...

Membrane magnesium transporter

Part of the endoplasmic reticulum membrane protein complex (EMC) that enables the energy-independent insertion into endoplasmic reticulum membranes of newly synthesized membrane proteins. May be involved in Mg(2+) transport.

AlphaFold DB (B5X988), UniProt , Accession A0A060XPS6, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 132 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
1M51.4Low77.6Confident217 Ų217100.3 Ų100.3100%1.06953%0.527SS*.  0-35.10-89.9169.7138.300115.6M3 A4M1-M3 PolarHBondContact O-N 2.9Å; M1-A4 PolarHBondContact O-N 3.34Å
2K54.4Low79.2Confident185 Ų18593.5 Ų93.580%0.80449%0.492SS*.Hα-helixtrans-57.7-39.3-178.3-79.4177.1174.9174.60115.3A4 S5 S6K2-A4 PolarHBondContact O-N 2.84Å; K2-S5 PolarHBondContact O-N 3.04Å; K2-S5 PolarHBondContact O-OG 3.31Å; K2-S6 PolarHBondContact O-N 3.33Å; K2-S6 PolarHBondContact O-OG 3.38Å
3M58.5Low80.5Confident165 Ų16592.8 Ų92.881%0.81350%0.499SS*.Hα-helixtrans-61.7-38.3-177.1-62.6-68.1-93.700113.6M1 S5 S6 F7M1-M3 PolarHBondContact O-N 2.9Å; M3-S5 PolarHBondContact O-N 2.87Å; M3-S6 PolarHBondContact O-N 3.43Å; M3-F7 PolarHBondContact O-N 2.97Å
4A62.3Low81.6Confident58 Ų5892.6 Ų92.648%0.47950%0.502SS..Hα-helixtrans-64.6-41179.700000111.6M1 K2 S6 F7 W8M1-A4 PolarHBondContact O-N 3.34Å; K2-A4 PolarHBondContact O-N 2.84Å; A4-S6 VanDerWaalsContact C-N 3.31Å; A4-S6 PolarHBondContact O-N 3.28Å; A4-F7 PolarHBondContact O-N 3.13Å; A4-W8 PolarHBondContact O-N 3.16Å
5S74.8Confident82.6Confident51 Ų5186.5 Ų86.536%0.35747%0.469SS..Hα-helixtrans-65.6-34.1177.480.60000112.8K2 M3 K9K2-S5 PolarHBondContact O-N 3.04Å; K2-S5 PolarHBondContact O-OG 3.31Å; M3-S5 PolarHBondContact O-N 2.87Å; S5-K9 VanDerWaalsContact O-CG 3.27Å; S5-K9 WeakPolarHBondContact O-CG 3.39Å; S5-K9 PolarHBondContact O-N 3.36Å; S5-K9 VanDerWaalsContact O-N 3.12Å
6S86.5Confident83.6Confident74 Ų7486.9 Ų86.952%0.51747%0.47SS..Hα-helixtrans-70.1-36.5178.4-60.80000111.9K2 M3 A4 K9 G10K2-S6 PolarHBondContact O-N 3.33Å; K2-S6 PolarHBondContact O-OG 3.38Å; M3-S6 PolarHBondContact O-N 3.43Å; A4-S6 VanDerWaalsContact C-N 3.31Å; A4-S6 PolarHBondContact O-N 3.28Å; S6-K9 PolarHBondContact O-N 3.29Å; S6-G10 PolarHBondContact O-N 3.29Å
7F91.1Very high84.4Confident133 Ų13390.8 Ų90.858%0.58348%0.482SS*.Hα-helixtrans-61.4-50.5174175.1-101.3000111.6M3 A4 K9 G10 V11M3-F7 PolarHBondContact O-N 2.97Å; A4-F7 PolarHBondContact O-N 3.13Å; F7-K9 VanDerWaalsContact C-N 3.31Å; F7-K9 PolarHBondContact O-N 2.84Å; F7-G10 CarbonylContact O-C 3.59Å; F7-G10 WeakPolarHBondContact O-CA 2.84Å; F7-G10 PolarHBondContact O-N 3.2Å; F7-V11 HydrophobicContact CD1-CG2 4.19Å; F7-V11 HydrophobicContact CE1-CG2 3.74Å; F7-V11 HydrophobicContact CE2-CG2 4.33Å; F7-V11 HydrophobicContact CZ-CG2 3.82Å; F7-V11 PolarHBondContact O-N 3.36Å
8W93.1Very high85.1Confident50 Ų5087.1 Ų87.119%0.18947%0.466CS..Hα-helixtrans-62.6-36.5179.5-67.7118.9000113.1A4 G10 V11 V12 Y60 H64 I65A4-W8 PolarHBondContact O-N 3.16Å; W8-G10 VanDerWaalsContact C-N 3.31Å; W8-G10 PolarHBondContact O-N 3.44Å; W8-V11 HydrophobicContact CE3-CB 4.4Å; W8-V11 HydrophobicContact CE3-CG2 4.3Å; W8-V11 WeakPolarHBondContact O-CB 3.14Å; W8-V11 PolarHBondContact O-N 3.04Å; W8-V12 WeakPolarHBondContact O-CG2 3.27Å; W8-V12 PolarHBondContact O-N 2.93Å; W8-Y60 HydrophobicContact CH2-CD1 4.15Å; W8-Y60 AromaticContact CH2-CE1 3.46Å; W8-Y60 HydrophobicContact CH2-CE1 3.46Å; W8-Y60 VanDerWaalsContact CH2-CE1 3.46Å; W8-Y60 AromaticContact CZ3-CD1 3.72Å; W8-Y60 HydrophobicContact CZ3-CD1 3.72Å; W8-Y60 AromaticContact CZ3-CE1 3.52Å; W8-Y60 HydrophobicContact CZ3-CE1 3.52Å; W8-H64 HydrophobicContact CB-CB 4.43Å; W8-H64 HydrophobicContact CD2-CB 3.55Å; W8-H64 AromaticContact CD2-CG 4Å; W8-H64 AromaticContact CE2-CD2 3.76Å; W8-H64 AromaticContact CE2-CG 3.73Å; W8-H64 HydrophobicContact CE3-CB 4.02Å; W8-H64 HydrophobicContact CG-CB 3.73Å; W8-H64 HydrophobicContact CZ2-CB 4.19Å; W8-H64 AromaticContact CZ2-CD2 3.53Å; W8-H64 AromaticContact CZ2-CG 3.75Å; W8-H64 AromaticContact CZ2-NE2 3.98Å; W8-I65 HydrophobicContact CB-CD1 4.34Å; W8-I65 HydrophobicContact CB-CG1 3.77Å
9K92.5Very high85.7Confident113 Ų11385.5 Ų85.549%0.49146%0.457SS..Hα-helixtrans-59.9-42.3170.5-72.5172.4-176.6-172.10111.8S5 S6 F7 V12 C13 I65S5-K9 VanDerWaalsContact O-CG 3.27Å; S5-K9 WeakPolarHBondContact O-CG 3.39Å; S5-K9 PolarHBondContact O-N 3.36Å; S5-K9 VanDerWaalsContact O-N 3.12Å; S6-K9 PolarHBondContact O-N 3.29Å; F7-K9 VanDerWaalsContact C-N 3.31Å; F7-K9 PolarHBondContact O-N 2.84Å; K9-V12 PolarHBondContact O-N 2.82Å; K9-C13 PolarHBondContact O-N 3.48Å; K9-C13 PolarHBondContact O-SG 2.92Å; K9-I65 HydrophobicContact CB-CD1 4.49Å; K9-I65 HydrophobicContact CG-CD1 3.89Å; K9-I65 HydrophobicContact CG-CG1 4.34Å
10G94.4Very high86.3Confident34 Ų3484.3 Ų84.335%0.35146%0.46SS..Hα-helixtrans-59.1-45.4172.700000112.6S6 F7 W8 V12 C13 V14S6-G10 PolarHBondContact O-N 3.29Å; F7-G10 CarbonylContact O-C 3.59Å; F7-G10 WeakPolarHBondContact O-CA 2.84Å; F7-G10 PolarHBondContact O-N 3.2Å; W8-G10 VanDerWaalsContact C-N 3.31Å; W8-G10 PolarHBondContact O-N 3.44Å; G10-V12 VanDerWaalsContact C-N 3.35Å; G10-V12 PolarHBondContact O-N 3.1Å; G10-C13 WeakPolarHBondContact O-CB 3.44Å; G10-C13 PolarHBondContact O-N 3.32Å; G10-V14 WeakPolarHBondContact O-CG2 3.4Å; G10-V14 PolarHBondContact O-N 2.95Å
11V95.1Very high86.8Confident23 Ų2384.7 Ų84.714%0.13946%0.459CS..Hα-helixtrans-58.6-45176.2175.10000111.4F7 W8 V14 G15 L57F7-V11 HydrophobicContact CD1-CG2 4.19Å; F7-V11 HydrophobicContact CE1-CG2 3.74Å; F7-V11 HydrophobicContact CE2-CG2 4.33Å; F7-V11 HydrophobicContact CZ-CG2 3.82Å; F7-V11 PolarHBondContact O-N 3.36Å; W8-V11 HydrophobicContact CE3-CB 4.4Å; W8-V11 HydrophobicContact CE3-CG2 4.3Å; W8-V11 WeakPolarHBondContact O-CB 3.14Å; W8-V11 PolarHBondContact O-N 3.04Å; V11-V14 PolarHBondContact O-N 3.35Å; V11-G15 PolarHBondContact O-N 3.15Å; V11-L57 HydrophobicContact CG1-CD1 3.71Å; V11-L57 HydrophobicContact CG1-CD2 4.5Å; V11-L57 HydrophobicContact CG1-CG 3.89Å
12V95.9Very high88.9Confident19 Ų1974.4 Ų74.412%0.11541%0.408CS..Hα-helixtrans-63.4-42.5176.31720000111.5W8 K9 G10 V14 G15 L16 T58 G61 I62 I65W8-V12 WeakPolarHBondContact O-CG2 3.27Å; W8-V12 PolarHBondContact O-N 2.93Å; K9-V12 PolarHBondContact O-N 2.82Å; G10-V12 VanDerWaalsContact C-N 3.35Å; G10-V12 PolarHBondContact O-N 3.1Å; V12-V14 VanDerWaalsContact C-N 3.34Å; V12-V14 PolarHBondContact O-N 3.38Å; V12-G15 PolarHBondContact O-N 3.44Å; V12-L16 HydrophobicContact CG1-CD1 4.04Å; V12-L16 HydrophobicContact CG1-CG 4.33Å; V12-L16 WeakPolarHBondContact O-CG 3.33Å; V12-L16 PolarHBondContact O-N 2.79Å; V12-T58 HydrophobicContact CG1-CG2 4.44Å; V12-G61 VanDerWaalsContact CG2-C 3.45Å; V12-I62 HydrophobicContact CG1-CG1 4.26Å; V12-I62 HydrophobicContact CG2-CG1 3.94Å; V12-I65 HydrophobicContact CB-CD1 4.26Å; V12-I65 HydrophobicContact CG2-CD1 3.59Å
