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Isoform C of 14-3-3 protein zeta AlphaSync

Canonical isoform description: Required in Raf-dependent cell proliferation and photoreceptor differentiation during eye development1. Acts upstream of Raf and downstream of Ras, and is essential for viability2. Acts as a negative regulator of the slo calcium channel via its interaction with slo-binding protein slob3. Inhibits yki activity by restricting its nuclear localization4. Binds to and promotes the activity of phosphoinositide 3-kinase Pi3K68D which converts phosphatidylinositol to phosphatidylinositol-3-phosphate and promotes maturation of early endosomes5.

AlphaFold DB , UniProt , Accession P29310-3 (canonical: P29310), Species DROME (Drosophila melanogaster, Fruit fly), Gene 14-3-3zeta, Length 248 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
1M59.4Low84.8Confident132 Ų13276.5 Ų76.565%0.6540%0.401SS*.  0128.70-162.3150.8-157.200107.3D5 L9 T35M1-D5 HydrophobicContact CE-CB 3.28Å; M1-D5 HydrophobicContact CG-CB 3.49Å; M1-D5 VanDerWaalsContact CG-CB 3.49Å; M1-D5 WeakPolarHBondContact CG-OD2 3.43Å; M1-D5 HydrophobicContact SD-CB 4.24Å; M1-L9 HydrophobicContact CE-CD1 3.22Å; M1-L9 HydrophobicContact CE-CG 3.83Å; M1-L9 HydrophobicContact SD-CD1 3.89Å; M1-T35 HydrophobicContact CB-CG2 3.79Å; M1-T35 HydrophobicContact CG-CG2 3.91Å; M1-T35 HydrophobicContact SD-CG2 3.35Å; M1-T35 WeakPolarHBondContact SD-CG2 3.45Å
2S70.9Confident85.9Confident53 Ų5379.8 Ų79.837%0.37141%0.41SS..  trans-71.8161.4175.881.60000110.1V4 D5 K6S2-V4 PolarHBondContact O-N 2.96Å; S2-V4 WeakPolarHBondContact OG-CB 3.43Å; S2-V4 PolarHBondContact OG-N 3.19Å; S2-D5 PolarHBondContact N-OD2 2.86Å; S2-D5 PolarHBondContact O-N 3.39Å; S2-D5 PolarHBondContact OG-N 2.96Å; S2-D5 PolarHBondContact OG-OD1 3.48Å; S2-D5 PolarHBondContact OG-OD2 3.38Å; S2-K6 PolarHBondContact O-N 2.9Å
3T72Confident86.8Confident110 Ų11073.6 Ų73.668%0.67538%0.378SS*.Hα-helixtrans-59-36.5171.6470000111.5D5 K6 E7T3-D5 VanDerWaalsContact C-N 3.34Å; T3-D5 PolarHBondContact O-N 3.41Å; T3-K6 PolarHBondContact O-N 3.11Å; T3-E7 PolarHBondContact O-N 3.31Å; T3-E7 VanDerWaalsContact O-N 3.08Å
4V73.6Confident87.6Confident80 Ų8071.3 Ų71.349%0.48536%0.364SS..Hα-helixtrans-59.9-44176-179.70000110.8S2 K6 E7 E8S2-V4 PolarHBondContact O-N 2.96Å; S2-V4 WeakPolarHBondContact OG-CB 3.43Å; S2-V4 PolarHBondContact OG-N 3.19Å; V4-K6 VanDerWaalsContact C-N 3.3Å; V4-K6 PolarHBondContact O-N 3.29Å; V4-E7 PolarHBondContact O-N 3.17Å; V4-E8 WeakPolarHBondContact O-CG 3.39Å; V4-E8 PolarHBondContact O-N 3.12Å
5D86.5Confident88.3Confident60 Ų6073.7 Ų73.732%0.32138%0.377SS..Hα-helixtrans-67.2-33.3-179.8-40.1-27.6000111.6M1 S2 T3 L9M1-D5 HydrophobicContact CE-CB 3.28Å; M1-D5 HydrophobicContact CG-CB 3.49Å; M1-D5 VanDerWaalsContact CG-CB 3.49Å; M1-D5 WeakPolarHBondContact CG-OD2 3.43Å; M1-D5 HydrophobicContact SD-CB 4.24Å; S2-D5 PolarHBondContact N-OD2 2.86Å; S2-D5 PolarHBondContact O-N 3.39Å; S2-D5 PolarHBondContact OG-N 2.96Å; S2-D5 PolarHBondContact OG-OD1 3.48Å; S2-D5 PolarHBondContact OG-OD2 3.38Å; T3-D5 VanDerWaalsContact C-N 3.34Å; T3-D5 PolarHBondContact O-N 3.41Å; D5-L9 WeakPolarHBondContact O-CG 3.43Å; D5-L9 PolarHBondContact O-N 2.97Å; D5-L9 VanDerWaalsContact O-N 3.11Å