13C96.5Very high90.9Very high85 Ų8568.2 Ų68.257%0.57439%0.391SS*.Hα-helixtrans-59.7-43.9175.8-70.90000112.1K9 G10 L16 F17K9-C13 PolarHBondContact O-N 3.48Å; K9-C13 PolarHBondContact O-SG 2.92Å; G10-C13 WeakPolarHBondContact O-CB 3.44Å; G10-C13 PolarHBondContact O-N 3.32Å; C13-L16 PolarHBondContact O-N 2.91Å; C13-F17 WeakPolarHBondContact O-CB 3.43Å; C13-F17 PolarHBondContact O-N 2.92Å
14V96.5Very high92.7Very high90 Ų9067.1 Ų67.155%0.54538%0.382SS..Hα-helixtrans-64.6-42.7176.6173.10000110.9G10 V11 V12 F17 A18G10-V14 WeakPolarHBondContact O-CG2 3.4Å; G10-V14 PolarHBondContact O-N 2.95Å; V11-V14 PolarHBondContact O-N 3.35Å; V12-V14 VanDerWaalsContact C-N 3.34Å; V12-V14 PolarHBondContact O-N 3.38Å; V14-F17 PolarHBondContact O-N 3.4Å; V14-A18 WeakPolarHBondContact O-CB 3.42Å; V14-A18 PolarHBondContact O-N 2.98Å
15G96.7Very high94.2Very high0 Ų065.7 Ų65.70%037%0.369CS..Hα-helixtrans-60.1-46176.100000113V11 V12 A18 L19 T58V11-G15 PolarHBondContact O-N 3.15Å; V12-G15 PolarHBondContact O-N 3.44Å; G15-A18 PolarHBondContact O-N 3.33Å; G15-L19 WeakPolarHBondContact O-CB 3.38Å; G15-L19 PolarHBondContact O-N 3.35Å; G15-T58 VanDerWaalsContact C-OG1 3.31Å; G15-T58 WeakPolarHBondContact CA-OG1 3.44Å
16L97.1Very high95.1Very high94 Ų9464.5 Ų64.549%0.49236%0.362SS..Hα-helixtrans-65.3-40176.6-70.5175.9000112.5V12 C13 L19 A20 T58V12-L16 HydrophobicContact CG1-CD1 4.04Å; V12-L16 HydrophobicContact CG1-CG 4.33Å; V12-L16 WeakPolarHBondContact O-CG 3.33Å; V12-L16 PolarHBondContact O-N 2.79Å; C13-L16 PolarHBondContact O-N 2.91Å; L16-L19 PolarHBondContact O-N 3.27Å; L16-A20 WeakPolarHBondContact O-CB 3.41Å; L16-A20 PolarHBondContact O-N 3.41Å; L16-T58 HydrophobicContact CD2-CG2 3.99Å; L16-T58 HydrophobicContact CG-CG2 4.28Å
17F98Very high95.5Very high152 Ų15263.5 Ų63.567%0.66736%0.358SS*.Hα-helixtrans-63.6-45.3175.4-179.9-97.8000111.6C13 V14 L19 A20 H21C13-F17 WeakPolarHBondContact O-CB 3.43Å; C13-F17 PolarHBondContact O-N 2.92Å; V14-F17 PolarHBondContact O-N 3.4Å; F17-L19 VanDerWaalsContact C-N 3.3Å; F17-L19 PolarHBondContact O-N 2.96Å; F17-A20 PolarHBondContact O-N 2.93Å; F17-H21 WeakPolarHBondContact O-CB 3.5Å; F17-H21 PolarHBondContact O-N 3.47Å
18A96.6Very high95.6Very high25 Ų2563 Ų6321%0.20736%0.358CS..Hα-helixtrans-62.7-37.3176.100000112.1V14 G15 H21 A22 A54V14-A18 WeakPolarHBondContact O-CB 3.42Å; V14-A18 PolarHBondContact O-N 2.98Å; G15-A18 PolarHBondContact O-N 3.33Å; A18-H21 PolarHBondContact O-N 3.13Å; A18-A22 WeakPolarHBondContact O-CB 3.29Å; A18-A22 PolarHBondContact O-N 2.9Å; A18-A54 HydrophobicContact CB-CB 3.85Å
19L96.7Very high95.5Very high56 Ų5662.5 Ų62.529%0.29336%0.358SS..Hα-helixtrans-67.5-42.2176.2-167.165.6000111.7G15 L16 F17 H21 A22 A23 T51 A54G15-L19 WeakPolarHBondContact O-CB 3.38Å; G15-L19 PolarHBondContact O-N 3.35Å; L16-L19 PolarHBondContact O-N 3.27Å; F17-L19 VanDerWaalsContact C-N 3.3Å; F17-L19 PolarHBondContact O-N 2.96Å; L19-H21 VanDerWaalsContact C-N 3.35Å; L19-A22 PolarHBondContact O-N 3.4Å; L19-A23 WeakPolarHBondContact O-CB 3.48Å; L19-A23 PolarHBondContact O-N 3.21Å; L19-T51 HydrophobicContact CD1-CG2 4.38Å; L19-A54 HydrophobicContact CB-CB 4.15Å; L19-A54 HydrophobicContact CD1-CB 4.27Å
20A97.6Very high95.3Very high62 Ų6264.8 Ų64.851%0.51236%0.363SS..Hα-helixtrans-62.9-41.3174.200000111.7L16 F17 A23 F24L16-A20 WeakPolarHBondContact O-CB 3.41Å; L16-A20 PolarHBondContact O-N 3.41Å; F17-A20 PolarHBondContact O-N 2.93Å; A20-A23 PolarHBondContact O-N 2.91Å; A20-F24 PolarHBondContact O-N 3.46Å
21H96.8Very high95.1Very high93 Ų9365.9 Ų65.943%0.43137%0.366SS..Hα-helixtrans-60-48.6174.5-176.1-78.2000111.3F17 A18 L19 A23 F24 S25 Q50F17-H21 WeakPolarHBondContact O-CB 3.5Å; F17-H21 PolarHBondContact O-N 3.47Å; A18-H21 PolarHBondContact O-N 3.13Å; L19-H21 VanDerWaalsContact C-N 3.35Å; H21-A23 VanDerWaalsContact C-N 3.32Å; H21-A23 PolarHBondContact O-N 2.92Å; H21-F24 WeakPolarHBondContact O-CB 3.39Å; H21-F24 PolarHBondContact O-N 3.41Å; H21-S25 PolarHBondContact O-N 2.88Å; H21-S25 PolarHBondContact O-OG 2.88Å; H21-Q50 PolarHBondContact ND1-NE2 3.45Å
22A96.2Very high94.8Very high0 Ų072 Ų720%039%0.387CS..Hα-helixtrans-65.8-35179.700000112.4A18 L19 S25 A26 Q50 T51A18-A22 WeakPolarHBondContact O-CB 3.29Å; A18-A22 PolarHBondContact O-N 2.9Å; L19-A22 PolarHBondContact O-N 3.4Å; A22-S25 PolarHBondContact O-N 3.36Å; A22-A26 WeakPolarHBondContact O-CB 3.24Å; A22-A26 PolarHBondContact O-N 2.98Å; A22-Q50 HydrophobicContact CB-CB 4.38Å; A22-Q50 HydrophobicContact CB-CG 4Å; A22-T51 HydrophobicContact CB-CG2 3.43Å; A22-T51 VanDerWaalsContact CB-CG2 3.43Å
23A95.9Very high94.4Very high56 Ų5671.8 Ų71.846%0.46339%0.385SS..Hα-helixtrans-64.3-41.1172.300000112.1L19 A20 H21 A26 A27L19-A23 WeakPolarHBondContact O-CB 3.48Å; L19-A23 PolarHBondContact O-N 3.21Å; A20-A23 PolarHBondContact O-N 2.91Å; H21-A23 VanDerWaalsContact C-N 3.32Å; H21-A23 PolarHBondContact O-N 2.92Å; A23-A26 PolarHBondContact O-N 3.18Å; A23-A27 WeakPolarHBondContact O-CB 3.32Å; A23-A27 PolarHBondContact O-N 2.89Å
24F96.3Very high93.9Very high141 Ų14174.7 Ų74.762%0.61838%0.384SS*.Hα-helixtrans-62.7-46.5173.8-176.7-94.2000111.4A20 H21 A26 A27 Q28A20-F24 PolarHBondContact O-N 3.46Å; H21-F24 WeakPolarHBondContact O-CB 3.39Å; H21-F24 PolarHBondContact O-N 3.41Å; F24-A26 VanDerWaalsContact C-N 3.33Å; F24-A26 PolarHBondContact O-N 2.96Å; F24-A27 PolarHBondContact O-N 2.83Å; F24-Q28 WeakPolarHBondContact O-CB 3.48Å; F24-Q28 PolarHBondContact O-N 3.39Å
25S94.8Very high93.4Very high29 Ų2977.6 Ų77.620%0.20340%0.395CS..Hα-helixtrans-58.7-42.9175.1-59.80000112.2H21 A22 Q28 H29H21-S25 PolarHBondContact O-N 2.88Å; H21-S25 PolarHBondContact O-OG 2.88Å; A22-S25 PolarHBondContact O-N 3.36Å; S25-Q28 PolarHBondContact O-N 3.45Å; S25-H29 WeakPolarHBondContact O-CB 3.47Å; S25-H29 PolarHBondContact O-N 2.92Å
26A93.6Very high92.8Very high26 Ų2679.9 Ų79.922%0.21541%0.41CS..Hα-helixtrans-65-41.4176.500000112.3A22 A23 F24 H29 R30 L43 I47A22-A26 WeakPolarHBondContact O-CB 3.24Å; A22-A26 PolarHBondContact O-N 2.98Å; A23-A26 PolarHBondContact O-N 3.18Å; F24-A26 VanDerWaalsContact C-N 3.33Å; F24-A26 PolarHBondContact O-N 2.96Å; A26-H29 PolarHBondContact O-N 3.42Å; A26-R30 WeakPolarHBondContact O-CB 3.22Å; A26-R30 PolarHBondContact O-N 3.47Å; A26-L43 HydrophobicContact CB-CD1 4.37Å; A26-L43 HydrophobicContact CB-CD2 4.41Å; A26-I47 HydrophobicContact CB-CG2 4.02Å
27A93.6Very high91.9Very high53 Ų5384.1 Ų84.144%0.43843%0.427SS..Hα-helixtrans-65.9-40.8177.500000112A23 F24 R30 S31A23-A27 WeakPolarHBondContact O-CB 3.32Å; A23-A27 PolarHBondContact O-N 2.89Å; F24-A27 PolarHBondContact O-N 2.83Å; A27-R30 PolarHBondContact O-N 3Å; A27-S31 WeakPolarHBondContact O-CB 3.37Å; A27-S31 PolarHBondContact O-N 2.97Å; A27-S31 PolarHBondContact O-OG 3.3Å
28Q93.7Very high90.8Very high122 Ų12282 Ų8257%0.5742%0.418SS*.Hα-helixtrans-65.7-46175-174.7176.6-3.700111.1F24 S25 R30 S31 Y32F24-Q28 WeakPolarHBondContact O-CB 3.48Å; F24-Q28 PolarHBondContact O-N 3.39Å; S25-Q28 PolarHBondContact O-N 3.45Å; Q28-R30 VanDerWaalsContact C-N 3.33Å; Q28-R30 PolarHBondContact O-N 3.37Å; Q28-S31 PolarHBondContact O-N 3.19Å; Q28-Y32 PolarHBondContact O-N 3.18Å
29H90.6Very high89.3Confident40 Ų4088 Ų8819%0.18544%0.441CS..Hα-helixtrans-56-49174.9-177.4-93.3000111S25 A26 S31 Y32 M33 L43 P44 I47S25-H29 WeakPolarHBondContact O-CB 3.47Å; S25-H29 PolarHBondContact O-N 2.92Å; A26-H29 PolarHBondContact O-N 3.42Å; H29-S31 VanDerWaalsContact C-N 3.31Å; H29-S31 PolarHBondContact O-N 3.44Å; H29-Y32 WeakPolarHBondContact O-CB 3.3Å; H29-Y32 PolarHBondContact O-N 3.43Å; H29-Y32 VanDerWaalsContact O-N 3.15Å; H29-M33 PolarHBondContact CE1-SD 3.46Å; H29-M33 WeakPolarHBondContact O-CG 3.48Å; H29-M33 PolarHBondContact O-N 3.18Å; H29-L43 HydrophobicContact CB-CD1 4.34Å; H29-P44 WeakPolarHBondContact NE2-CD 3.47Å; H29-I47 HydrophobicContact CB-CD1 4.39Å
30R89.3Confident87.7Confident160 Ų16093 Ų9360%0.60447%0.468SS*.Hα-helixtrans-61.8-37.7178.5-167.8175-171153.63.7112.8A26 A27 Q28 R34A26-R30 WeakPolarHBondContact O-CB 3.22Å; A26-R30 PolarHBondContact O-N 3.47Å; A27-R30 PolarHBondContact O-N 3Å; Q28-R30 VanDerWaalsContact C-N 3.33Å; Q28-R30 PolarHBondContact O-N 3.37Å; R30-R34 VanDerWaalsContact O-CG 3.32Å; R30-R34 WeakPolarHBondContact O-CG 3.39Å; R30-R34 PolarHBondContact O-N 2.97Å
31S89.8Confident86.6Confident58 Ų5895.4 Ų95.441%0.40647%0.469SS..Hα-helixtrans-65.8-42.9174.9-580000111.3A27 Q28 H29 R34 L35A27-S31 WeakPolarHBondContact O-CB 3.37Å; A27-S31 PolarHBondContact O-N 2.97Å; A27-S31 PolarHBondContact O-OG 3.3Å; Q28-S31 PolarHBondContact O-N 3.19Å; H29-S31 VanDerWaalsContact C-N 3.31Å; H29-S31 PolarHBondContact O-N 3.44Å; S31-R34 PolarHBondContact O-N 3.01Å; S31-L35 WeakPolarHBondContact O-CD1 3.46Å; S31-L35 PolarHBondContact O-N 3.48Å; S31-L35 VanDerWaalsContact O-N 3.13Å
32Y88.5Confident85.9Confident150 Ų15096.9 Ų96.959%0.58849%0.485SS*.Hα-helixtrans-62-43.3176.4178.5-98.4000112.6Q28 H29 R34 L35 T36Q28-Y32 PolarHBondContact O-N 3.18Å; H29-Y32 WeakPolarHBondContact O-CB 3.3Å; H29-Y32 PolarHBondContact O-N 3.43Å; H29-Y32 VanDerWaalsContact O-N 3.15Å; Y32-R34 VanDerWaalsContact C-N 3.33Å; Y32-R34 PolarHBondContact O-N 2.7Å; Y32-L35 PolarHBondContact O-N 2.9Å; Y32-T36 HydrophobicContact CD2-CG2 4.37Å; Y32-T36 HydrophobicContact CE1-CG2 4.14Å; Y32-T36 HydrophobicContact CE2-CG2 3.94Å; Y32-T36 WeakPolarHBondContact O-CG2 3.15Å; Y32-T36 PolarHBondContact O-N 3.43Å; Y32-T36 VanDerWaalsContact O-N 3.1Å; Y32-T36 PolarHBondContact O-OG1 3.38Å
33M87.6Confident85.4Confident15 Ų15100.2 Ų100.27%0.07450%0.502CS..Hα-helixtrans-61-41.5176.9-58.5-138.281.900112.4H29 T36 E37 K38 E41H29-M33 PolarHBondContact CE1-SD 3.46Å; H29-M33 WeakPolarHBondContact O-CG 3.48Å; H29-M33 PolarHBondContact O-N 3.18Å; M33-T36 PolarHBondContact O-N 2.84Å; M33-T36 PolarHBondContact O-OG1 3.33Å; M33-E37 PolarHBondContact O-N 2.97Å; M33-K38 HydrophobicContact CE-CB 4.11Å; M33-K38 WeakPolarHBondContact CE-O 3.46Å; M33-K38 PolarHBondContact O-N 2.92Å; M33-E41 HydrophobicContact CE-CB 3.33Å; M33-E41 HydrophobicContact CE-CG 3.62Å; M33-E41 HydrophobicContact SD-CB 4.27Å; M33-E41 VanDerWaalsContact SD-O 3.41Å
34R86Confident85.1Confident147 Ų14799.9 Ų99.956%0.55550%0.495SS*.Hα-helixtrans-63.8-39.8177.3-74.5170.5171.2171-4.3112.3R30 S31 Y32 T36R30-R34 VanDerWaalsContact O-CG 3.32Å; R30-R34 WeakPolarHBondContact O-CG 3.39Å; R30-R34 PolarHBondContact O-N 2.97Å; S31-R34 PolarHBondContact O-N 3.01Å; Y32-R34 VanDerWaalsContact C-N 3.33Å; Y32-R34 PolarHBondContact O-N 2.7Å; R34-T36 VanDerWaalsContact C-N 3.35Å
35L87.1Confident84.9Confident150 Ų15098.9 Ų98.979%0.78550%0.501SS*.Hα-helixtrans-71.4-29178.5-93.783.5000113.3S31 Y32S31-L35 WeakPolarHBondContact O-CD1 3.46Å; S31-L35 PolarHBondContact O-N 3.48Å; S31-L35 VanDerWaalsContact O-N 3.13Å; Y32-L35 PolarHBondContact O-N 2.9Å
36T83.9Confident84.8Confident49 Ų49103 Ų10330%0.30152%0.52SS..THydrogen-bonded Turntrans-96.85.2-174.351.80000113.5Y32 M33 R34 K38Y32-T36 HydrophobicContact CD2-CG2 4.37Å; Y32-T36 HydrophobicContact CE1-CG2 4.14Å; Y32-T36 HydrophobicContact CE2-CG2 3.94Å; Y32-T36 WeakPolarHBondContact O-CG2 3.15Å; Y32-T36 PolarHBondContact O-N 3.43Å; Y32-T36 VanDerWaalsContact O-N 3.1Å; Y32-T36 PolarHBondContact O-OG1 3.38Å; M33-T36 PolarHBondContact O-N 2.84Å; M33-T36 PolarHBondContact O-OG1 3.33Å; R34-T36 VanDerWaalsContact C-N 3.35Å; T36-K38 PolarHBondContact O-N 2.92Å
37E78.1Confident84.8Confident182 Ų182102.4 Ų102.485%0.8551%0.513SS*.THydrogen-bonded Turntrans54.114.3-175.6-62.5-176.916100114.3M33 E39M33-E37 PolarHBondContact O-N 2.97Å; E37-E39 VanDerWaalsContact C-N 3.27Å; E37-E39 PolarHBondContact O-N 3.3Å; E37-E39 VanDerWaalsContact O-N 3.16Å
38K73.6Confident84.9Confident109 Ų109102.9 Ų102.947%0.47451%0.51SS..  trans-8853.5176.7-70-160.2173.475.30111.1M33 T36 N40M33-K38 HydrophobicContact CE-CB 4.11Å; M33-K38 WeakPolarHBondContact CE-O 3.46Å; M33-K38 PolarHBondContact O-N 2.92Å; T36-K38 PolarHBondContact O-N 2.92Å; K38-N40 PolarHBondContact O-N 3.36Å
39E66.1Low85Confident151 Ų151101.6 Ų101.671%0.70651%0.507SS*.THydrogen-bonded Turntrans-65.3-6.5-169.3-131.1-177.2172.200115.5E37E37-E39 VanDerWaalsContact C-N 3.27Å; E37-E39 PolarHBondContact O-N 3.3Å; E37-E39 VanDerWaalsContact O-N 3.16Å
40N61.9Low85.2Confident159 Ų159102.4 Ų102.485%0.8551%0.511SS*.THydrogen-bonded Turntrans-101.3-2.3-170.1-54.5-56000115.3K38K38-N40 PolarHBondContact O-N 3.36Å
41E75.9Confident85.6Confident113 Ų11396.8 Ų96.853%0.52850%0.495SS..PPolyproline II helixtrans-81.6139.3178-43.1-178.8150.100111.4M33M33-E41 HydrophobicContact CE-CB 3.33Å; M33-E41 HydrophobicContact CE-CG 3.62Å; M33-E41 HydrophobicContact SD-CB 4.27Å; M33-E41 VanDerWaalsContact SD-O 3.41Å