6K91.7Very high88.9Confident33 Ų3369.4 Ų69.414%0.14336%0.357CS..Hα-helixtrans-65.5-47.2176.1-174.8-176.3178.1-161.10110.5S2 T3 V4 E8 L9 V10 V32 E43S2-K6 PolarHBondContact O-N 2.9Å; T3-K6 PolarHBondContact O-N 3.11Å; V4-K6 VanDerWaalsContact C-N 3.3Å; V4-K6 PolarHBondContact O-N 3.29Å; K6-E8 VanDerWaalsContact C-N 3.34Å; K6-E8 PolarHBondContact O-N 3.44Å; K6-L9 PolarHBondContact O-N 3.28Å; K6-V10 WeakPolarHBondContact O-CG2 3.48Å; K6-V10 PolarHBondContact O-N 3.05Å; K6-V32 HydrophobicContact CD-CG1 4.44Å; K6-V32 HydrophobicContact CG-CG1 4.07Å; K6-E43 VanDerWaalsContact CE-CD 3.44Å; K6-E43 WeakPolarHBondContact CE-OE1 3.47Å; K6-E43 WeakPolarHBondContact CE-OE2 3.46Å; K6-E43 IonicContact NZ-OE1 2.71Å; K6-E43 PolarHBondContact NZ-OE1 2.95Å; K6-E43 IonicContact NZ-OE2 3.17Å; K6-E43 PolarHBondContact NZ-OE2 2.84Å
7E93.3Very high89.5Confident132 Ų13269.4 Ų69.462%0.61735%0.354SS*.Hα-helixtrans-60.3-43.6177.8-72.3174.8-167.900111.4T3 V4 L9 V10 Q11T3-E7 PolarHBondContact O-N 3.31Å; T3-E7 VanDerWaalsContact O-N 3.08Å; V4-E7 PolarHBondContact O-N 3.17Å; E7-L9 VanDerWaalsContact C-N 3.35Å; E7-L9 PolarHBondContact O-N 2.93Å; E7-V10 PolarHBondContact O-N 3.35Å; E7-Q11 WeakPolarHBondContact O-CG 3.32Å; E7-Q11 PolarHBondContact O-N 3.44Å
8E94.9Very high89.9Confident104 Ų10474.3 Ų74.349%0.48638%0.376SS..Hα-helixtrans-60-42.1175.5-75.2-173.2-175.500112.8V4 K6 Q11 K12V4-E8 WeakPolarHBondContact O-CG 3.39Å; V4-E8 PolarHBondContact O-N 3.12Å; K6-E8 VanDerWaalsContact C-N 3.34Å; K6-E8 PolarHBondContact O-N 3.44Å; E8-Q11 PolarHBondContact O-N 3.33Å; E8-K12 WeakPolarHBondContact O-CG 3.42Å; E8-K12 PolarHBondContact O-N 3.44Å
9L96.3Very high90.2Very high20 Ų2074.1 Ų74.111%0.10538%0.382CS..Hα-helixtrans-65.6-41176.5-74178.1000112.4M1 D5 K6 E7 Q11 K12 A13 S31 V32M1-L9 HydrophobicContact CE-CD1 3.22Å; M1-L9 HydrophobicContact CE-CG 3.83Å; M1-L9 HydrophobicContact SD-CD1 3.89Å; D5-L9 WeakPolarHBondContact O-CG 3.43Å; D5-L9 PolarHBondContact O-N 2.97Å; D5-L9 VanDerWaalsContact O-N 3.11Å; K6-L9 PolarHBondContact O-N 3.28Å; E7-L9 VanDerWaalsContact C-N 3.35Å; E7-L9 PolarHBondContact O-N 2.93Å; L9-Q11 VanDerWaalsContact C-N 3.32Å; L9-Q11 PolarHBondContact O-N 2.93Å; L9-K12 WeakPolarHBondContact O-CB 3.47Å; L9-K12 PolarHBondContact O-N 3.3Å; L9-A13 PolarHBondContact O-N 2.71Å; L9-S31 VanDerWaalsContact CD1-CB 3.44Å; L9-V32 HydrophobicContact CB-CG2 3.42Å; L9-V32 VanDerWaalsContact CB-CG2 3.42Å; L9-V32 HydrophobicContact CD1-CG2 3.84Å; L9-V32 HydrophobicContact CG-CG2 4.33Å
10V97.4Very high90.6Very high9 Ų977.7 Ų77.76%0.05540%0.397CS..Hα-helixtrans-63.5-40.7176172.50000110.4K6 E7 A13 K14 V32 E43 L46K6-V10 WeakPolarHBondContact O-CG2 3.48Å; K6-V10 PolarHBondContact O-N 3.05Å; E7-V10 PolarHBondContact O-N 3.35Å; V10-A13 WeakPolarHBondContact O-CB 3.44Å; V10-A13 PolarHBondContact O-N 2.84Å; V10-K14 HydrophobicContact CG1-CD 4.43Å; V10-K14 WeakPolarHBondContact O-CG 3.46Å; V10-K14 PolarHBondContact O-N 2.63Å; V10-V32 HydrophobicContact CG2-CG1 4.3Å; V10-V32 HydrophobicContact CG2-CG2 3.94Å; V10-E43 HydrophobicContact CG2-CG 3.94Å; V10-L46 HydrophobicContact CG1-CD1 3.96Å
11Q97.4Very high90.9Very high108 Ų10880.7 Ų80.751%0.50540%0.403SS..Hα-helixtrans-64.2-40.9174.5-67.5-59.7-21.700112.2E7 E8 L9 A13 K14 L15E7-Q11 WeakPolarHBondContact O-CG 3.32Å; E7-Q11 PolarHBondContact O-N 3.44Å; E8-Q11 PolarHBondContact O-N 3.33Å; L9-Q11 VanDerWaalsContact C-N 3.32Å; L9-Q11 PolarHBondContact O-N 2.93Å; Q11-A13 VanDerWaalsContact C-N 3.32Å; Q11-A13 PolarHBondContact O-N 3.39Å; Q11-K14 PolarHBondContact O-N 3.09Å; Q11-L15 WeakPolarHBondContact O-CG 3.41Å; Q11-L15 PolarHBondContact O-N 3.24Å
12K97.2Very high92.8Very high116 Ų11676.9 Ų76.950%0.50438%0.382SS..Hα-helixtrans-59.9-42.2172.6-74.2172.3-174.1169.80111.7E8 L9 L15 A16 A28E8-K12 WeakPolarHBondContact O-CG 3.42Å; E8-K12 PolarHBondContact O-N 3.44Å; L9-K12 WeakPolarHBondContact O-CB 3.47Å; L9-K12 PolarHBondContact O-N 3.3Å; K12-L15 PolarHBondContact O-N 3.16Å; K12-A16 WeakPolarHBondContact O-CB 3.48Å; K12-A16 PolarHBondContact O-N 3.34Å; K12-A28 HydrophobicContact CB-CB 4.43Å
13A98.1Very high94.1Very high0 Ų078 Ų780%038%0.384CS..Hα-helixtrans-62.3-41.9176.200000112L9 V10 Q11 A16 E17 M25 A28 M29L9-A13 PolarHBondContact O-N 2.71Å; V10-A13 WeakPolarHBondContact O-CB 3.44Å; V10-A13 PolarHBondContact O-N 2.84Å; Q11-A13 VanDerWaalsContact C-N 3.32Å; Q11-A13 PolarHBondContact O-N 3.39Å; A13-A16 PolarHBondContact O-N 3.08Å; A13-E17 PolarHBondContact O-N 3.09Å; A13-M25 HydrophobicContact CB-CG 4.09Å; A13-A28 HydrophobicContact CB-CB 4.05Å; A13-M29 HydrophobicContact CB-CG 3.74Å; A13-M29 HydrophobicContact CB-SD 3.58Å; A13-M29 VanDerWaalsContact CB-SD 3.58Å
14K98.1Very high95.3Very high41 Ų4175.4 Ų75.418%0.17837%0.366CS..Hα-helixtrans-63.8-41.4175.5-70.4175.5177.1-175.40112.6V10 Q11 A16 E17 Q18 E42 L46V10-K14 HydrophobicContact CG1-CD 4.43Å; V10-K14 WeakPolarHBondContact O-CG 3.46Å; V10-K14 PolarHBondContact O-N 2.63Å; Q11-K14 PolarHBondContact O-N 3.09Å; K14-A16 VanDerWaalsContact C-N 3.34Å; K14-E17 PolarHBondContact O-N 3Å; K14-Q18 WeakPolarHBondContact O-CG 3.38Å; K14-Q18 PolarHBondContact O-N 2.88Å; K14-Q18 VanDerWaalsContact O-N 3.08Å; K14-E42 WeakPolarHBondContact CE-OE1 3.45Å; K14-E42 IonicContact NZ-OE1 3.76Å; K14-E42 PolarHBondContact NZ-OE1 3.02Å; K14-E42 IonicContact NZ-OE2 2.65Å; K14-E42 PolarHBondContact NZ-OE2 2.87Å; K14-E42 VanDerWaalsContact NZ-OE2 3.1Å; K14-L46 HydrophobicContact CG-CD1 4.03Å; K14-L46 HydrophobicContact CG-CD2 4.21Å