42T82.3Confident86Confident125 Ų12598.7 Ų98.777%0.76750%0.5SS*.PPolyproline II helixtrans-72155.9178.352.60000111.4
43L84.6Confident86.4Confident69 Ų6996.8 Ų96.836%0.36150%0.499SS..PPolyproline II helixtrans-59.5137.4176.3-15969000110.6A26 H29 V45 I47 V48A26-L43 HydrophobicContact CB-CD1 4.37Å; A26-L43 HydrophobicContact CB-CD2 4.41Å; H29-L43 HydrophobicContact CB-CD1 4.34Å; L43-V45 PolarHBondContact O-N 3.42Å; L43-I47 HydrophobicContact CD1-CD1 4.42Å; L43-I47 HydrophobicContact CD2-CB 4.32Å; L43-I47 HydrophobicContact CD2-CG2 3.86Å; L43-I47 HydrophobicContact CG-CB 4.34Å; L43-I47 HydrophobicContact CG-CG2 4.31Å; L43-V48 HydrophobicContact CB-CG2 4.3Å; L43-V48 HydrophobicContact CD2-CG2 4.06Å; L43-V48 HydrophobicContact CG-CG2 4.46Å
44P89.6Confident86.8Confident49 Ų4996.3 Ų96.332%0.31850%0.497SS..PPolyproline II helixtrans-53.5132.9177.1-26.932.2000111.2H29 D46 I47 V48H29-P44 WeakPolarHBondContact NE2-CD 3.47Å; P44-D46 PolarHBondContact O-N 3.36Å; P44-D46 VanDerWaalsContact O-N 3.13Å; P44-I47 HydrophobicContact CB-CD1 4.33Å; P44-I47 HydrophobicContact CB-CG1 4.36Å; P44-I47 HydrophobicContact CG-CD1 4.06Å; P44-I47 PolarHBondContact O-N 3.41Å; P44-V48 PolarHBondContact O-N 2.9Å
45V91.7Very high87.3Confident121 Ų12194.7 Ų94.773%0.73350%0.495SS*.Hα-helixtrans-56.3-32.4-178.9178.70000111.5L43 V48 L49L43-V45 PolarHBondContact O-N 3.42Å; V45-V48 PolarHBondContact O-N 2.92Å; V45-L49 WeakPolarHBondContact O-CB 3.39Å; V45-L49 PolarHBondContact O-N 3.18Å
46D93.3Very high87.8Confident115 Ų11591.9 Ų91.962%0.61548%0.483SS*.Hα-helixtrans-58.7-46175.9-175.660.6000112.9P44 V48 L49 Q50P44-D46 PolarHBondContact O-N 3.36Å; P44-D46 VanDerWaalsContact O-N 3.13Å; D46-V48 VanDerWaalsContact C-N 3.33Å; D46-V48 PolarHBondContact O-N 2.91Å; D46-L49 PolarHBondContact O-N 2.91Å; D46-Q50 WeakPolarHBondContact O-CB 3.37Å; D46-Q50 PolarHBondContact O-N 3.4Å
47I94.2Very high88.4Confident14 Ų1492.8 Ų92.87%0.07249%0.486CS..Hα-helixtrans-66-39177.9-62.1175.1000110.7A26 H29 L43 P44 T51A26-I47 HydrophobicContact CB-CG2 4.02Å; H29-I47 HydrophobicContact CB-CD1 4.39Å; L43-I47 HydrophobicContact CD1-CD1 4.42Å; L43-I47 HydrophobicContact CD2-CB 4.32Å; L43-I47 HydrophobicContact CD2-CG2 3.86Å; L43-I47 HydrophobicContact CG-CB 4.34Å; L43-I47 HydrophobicContact CG-CG2 4.31Å; P44-I47 HydrophobicContact CB-CD1 4.33Å; P44-I47 HydrophobicContact CB-CG1 4.36Å; P44-I47 HydrophobicContact CG-CD1 4.06Å; P44-I47 PolarHBondContact O-N 3.41Å; I47-T51 WeakPolarHBondContact O-CB 3.39Å; I47-T51 WeakPolarHBondContact O-CG2 3.4Å; I47-T51 PolarHBondContact O-N 3.32Å; I47-T51 PolarHBondContact O-OG1 2.99Å
48V94.7Very high89.3Confident62 Ų6284.7 Ų84.738%0.37645%0.449SS..Hα-helixtrans-64.8-43.9176.8178.40000110.7L43 P44 V45 D46 T51 L52L43-V48 HydrophobicContact CB-CG2 4.3Å; L43-V48 HydrophobicContact CD2-CG2 4.06Å; L43-V48 HydrophobicContact CG-CG2 4.46Å; P44-V48 PolarHBondContact O-N 2.9Å; V45-V48 PolarHBondContact O-N 2.92Å; D46-V48 VanDerWaalsContact C-N 3.33Å; D46-V48 PolarHBondContact O-N 2.91Å; V48-T51 WeakPolarHBondContact CA-OG1 3.39Å; V48-T51 PolarHBondContact O-OG1 3.26Å; V48-L52 HydrophobicContact CG1-CD1 4.14Å; V48-L52 WeakPolarHBondContact O-CB 3.36Å; V48-L52 PolarHBondContact O-N 3.36Å
49L95.8Very high90.3Very high95 Ų9583.1 Ų83.150%0.49745%0.445SS..Hα-helixtrans-67.5-43.3178.3-172.262.1000111.3V45 D46 T51 L52 L53V45-L49 WeakPolarHBondContact O-CB 3.39Å; V45-L49 PolarHBondContact O-N 3.18Å; D46-L49 PolarHBondContact O-N 2.91Å; L49-T51 PolarHBondContact O-N 3.43Å; L49-L52 PolarHBondContact O-N 3.31Å; L49-L53 HydrophobicContact CD1-CD1 4.31Å; L49-L53 HydrophobicContact CD1-CG 4.32Å; L49-L53 HydrophobicContact CG-CD1 3.99Å; L49-L53 HydrophobicContact CG-CG 4.41Å; L49-L53 WeakPolarHBondContact O-CB 3.48Å; L49-L53 VanDerWaalsContact O-CG 3.27Å; L49-L53 WeakPolarHBondContact O-CG 3.39Å; L49-L53 PolarHBondContact O-N 2.91Å
50Q95.9Very high91.7Very high57 Ų5782 Ų8227%0.26644%0.435SS..Hα-helixtrans-61.6-43.9177.1-175.5173.8-11.600111.8H21 A22 D46 A54H21-Q50 PolarHBondContact ND1-NE2 3.45Å; A22-Q50 HydrophobicContact CB-CB 4.38Å; A22-Q50 HydrophobicContact CB-CG 4Å; D46-Q50 WeakPolarHBondContact O-CB 3.37Å; D46-Q50 PolarHBondContact O-N 3.4Å; Q50-A54 WeakPolarHBondContact O-CB 3.5Å; Q50-A54 PolarHBondContact O-N 3.3Å
51T96.9Very high93.2Very high43 Ų4374.4 Ų74.426%0.26440%0.395SS..Hα-helixtrans-63.2-45.5176.241.50000112L19 A22 I47 V48 L49 A54 F55L19-T51 HydrophobicContact CD1-CG2 4.38Å; A22-T51 HydrophobicContact CB-CG2 3.43Å; A22-T51 VanDerWaalsContact CB-CG2 3.43Å; I47-T51 WeakPolarHBondContact O-CB 3.39Å; I47-T51 WeakPolarHBondContact O-CG2 3.4Å; I47-T51 PolarHBondContact O-N 3.32Å; I47-T51 PolarHBondContact O-OG1 2.99Å; V48-T51 WeakPolarHBondContact CA-OG1 3.39Å; V48-T51 PolarHBondContact O-OG1 3.26Å; L49-T51 PolarHBondContact O-N 3.43Å; T51-A54 PolarHBondContact O-N 3.5Å; T51-F55 VanDerWaalsContact O-CB 3.24Å; T51-F55 WeakPolarHBondContact O-CB 3.4Å; T51-F55 PolarHBondContact O-N 2.96Å
52L97.6Very high94Very high98 Ų9873.3 Ų73.351%0.51339%0.392SS..Hα-helixtrans-60.9-47177.2-91.6161.5000112.3V48 L49 F55 V56V48-L52 HydrophobicContact CG1-CD1 4.14Å; V48-L52 WeakPolarHBondContact O-CB 3.36Å; V48-L52 PolarHBondContact O-N 3.36Å; L49-L52 PolarHBondContact O-N 3.31Å; L52-F55 PolarHBondContact O-N 3.17Å; L52-V56 WeakPolarHBondContact O-CG2 3.32Å; L52-V56 PolarHBondContact O-N 3.35Å
53L96.9Very high94.5Very high109 Ų10971.8 Ų71.857%0.57138%0.382SS*.Hα-helixtrans-64.5-45178.9-69.6174.8000111.6L49 F55 V56 L57L49-L53 HydrophobicContact CD1-CD1 4.31Å; L49-L53 HydrophobicContact CD1-CG 4.32Å; L49-L53 HydrophobicContact CG-CD1 3.99Å; L49-L53 HydrophobicContact CG-CG 4.41Å; L49-L53 WeakPolarHBondContact O-CB 3.48Å; L49-L53 VanDerWaalsContact O-CG 3.27Å; L49-L53 WeakPolarHBondContact O-CG 3.39Å; L49-L53 PolarHBondContact O-N 2.91Å; L53-F55 VanDerWaalsContact C-N 3.29Å; L53-F55 PolarHBondContact O-N 3.41Å; L53-V56 PolarHBondContact O-N 3.12Å; L53-L57 VanDerWaalsContact O-CB 3.3Å; L53-L57 WeakPolarHBondContact O-CB 3.48Å; L53-L57 PolarHBondContact O-N 3.44Å
54A97.2Very high94.8Very high5 Ų571.7 Ų71.74%0.04138%0.379CS..Hα-helixtrans-61.9-38.4176.500000111.9A18 L19 Q50 T51 T58A18-A54 HydrophobicContact CB-CB 3.85Å; L19-A54 HydrophobicContact CB-CB 4.15Å; L19-A54 HydrophobicContact CD1-CB 4.27Å; Q50-A54 WeakPolarHBondContact O-CB 3.5Å; Q50-A54 PolarHBondContact O-N 3.3Å; T51-A54 PolarHBondContact O-N 3.5Å; A54-T58 WeakPolarHBondContact O-CB 3.38Å; A54-T58 PolarHBondContact O-N 3.34Å; A54-T58 PolarHBondContact O-OG1 3.22Å
55F96.9Very high94.8Very high114 Ų11472.5 Ų72.550%0.538%0.38SS..Hα-helixtrans-65.6-50.3177.4-178.4-117.3000112.2T51 L52 L53 L57 T58 I59T51-F55 VanDerWaalsContact O-CB 3.24Å; T51-F55 WeakPolarHBondContact O-CB 3.4Å; T51-F55 PolarHBondContact O-N 2.96Å; L52-F55 PolarHBondContact O-N 3.17Å; L53-F55 VanDerWaalsContact C-N 3.29Å; L53-F55 PolarHBondContact O-N 3.41Å; F55-L57 VanDerWaalsContact C-N 3.33Å; F55-L57 PolarHBondContact O-N 3.34Å; F55-T58 PolarHBondContact O-N 3.25Å; F55-I59 HydrophobicContact CD1-CD1 3.84Å; F55-I59 HydrophobicContact CD2-CD1 4.25Å; F55-I59 HydrophobicContact CE1-CD1 3.38Å; F55-I59 HydrophobicContact CE2-CD1 3.83Å; F55-I59 HydrophobicContact CE2-CG1 4.31Å; F55-I59 HydrophobicContact CG-CD1 4.26Å; F55-I59 HydrophobicContact CZ-CD1 3.4Å; F55-I59 HydrophobicContact CZ-CG1 4.33Å; F55-I59 PolarHBondContact O-N 2.96Å
56V97.2Very high94.5Very high90 Ų9070.8 Ų70.855%0.54538%0.379SS..Hα-helixtrans-60.2-44.1177.5171.80000111L52 L53 T58 I59 Y60L52-V56 WeakPolarHBondContact O-CG2 3.32Å; L52-V56 PolarHBondContact O-N 3.35Å; L53-V56 PolarHBondContact O-N 3.12Å; V56-T58 VanDerWaalsContact C-N 3.3Å; V56-T58 PolarHBondContact O-N 3.49Å; V56-I59 PolarHBondContact O-N 2.93Å; V56-Y60 VanDerWaalsContact O-CB 3.29Å; V56-Y60 WeakPolarHBondContact O-CB 3.27Å; V56-Y60 PolarHBondContact O-N 2.98Å
57L95.8Very high94Very high69 Ų6967.5 Ų67.536%0.36137%0.372SS..Hα-helixtrans-59.9-42.1177.3-17467.7000111.8V11 L53 F55 Y60 G61V11-L57 HydrophobicContact CG1-CD1 3.71Å; V11-L57 HydrophobicContact CG1-CD2 4.5Å; V11-L57 HydrophobicContact CG1-CG 3.89Å; L53-L57 VanDerWaalsContact O-CB 3.3Å; L53-L57 WeakPolarHBondContact O-CB 3.48Å; L53-L57 PolarHBondContact O-N 3.44Å; F55-L57 VanDerWaalsContact C-N 3.33Å; F55-L57 PolarHBondContact O-N 3.34Å; L57-Y60 PolarHBondContact O-N 3.3Å; L57-G61 PolarHBondContact O-N 2.98Å
58T96.5Very high93.6Very high11 Ų1174.6 Ų74.67%0.06741%0.405CS..Hα-helixtrans-66.4-46.5179.6-57.20000111.3V12 G15 L16 A54 F55 V56 Y60 G61 I62V12-T58 HydrophobicContact CG1-CG2 4.44Å; G15-T58 VanDerWaalsContact C-OG1 3.31Å; G15-T58 WeakPolarHBondContact CA-OG1 3.44Å; L16-T58 HydrophobicContact CD2-CG2 3.99Å; L16-T58 HydrophobicContact CG-CG2 4.28Å; A54-T58 WeakPolarHBondContact O-CB 3.38Å; A54-T58 PolarHBondContact O-N 3.34Å; A54-T58 PolarHBondContact O-OG1 3.22Å; F55-T58 PolarHBondContact O-N 3.25Å; V56-T58 VanDerWaalsContact C-N 3.3Å; V56-T58 PolarHBondContact O-N 3.49Å; T58-Y60 VanDerWaalsContact C-N 3.32Å; T58-Y60 PolarHBondContact O-N 2.97Å; T58-G61 PolarHBondContact O-N 3.4Å; T58-I62 HydrophobicContact CG2-CD1 3.81Å; T58-I62 HydrophobicContact CG2-CG1 4.49Å; T58-I62 VanDerWaalsContact O-CG1 3.27Å; T58-I62 WeakPolarHBondContact O-CG1 3.4Å; T58-I62 PolarHBondContact O-N 2.96Å
59I95.9Very high93.1Very high77 Ų7781.6 Ų81.640%0.39543%0.431SS..Hα-helixtrans-58-48.2175.2-70.6169000110.2F55 V56 G61 I62 V63F55-I59 HydrophobicContact CD1-CD1 3.84Å; F55-I59 HydrophobicContact CD2-CD1 4.25Å; F55-I59 HydrophobicContact CE1-CD1 3.38Å; F55-I59 HydrophobicContact CE2-CD1 3.83Å; F55-I59 HydrophobicContact CE2-CG1 4.31Å; F55-I59 HydrophobicContact CG-CD1 4.26Å; F55-I59 HydrophobicContact CZ-CD1 3.4Å; F55-I59 HydrophobicContact CZ-CG1 4.33Å; F55-I59 PolarHBondContact O-N 2.96Å; V56-I59 PolarHBondContact O-N 2.93Å; I59-G61 VanDerWaalsContact C-N 3.31Å; I59-G61 PolarHBondContact O-N 3.2Å; I59-I62 PolarHBondContact O-N 3.47Å; I59-V63 HydrophobicContact CG2-CG2 4.36Å; I59-V63 WeakPolarHBondContact O-CG2 3.47Å; I59-V63 PolarHBondContact O-N 3.06Å
60Y94.3Very high92.4Very high126 Ų12684 Ų8449%0.49444%0.437SS..Hα-helixtrans-60.1-42.2-178.1-172.3-107.2000112W8 V56 L57 T58 H64W8-Y60 HydrophobicContact CH2-CD1 4.15Å; W8-Y60 AromaticContact CH2-CE1 3.46Å; W8-Y60 HydrophobicContact CH2-CE1 3.46Å; W8-Y60 VanDerWaalsContact CH2-CE1 3.46Å; W8-Y60 AromaticContact CZ3-CD1 3.72Å; W8-Y60 HydrophobicContact CZ3-CD1 3.72Å; W8-Y60 AromaticContact CZ3-CE1 3.52Å; W8-Y60 HydrophobicContact CZ3-CE1 3.52Å; V56-Y60 VanDerWaalsContact O-CB 3.29Å; V56-Y60 WeakPolarHBondContact O-CB 3.27Å; V56-Y60 PolarHBondContact O-N 2.98Å; L57-Y60 PolarHBondContact O-N 3.3Å; T58-Y60 VanDerWaalsContact C-N 3.32Å; T58-Y60 PolarHBondContact O-N 2.97Å; Y60-H64 AromaticContact CE1-CE1 3.91Å; Y60-H64 AromaticContact CE2-CE1 3.47Å; Y60-H64 VanDerWaalsContact CE2-CE1 3.47Å; Y60-H64 WeakPolarHBondContact CE2-CE1 3.36Å; Y60-H64 AromaticContact CZ-CE1 3.39Å; Y60-H64 PolarHBondContact O-N 3.44Å; Y60-H64 PolarHBondContact O-ND1 3.31Å
61G93.5Very high91.7Very high0 Ų087.9 Ų87.90%046%0.455CS..Hα-helixtrans-65-42.7174.700000113.2V12 L57 T58 I59 V63 H64 I65V12-G61 VanDerWaalsContact CG2-C 3.45Å; L57-G61 PolarHBondContact O-N 2.98Å; T58-G61 PolarHBondContact O-N 3.4Å; I59-G61 VanDerWaalsContact C-N 3.31Å; I59-G61 PolarHBondContact O-N 3.2Å; G61-V63 PolarHBondContact O-N 2.97Å; G61-H64 PolarHBondContact O-N 2.94Å; G61-I65 WeakPolarHBondContact O-CG1 3.13Å; G61-I65 PolarHBondContact O-N 3.49Å; G61-I65 VanDerWaalsContact O-N 3.17Å
62I93.5Very high90.9Very high91 Ų9195 Ų9547%0.46749%0.488SS..Hα-helixtrans-64.1-42.8-179.5-69.2165.8000111.3V12 T58 I59 H64 I65 A66V12-I62 HydrophobicContact CG1-CG1 4.26Å; V12-I62 HydrophobicContact CG2-CG1 3.94Å; T58-I62 HydrophobicContact CG2-CD1 3.81Å; T58-I62 HydrophobicContact CG2-CG1 4.49Å; T58-I62 VanDerWaalsContact O-CG1 3.27Å; T58-I62 WeakPolarHBondContact O-CG1 3.4Å; T58-I62 PolarHBondContact O-N 2.96Å; I59-I62 PolarHBondContact O-N 3.47Å; I62-H64 PolarHBondContact O-N 3.18Å; I62-I65 PolarHBondContact O-N 2.72Å; I62-A66 PolarHBondContact O-N 3.47Å
63V93.2Very high90.2Very high92 Ų9294.3 Ų94.356%0.55849%0.485SS*.Hα-helixtrans-57.8-40.1178.3170.70000111.2I59 G61 I65 A66I59-V63 HydrophobicContact CG2-CG2 4.36Å; I59-V63 WeakPolarHBondContact O-CG2 3.47Å; I59-V63 PolarHBondContact O-N 3.06Å; G61-V63 PolarHBondContact O-N 2.97Å; V63-I65 VanDerWaalsContact C-N 3.31Å; V63-I65 PolarHBondContact O-N 3.3Å; V63-A66 PolarHBondContact O-N 3.42Å
64H90.3Very high89.2Confident67 Ų6792.7 Ų92.731%0.3149%0.487SS..Hα-helixtrans-75.7-16.9177.4-71.880.8000113.9W8 Y60 G61 I62W8-H64 HydrophobicContact CB-CB 4.43Å; W8-H64 HydrophobicContact CD2-CB 3.55Å; W8-H64 AromaticContact CD2-CG 4Å; W8-H64 AromaticContact CE2-CD2 3.76Å; W8-H64 AromaticContact CE2-CG 3.73Å; W8-H64 HydrophobicContact CE3-CB 4.02Å; W8-H64 HydrophobicContact CG-CB 3.73Å; W8-H64 HydrophobicContact CZ2-CB 4.19Å; W8-H64 AromaticContact CZ2-CD2 3.53Å; W8-H64 AromaticContact CZ2-CG 3.75Å; W8-H64 AromaticContact CZ2-NE2 3.98Å; Y60-H64 AromaticContact CE1-CE1 3.91Å; Y60-H64 AromaticContact CE2-CE1 3.47Å; Y60-H64 VanDerWaalsContact CE2-CE1 3.47Å; Y60-H64 WeakPolarHBondContact CE2-CE1 3.36Å; Y60-H64 AromaticContact CZ-CE1 3.39Å; Y60-H64 PolarHBondContact O-N 3.44Å; Y60-H64 PolarHBondContact O-ND1 3.31Å; G61-H64 PolarHBondContact O-N 2.94Å; I62-H64 PolarHBondContact O-N 3.18Å
65I89.8Confident88.1Confident66 Ų6695.4 Ų95.434%0.33851%0.506SS..Hα-helixtrans-85.5-29173.3-66.3167.5000111.3W8 K9 V12 G61 I62 V63 G67W8-I65 HydrophobicContact CB-CD1 4.34Å; W8-I65 HydrophobicContact CB-CG1 3.77Å; K9-I65 HydrophobicContact CB-CD1 4.49Å; K9-I65 HydrophobicContact CG-CD1 3.89Å; K9-I65 HydrophobicContact CG-CG1 4.34Å; V12-I65 HydrophobicContact CB-CD1 4.26Å; V12-I65 HydrophobicContact CG2-CD1 3.59Å; G61-I65 WeakPolarHBondContact O-CG1 3.13Å; G61-I65 PolarHBondContact O-N 3.49Å; G61-I65 VanDerWaalsContact O-N 3.17Å; I62-I65 PolarHBondContact O-N 2.72Å; V63-I65 VanDerWaalsContact C-N 3.31Å; V63-I65 PolarHBondContact O-N 3.3Å; I65-G67 PolarHBondContact O-N 3.37Å
66A86.1Confident86.9Confident86 Ų8691.1 Ų91.171%0.71149%0.49SS*.SBendtrans-59-17.1-175.200000113.7I62 V63I62-A66 PolarHBondContact O-N 3.47Å; V63-A66 PolarHBondContact O-N 3.42Å
67G81.7Confident85.8Confident45 Ų4591.7 Ų91.746%0.46449%0.487SS..  trans100.2163.7173.300000112.2I65I65-G67 PolarHBondContact O-N 3.37Å
68E85.1Confident84.7Confident164 Ų16493 Ų9377%0.76649%0.494SS*.PPolyproline II helixtrans-79.1143.6179.4-63.5-60.9147.700110.6K70E68-K70 PolarHBondContact O-N 3.29Å
69F84.5Confident83.6Confident208 Ų208100.6 Ų100.691%0.91253%0.526SS*.PPolyproline II helixtrans-66.2134.3171.3-65.3-74.6000109.8
70K81.1Confident82.7Confident145 Ų145103.8 Ų103.863%0.6354%0.544SS*.PPolyproline II helixtrans-94.6141.7173.6-173.3-179.9174.2-169.60109.5E68 E77E68-K70 PolarHBondContact O-N 3.29Å; K70-E77 WeakPolarHBondContact CE-OE1 3.27Å; K70-E77 WeakPolarHBondContact CE-OE2 3.04Å; K70-E77 IonicContact NZ-OE1 2.66Å; K70-E77 PolarHBondContact NZ-OE1 3.46Å; K70-E77 IonicContact NZ-OE2 2.79Å; K70-E77 PolarHBondContact NZ-OE2 3.23Å
71E82.1Confident82Confident139 Ų139103.5 Ų103.565%0.6555%0.545SS*.PPolyproline II helixtrans-58140174.4-65.8-179.8176.300111.5S76E71-S76 WeakPolarHBondContact OE2-CB 3.18Å; E71-S76 PolarHBondContact OE2-OG 2.83Å
72M79.4Confident81.5Confident192 Ų192107.7 Ų107.795%0.94657%0.57SS**SBendtrans-81.1-18.4179-174166.763.700112.9A74M72-A74 PolarHBondContact O-N 2.92Å
73D83.3Confident80.9Confident84 Ų84110 Ų11045%0.44958%0.577SS.*  trans-72.9109.8-179.2-17711.8000111S75 S76D73-S75 PolarHBondContact O-N 3.46Å; D73-S75 VanDerWaalsContact O-N 3.14Å; D73-S75 WeakPolarHBondContact OD1-CB 3.31Å; D73-S75 PolarHBondContact OD1-N 3.19Å; D73-S75 PolarHBondContact OD1-OG 2.97Å; D73-S76 PolarHBondContact O-N 3.02Å; D73-S76 VanDerWaalsContact O-N 3.1Å; D73-S76 PolarHBondContact O-OG 3.5Å
74A75.1Confident80.2Confident75 Ų75111.4 Ų111.462%0.6258%0.582SS**Hα-helixtrans-60.5-24.2176.600000112.7M72 S76 L78M72-A74 PolarHBondContact O-N 2.92Å; A74-S76 VanDerWaalsContact C-N 3.3Å; A74-S76 PolarHBondContact O-N 3.14Å; A74-L78 PolarHBondContact O-N 3.5Å
75S74.6Confident79.9Confident62 Ų62112.7 Ų112.743%0.43459%0.594SS.*Hα-helixtrans-69.2-28.2178.8-40.50000111.9D73 L78 K79D73-S75 PolarHBondContact O-N 3.46Å; D73-S75 VanDerWaalsContact O-N 3.14Å; D73-S75 WeakPolarHBondContact OD1-CB 3.31Å; D73-S75 PolarHBondContact OD1-N 3.19Å; D73-S75 PolarHBondContact OD1-OG 2.97Å; S75-L78 PolarHBondContact O-N 3.1Å; S75-K79 VanDerWaalsContact O-CG 3.31Å; S75-K79 WeakPolarHBondContact O-CG 3.33Å; S75-K79 PolarHBondContact O-N 3.3Å
76S72.6Confident79.5Confident24 Ų24113.7 Ų113.717%0.16860%0.6CS.*Hα-helixtrans-72.2-34.7-17976.20000112.4E71 D73 A74 N80E71-S76 WeakPolarHBondContact OE2-CB 3.18Å; E71-S76 PolarHBondContact OE2-OG 2.83Å; D73-S76 PolarHBondContact O-N 3.02Å; D73-S76 VanDerWaalsContact O-N 3.1Å; D73-S76 PolarHBondContact O-OG 3.5Å; A74-S76 VanDerWaalsContact C-N 3.3Å; A74-S76 PolarHBondContact O-N 3.14Å; S76-N80 PolarHBondContact O-ND2 2.79Å
77E73.5Confident79.3Confident102 Ų102118.3 Ų118.348%0.47760%0.599SS.*Hα-helixtrans-69.5-35.2169.8-68-158.3101.500112.6K70 N80K70-E77 WeakPolarHBondContact CE-OE1 3.27Å; K70-E77 WeakPolarHBondContact CE-OE2 3.04Å; K70-E77 IonicContact NZ-OE1 2.66Å; K70-E77 PolarHBondContact NZ-OE1 3.46Å; K70-E77 IonicContact NZ-OE2 2.79Å; K70-E77 PolarHBondContact NZ-OE2 3.23Å; E77-N80 PolarHBondContact O-N 2.66Å
78L73.5Confident79.6Confident98 Ų98119.8 Ų119.851%0.51360%0.596SS.*Hα-helixtrans-75-29.3-177.3-154.167.3000112.4A74 S75 N80 K81A74-L78 PolarHBondContact O-N 3.5Å; S75-L78 PolarHBondContact O-N 3.1Å; L78-N80 PolarHBondContact O-N 3.31Å; L78-K81 HydrophobicContact CD1-CD 4.17Å; L78-K81 PolarHBondContact O-N 3.01Å
79K73.1Confident79.7Confident170 Ų170117.4 Ų117.474%0.73959%0.585SS**Hα-helixtrans-57.1-31.2173.8-80.5173.5-174.9-179.30113.4S75 K81S75-K79 VanDerWaalsContact O-CG 3.31Å; S75-K79 WeakPolarHBondContact O-CG 3.33Å; S75-K79 PolarHBondContact O-N 3.3Å; K79-K81 VanDerWaalsContact C-N 3.34Å
80N77.4Confident79.8Confident144 Ų144111.5 Ų111.577%0.7757%0.568SS**THydrogen-bonded Turntrans-85.7-3.1178.7-70.9-56.2000113.6S76 E77 L78S76-N80 PolarHBondContact O-ND2 2.79Å; E77-N80 PolarHBondContact O-N 2.66Å; L78-N80 PolarHBondContact O-N 3.31Å
81K78.8Confident80.1Confident120 Ų120110 Ų11052%0.52258%0.575SS.*  trans-98.1122.4177.9-74.3-179.6173.5176.20110.6L78 K79L78-K81 HydrophobicContact CD1-CD 4.17Å; L78-K81 PolarHBondContact O-N 3.01Å; K79-K81 VanDerWaalsContact C-N 3.34Å
82T82.5Confident80.5Confident87 Ų87111.3 Ų111.353%0.53458%0.579SS.*  trans-79.5152.4175-52.80000111D84 T85 L86T82-D84 HydrophobicContact CG2-CB 4.4Å; T82-D84 PolarHBondContact O-N 3.01Å; T82-D84 VanDerWaalsContact O-N 3.15Å; T82-T85 PolarHBondContact O-N 3.15Å; T82-L86 PolarHBondContact O-N 3.37Å
83F80.9Confident80.8Confident140 Ų140107.5 Ų107.561%0.61456%0.555SS**Hα-helixtrans-53.7-32.5175.4-172.9-104.8000113.2T85 L86 R87F83-T85 VanDerWaalsContact C-N 3.33Å; F83-T85 PolarHBondContact O-N 2.85Å; F83-L86 PolarHBondContact O-N 3.41Å; F83-R87 HydrophobicContact CE1-CB 4.31Å; F83-R87 WeakPolarHBondContact O-CB 3.33Å; F83-R87 PolarHBondContact O-N 3.18Å
84D78.9Confident80.8Confident122 Ų122111 Ų11165%0.65257%0.571SS**Hα-helixtrans-61.9-37.2176.3-71-25000113.1T82 N88T82-D84 HydrophobicContact CG2-CB 4.4Å; T82-D84 PolarHBondContact O-N 3.01Å; T82-D84 VanDerWaalsContact O-N 3.15Å; D84-N88 PolarHBondContact O-N 3.47Å
85T83.4Confident81.3Confident93 Ų93114.9 Ų114.957%0.57157%0.574SS**Hα-helixtrans-72.6-31.9176.5-43.10000111.7T82 F83T82-T85 PolarHBondContact O-N 3.15Å; F83-T85 VanDerWaalsContact C-N 3.33Å; F83-T85 PolarHBondContact O-N 2.85Å
86L81.1Confident81.6Confident87 Ų87116.8 Ų116.846%0.45558%0.579SS.*Hα-helixtrans-78-38.9178.6-66.6177.8000112.8T82 F83 N88T82-L86 PolarHBondContact O-N 3.37Å; F83-L86 PolarHBondContact O-N 3.41Å; L86-N88 PolarHBondContact O-N 2.8Å
87R83.8Confident82.2Confident183 Ų183121 Ų12169%0.69160%0.596SS**Hα-helixtrans-67.1-23.3179.6-179.6174.8-179.5156.84112.6F83 H89F83-R87 HydrophobicContact CE1-CB 4.31Å; F83-R87 WeakPolarHBondContact O-CB 3.33Å; F83-R87 PolarHBondContact O-N 3.18Å; R87-H89 PolarHBondContact O-N 3.31Å
88N86.4Confident82.6Confident76 Ų76126.4 Ų126.441%0.40661%0.612SS.*  trans-70.797.3177.6-178.469.6000110.8D84 L86 P90 Y93D84-N88 PolarHBondContact O-N 3.47Å; L86-N88 PolarHBondContact O-N 2.8Å; N88-P90 WeakPolarHBondContact O-CD 3.36Å; N88-Y93 PolarHBondContact ND2-OH 3.06Å; N88-Y93 WeakPolarHBondContact OD1-CE1 3.07Å; N88-Y93 PolarHBondContact OD1-OH 3.2Å
89H87Confident83.1Confident115 Ų115122.3 Ų122.353%0.53259%0.593SS.*  trans-98.1104.5173.9-77.3-78.9000111.2R87 S91 F92 Y93R87-H89 PolarHBondContact O-N 3.31Å; H89-S91 PolarHBondContact O-N 3.02Å; H89-F92 HydrophobicContact CB-CB 4.42Å; H89-F92 HydrophobicContact CB-CD2 3.96Å; H89-F92 PolarHBondContact O-N 3.2Å; H89-Y93 WeakPolarHBondContact O-CD1 3.34Å
90P86.4Confident83.4Confident84 Ų84119.8 Ų119.855%0.54558%0.579SS.*G310 helixtrans-60.4-32.5-176-23.835.1000113.4N88 F92 Y93N88-P90 WeakPolarHBondContact O-CD 3.36Å; P90-F92 PolarHBondContact O-N 2.56Å; P90-Y93 HydrophobicContact CB-CE2 4.17Å; P90-Y93 PolarHBondContact O-N 3.24Å
91S87.9Confident83.7Confident114 Ų114117.9 Ų117.980%0.79757%0.573SS**G310 helixtrans-65.6-18.9178.3-50.80000113.9H89H89-S91 PolarHBondContact O-N 3.02Å
92F90Very high83.9Confident166 Ų166118.3 Ų118.373%0.72858%0.58SS**G310 helixtrans-116.324.2-177.3-64-70.2000112.7H89 P90 M94H89-F92 HydrophobicContact CB-CB 4.42Å; H89-F92 HydrophobicContact CB-CD2 3.96Å; H89-F92 PolarHBondContact O-N 3.2Å; P90-F92 PolarHBondContact O-N 2.56Å; F92-M94 PolarHBondContact O-N 3.42Å
93Y86.6Confident83.8Confident111 Ų111122.7 Ų122.744%0.43559%0.592SS.*  trans-64.2120.5176.4-75.9-11.7000112.4N88 H89 P90N88-Y93 PolarHBondContact ND2-OH 3.06Å; N88-Y93 WeakPolarHBondContact OD1-CE1 3.07Å; N88-Y93 PolarHBondContact OD1-OH 3.2Å; H89-Y93 WeakPolarHBondContact O-CD1 3.34Å; P90-Y93 HydrophobicContact CB-CE2 4.17Å; P90-Y93 PolarHBondContact O-N 3.24Å
94M83.9Confident83.7Confident159 Ų159122 Ų12278%0.78359%0.585SS**  trans-103.8116.8168.8-66.9-176.168.700109.2F92 N96F92-M94 PolarHBondContact O-N 3.42Å; M94-N96 PolarHBondContact O-N 3.03Å
95F84Confident83.4Confident155 Ų155119.1 Ų119.168%0.6858%0.575SS**  trans-80.5-2.4-178.9-58.7-73.5000113.7H97F95-H97 VanDerWaalsContact C-N 3.33Å; F95-H97 PolarHBondContact O-N 3.34Å; F95-H97 PolarHBondContact O-ND1 3.13Å
96N82.1Confident82.7Confident102 Ų102119.9 Ų119.955%0.54558%0.581SS.*  trans-84.672.3175.7-168.621.9000111.9M94M94-N96 PolarHBondContact O-N 3.03Å
97H84.3Confident81.8Confident112 Ų112122.1 Ų122.152%0.51959%0.593SS.*SBendtrans-130.8167.4-179.567.9-58.2000110.8F95 G99 R100F95-H97 VanDerWaalsContact C-N 3.33Å; F95-H97 PolarHBondContact O-N 3.34Å; F95-H97 PolarHBondContact O-ND1 3.13Å; H97-G99 PolarHBondContact O-N 3.14Å; H97-G99 VanDerWaalsContact O-N 3.14Å; H97-R100 VanDerWaalsContact O-CB 3.3Å; H97-R100 WeakPolarHBondContact O-CB 3.3Å; H97-R100 PolarHBondContact O-N 3.41Å
98R81.8Confident80.6Confident217 Ų217117.8 Ų117.882%0.81958%0.581SS**THydrogen-bonded Turntrans-59-27.7-176.2-64.9-177178.3-168.6-0.6113.3R100 V101 L102R98-R100 PolarHBondContact O-N 3.19Å; R98-V101 PolarHBondContact O-N 3.2Å; R98-V101 VanDerWaalsContact O-N 3.13Å; R98-L102 HydrophobicContact CB-CD1 4.22Å; R98-L102 WeakPolarHBondContact O-CG 3.43Å; R98-L102 PolarHBondContact O-N 3.06Å
99G84.3Confident79.1Confident12 Ų12122 Ų12212%0.12460%0.598CS.*Hα-helixtrans-58.9-27.4176.200000113.8H97 V101 L102 F103H97-G99 PolarHBondContact O-N 3.14Å; H97-G99 VanDerWaalsContact O-N 3.14Å; G99-V101 PolarHBondContact O-N 2.95Å; G99-L102 PolarHBondContact O-N 3.23Å; G99-F103 PolarHBondContact O-N 3.06Å
100R80.8Confident77.5Confident117 Ų117121.4 Ų121.444%0.44261%0.613SS.*Hα-helixtrans-60.3-29.7176.3-172.4178.965.376.5-1.3113.6H97 R98H97-R100 VanDerWaalsContact O-CB 3.3Å; H97-R100 WeakPolarHBondContact O-CB 3.3Å; H97-R100 PolarHBondContact O-N 3.41Å; R98-R100 PolarHBondContact O-N 3.19Å
101V82.1Confident75.9Confident104 Ų104121.5 Ų121.563%0.6362%0.616SS**Hα-helixtrans-98.5-35.9-179.8-177.70000110.6R98 G99R98-V101 PolarHBondContact O-N 3.2Å; R98-V101 VanDerWaalsContact O-N 3.13Å; G99-V101 PolarHBondContact O-N 2.95Å
102L82.8Confident74.4Confident129 Ų129119.2 Ų119.268%0.67560%0.604SS**Hα-helixtrans-75.5-28.2-176.6-65.3172.7000113.8R98 G99R98-L102 HydrophobicContact CB-CD1 4.22Å; R98-L102 WeakPolarHBondContact O-CG 3.43Å; R98-L102 PolarHBondContact O-N 3.06Å; G99-L102 PolarHBondContact O-N 3.23Å
103F81.4Confident72.7Confident178 Ų178116.9 Ų116.978%0.78160%0.603SS**THydrogen-bonded Turntrans-120.424.9-175.3-56.8-70.3000113.2G99G99-F103 PolarHBondContact O-N 3.06Å
104R79.5Confident71.1Confident126 Ų126117 Ų11748%0.47562%0.617SS.*  trans-74.2129.6176.2172.6170-86.7-171.9-11.7110.4Q108R104-Q108 HydrophobicContact CG-CB 4.42Å
105S72.5Confident69.7Low62 Ų62114 Ų11443%0.43461%0.605SS.*  trans-82.5151171.459.40000111.5D107 Q108S105-D107 PolarHBondContact O-N 3.26Å; S105-Q108 WeakPolarHBondContact O-CB 3.47Å; S105-Q108 PolarHBondContact O-N 3.27Å
106P67.2Low68.2Low108 Ų108112.4 Ų112.470%0.70161%0.61SS**G310 helixtrans-58.7-32.9179.7-22.232.4000113.5Q108 E109P106-Q108 PolarHBondContact O-N 3.48Å; P106-Q108 VanDerWaalsContact O-N 3.16Å; P106-E109 PolarHBondContact O-N 2.72Å
107D62Low66.8Low134 Ų134115.8 Ų115.872%0.71762%0.622SS**G310 helixtrans-70-13.6-176.2-48-43000113.6S105 E109S105-D107 PolarHBondContact O-N 3.26Å; D107-E109 VanDerWaalsContact C-N 3.29Å; D107-E109 PolarHBondContact O-N 3.16Å
108Q58.8Low65.4Low92 Ų92113.4 Ų113.443%0.4362%0.622SS.*G310 helixtrans-79.1-11.1-179.9-161.7170.943.200113.2R104 S105 P106R104-Q108 HydrophobicContact CG-CB 4.42Å; S105-Q108 WeakPolarHBondContact O-CB 3.47Å; S105-Q108 PolarHBondContact O-N 3.27Å; P106-Q108 PolarHBondContact O-N 3.48Å; P106-Q108 VanDerWaalsContact O-N 3.16Å
109E56.5Low64Low165 Ų165110.3 Ų110.377%0.77162%0.621SS**SBendtrans-69.8-33.9180-164.8168.4-171.200112.3P106 D107 S111P106-E109 PolarHBondContact O-N 2.72Å; D107-E109 VanDerWaalsContact C-N 3.29Å; D107-E109 PolarHBondContact O-N 3.16Å; E109-S111 PolarHBondContact O-N 3.44Å
110A53.6Low62.7Low102 Ų102113.6 Ų113.684%0.84364%0.64SS**THydrogen-bonded Turntrans-78.6-15-174.900000114.8
111S52.2Low61.7Low86 Ų86112.2 Ų112.260%0.60164%0.641SS**THydrogen-bonded Turntrans-123.817.7-174.847.10000113.3E109 V113E109-S111 PolarHBondContact O-N 3.44Å; S111-V113 PolarHBondContact O-N 3.32Å
112A56.2Low60.6Low67 Ų67111.5 Ų111.555%0.55464%0.639SS**  trans-69.665.1174.200000111.7P114A112-P114 WeakPolarHBondContact O-CD 3.48Å
113V53.6Low59.5Low117 Ų117111.8 Ų111.871%0.70964%0.64SS**  trans-59123.5159.1-178.90000106S111 N115S111-V113 PolarHBondContact O-N 3.32Å; V113-N115 PolarHBondContact O-N 3.37Å
114P53.3Low58.5Low113 Ų113112.3 Ų112.373%0.73464%0.637SS**  trans-54.7116.3172-19.730.1000107.4A112 P116A112-P114 WeakPolarHBondContact O-CD 3.48Å; P114-P116 WeakPolarHBondContact O-CD 3.47Å
115N54.2Low57.6Low97 Ų97110.9 Ų110.952%0.51964%0.639SS.*  trans-60107.8178179.510.5000108.4V113 Q117 A118V113-N115 PolarHBondContact O-N 3.37Å; N115-Q117 PolarHBondContact O-N 2.79Å; N115-Q117 VanDerWaalsContact O-N 3.12Å; N115-Q117 PolarHBondContact OD1-N 3.46Å; N115-A118 PolarHBondContact O-N 3.02Å
116P52.3Low57Low121 Ų121116.9 Ų116.979%0.78665%0.652SS**THydrogen-bonded Turntrans-71.5-8.6-174.129.4-31.9000112.2P114P114-P116 WeakPolarHBondContact O-CD 3.47Å
117Q54.2Low56.6Low172 Ų172119.3 Ų119.380%0.80465%0.651SS**THydrogen-bonded Turntrans-95.6-3.8179.1-63.7168.2-27.100113.4N115 L119N115-Q117 PolarHBondContact O-N 2.79Å; N115-Q117 VanDerWaalsContact O-N 3.12Å; N115-Q117 PolarHBondContact OD1-N 3.46Å; Q117-L119 PolarHBondContact O-N 3.41Å
118A53.7Low56.6Low63 Ų63118.9 Ų118.952%0.52165%0.648SS.*SBendtrans-72.2102.1170.500000108.1N115 P120N115-A118 PolarHBondContact O-N 3.02Å; A118-P120 WeakPolarHBondContact O-CD 3.36Å
119L53.8Low56.7Low152 Ų152122 Ų12280%0.79666%0.663SS**PPolyproline II helixtrans-48.7121.3172.5-170.779.7000107.6Q117 N121Q117-L119 PolarHBondContact O-N 3.41Å; L119-N121 PolarHBondContact O-N 3.1Å; L119-N121 VanDerWaalsContact O-N 3.1Å
120P57.1Low56.8Low81 Ų81122.3 Ų122.353%0.52666%0.664SS.*PPolyproline II helixtrans-56125.5-179.120.3-31000108A118 P122 L125A118-P120 WeakPolarHBondContact O-CD 3.36Å; P120-P122 WeakPolarHBondContact O-CD 3.48Å; P120-L125 HydrophobicContact CB-CD1 3.65Å; P120-L125 HydrophobicContact CG-CD1 3.67Å
121N59.2Low57.1Low87 Ų87124.2 Ų124.247%0.46566%0.659SS.*PPolyproline II helixtrans-47.8121.1178.4-108.3-44.4000107.8L119 L123 R124 L125L119-N121 PolarHBondContact O-N 3.1Å; L119-N121 VanDerWaalsContact O-N 3.1Å; N121-L123 PolarHBondContact O-N 3.21Å; N121-R124 HydrophobicContact CB-CB 4.4Å; N121-R124 HydrophobicContact CB-CG 4.23Å; N121-R124 WeakPolarHBondContact O-CA 3.05Å; N121-R124 WeakPolarHBondContact O-CB 3.44Å; N121-R124 PolarHBondContact O-N 3.23Å; N121-L125 PolarHBondContact O-N 3.05Å
122P58.2Low56.9Low89 Ų89131.9 Ų131.958%0.57869%0.685SS**Hα-helixtrans-60.2-24.4-175.320.9-31.6000111.9P120 R124 L125 R126P120-P122 WeakPolarHBondContact O-CD 3.48Å; P122-R124 VanDerWaalsContact C-N 3.33Å; P122-R124 PolarHBondContact O-N 3Å; P122-L125 PolarHBondContact O-N 3.24Å; P122-R126 PolarHBondContact O-N 3.07Å
123L60.5Low57Low135 Ų135135.1 Ų135.171%0.70769%0.692SS**Hα-helixtrans-65.4-29.8172-63.9175.1000113.9N121 K127N121-L123 PolarHBondContact O-N 3.21Å; L123-K127 PolarHBondContact O-N 3.12Å
124R60.4Low57.1Low190 Ų190136.1 Ų136.172%0.71769%0.691SS**Hα-helixtrans-75.1-38.1174.3-79.1-90.9167.2138.7-7.3111.1N121 P122 K127 L128N121-R124 HydrophobicContact CB-CB 4.4Å; N121-R124 HydrophobicContact CB-CG 4.23Å; N121-R124 WeakPolarHBondContact O-CA 3.05Å; N121-R124 WeakPolarHBondContact O-CB 3.44Å; N121-R124 PolarHBondContact O-N 3.23Å; P122-R124 VanDerWaalsContact C-N 3.33Å; P122-R124 PolarHBondContact O-N 3Å; R124-K127 PolarHBondContact O-N 3.04Å; R124-L128 PolarHBondContact O-N 3.33Å
125L59.5Low57.4Low96 Ų96137.3 Ų137.350%0.50369%0.688SS.*Hα-helixtrans-62.8-46173.3-88.1119.7000111.8P120 N121 P122 K127 L128 E129P120-L125 HydrophobicContact CB-CD1 3.65Å; P120-L125 HydrophobicContact CG-CD1 3.67Å; N121-L125 PolarHBondContact O-N 3.05Å; P122-L125 PolarHBondContact O-N 3.24Å; L125-K127 PolarHBondContact O-N 3.34Å; L125-L128 PolarHBondContact O-N 3.39Å; L125-E129 PolarHBondContact O-N 3.02Å; L125-E129 VanDerWaalsContact O-N 3.07Å
126R61.1Low57.5Low188 Ų188139.7 Ų139.771%0.70970%0.698SS**Hα-helixtrans-61.5-31.1178.3-163.3177-165.8162.14.9113.3P122 L128P122-R126 PolarHBondContact O-N 3.07Å; R126-L128 VanDerWaalsContact C-N 3.34Å
127K59.2Low57.9Low159 Ų159140.9 Ų140.969%0.69169%0.693SS**Hα-helixtrans-74.5-25.3177.2-149.3-165.2-176.8-163.30112.8L123 R124 L125L123-K127 PolarHBondContact O-N 3.12Å; R124-K127 PolarHBondContact O-N 3.04Å; L125-K127 PolarHBondContact O-N 3.34Å
128L60.1Low58.1Low125 Ų125138.8 Ų138.865%0.65469%0.685SS**Hα-helixtrans-82.2-34176.3-73.2164.8000111.6R124 L125 R126 H130 L131R124-L128 PolarHBondContact O-N 3.33Å; L125-L128 PolarHBondContact O-N 3.39Å; R126-L128 VanDerWaalsContact C-N 3.34Å; L128-H130 VanDerWaalsContact C-N 3.26Å; L128-H130 PolarHBondContact O-N 3.4Å; L128-L131 PolarHBondContact O-N 3.16Å; L128-L131 VanDerWaalsContact O-N 3.16Å
129E61.5Low58.4Low156 Ų156144.2 Ų144.273%0.72970%0.697SS**Hα-helixtrans-65.5-30177.1-158.6179.1-179.200112.7L125 L131L125-E129 PolarHBondContact O-N 3.02Å; L125-E129 VanDerWaalsContact O-N 3.07Å; E129-L131 PolarHBondContact O-N 3.39Å
130H59.2Low58.8Low173 Ų173143.6 Ų143.680%0.80169%0.689SS**THydrogen-bonded Turntrans-83.42.7177.4-142.3-64.4000113.8L128L128-H130 VanDerWaalsContact C-N 3.26Å; L128-H130 PolarHBondContact O-N 3.4Å
131L59.8Low58.9Low142 Ų142148.8 Ų148.874%0.74370%0.703SS**THydrogen-bonded Turntrans-109.413-177.1-136.391.8000113.2L128 E129L128-L131 PolarHBondContact O-N 3.16Å; L128-L131 VanDerWaalsContact O-N 3.16Å; E129-L131 PolarHBondContact O-N 3.39Å
132H48.4Very low58.9Low246 Ų246154.5 Ų154.5100%1.13973%0.725SS**  trans-120.50174.6-145-137.4000110.3

Retrieved 132 of 132 residues in 433.6 ms (Link to these results)

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