15L98.2Very high96.5Very high107 Ų10771.6 Ų71.656%0.5634%0.343SS*.Hα-helixtrans-65.7-38.4174.5-69.7171000111.9Q11 K12 Q18 S19Q11-L15 WeakPolarHBondContact O-CG 3.41Å; Q11-L15 PolarHBondContact O-N 3.24Å; K12-L15 PolarHBondContact O-N 3.16Å; L15-Q18 PolarHBondContact O-N 3.43Å; L15-S19 PolarHBondContact O-N 3.06Å; L15-S19 PolarHBondContact O-OG 3.33Å
16A98.1Very high97Very high6 Ų669 Ų695%0.0533%0.329CS..Hα-helixtrans-65.7-39.9175.100000111.8K12 A13 K14 S19 E20 R21 D24 M25K12-A16 WeakPolarHBondContact O-CB 3.48Å; K12-A16 PolarHBondContact O-N 3.34Å; A13-A16 PolarHBondContact O-N 3.08Å; K14-A16 VanDerWaalsContact C-N 3.34Å; A16-S19 CarbonylContact O-C 3.49Å; A16-S19 PolarHBondContact O-N 3.43Å; A16-S19 PolarHBondContact O-OG 3.48Å; A16-E20 PolarHBondContact O-N 3.17Å; A16-E20 VanDerWaalsContact O-N 3.08Å; A16-R21 HydrophobicContact CB-CB 4.37Å; A16-R21 PolarHBondContact O-N 3.01Å; A16-D24 HydrophobicContact CB-CB 4.01Å; A16-M25 HydrophobicContact CB-CB 3.84Å; A16-M25 HydrophobicContact CB-CG 4.49Å
17E97.8Very high97.3Very high69 Ų6973.7 Ų73.732%0.32235%0.352SS..Hα-helixtrans-59.9-48.3173.7-177.1178.4-14200111.7A13 K14 S19 E20 M25 L46A13-E17 PolarHBondContact O-N 3.09Å; K14-E17 PolarHBondContact O-N 3Å; E17-S19 PolarHBondContact O-N 3.47Å; E17-E20 PolarHBondContact O-N 2.74Å; E17-M25 HydrophobicContact CB-CE 3.91Å; E17-M25 HydrophobicContact CB-SD 3.95Å; E17-M25 HydrophobicContact CG-CE 4.17Å; E17-M25 HydrophobicContact CG-SD 4.4Å; E17-L46 WeakPolarHBondContact OE2-CD2 3.34Å
18Q97.1Very high97.5Very high158 Ų15867.9 Ų67.974%0.73833%0.327SS*.Hα-helixtrans-63.1-21.5178.9-70.8174.425.100113.9K14 L15K14-Q18 WeakPolarHBondContact O-CG 3.38Å; K14-Q18 PolarHBondContact O-N 2.88Å; K14-Q18 VanDerWaalsContact O-N 3.08Å; L15-Q18 PolarHBondContact O-N 3.43Å
19S96.8Very high97.7Very high70 Ų7063 Ų6349%0.4930%0.303SS..THydrogen-bonded Turntrans-105.210.1176.953.40000113.2L15 A16 E17 R21L15-S19 PolarHBondContact O-N 3.06Å; L15-S19 PolarHBondContact O-OG 3.33Å; A16-S19 CarbonylContact O-C 3.49Å; A16-S19 PolarHBondContact O-N 3.43Å; A16-S19 PolarHBondContact O-OG 3.48Å; E17-S19 PolarHBondContact O-N 3.47Å; S19-R21 PolarHBondContact O-N 3.37Å; S19-R21 VanDerWaalsContact O-N 3.09Å
20E97Very high97.8Very high146 Ų14664.6 Ų64.668%0.68231%0.31SS*.THydrogen-bonded Turntrans53.925.7-177.9-56.3-173.3145.600113.8A16 E17 Y22A16-E20 PolarHBondContact O-N 3.17Å; A16-E20 VanDerWaalsContact O-N 3.08Å; E17-E20 PolarHBondContact O-N 2.74Å; E20-Y22 VanDerWaalsContact C-N 3.31Å; E20-Y22 HydrophobicContact CB-CE2 3.98Å; E20-Y22 WeakPolarHBondContact O-CD2 3.35Å; E20-Y22 PolarHBondContact O-N 3.39Å; E20-Y22 VanDerWaalsContact O-N 3.12Å
21R98.1Very high97.8Very high140 Ų14066.5 Ų66.553%0.52832%0.323SS..  trans-88.667.2177.4-66.3-161.164.1-177.8-11.1110.7A16 S19 D23 D24 M25A16-R21 HydrophobicContact CB-CB 4.37Å; A16-R21 PolarHBondContact O-N 3.01Å; S19-R21 PolarHBondContact O-N 3.37Å; S19-R21 VanDerWaalsContact O-N 3.09Å; R21-D23 VanDerWaalsContact C-N 3.3Å; R21-D23 PolarHBondContact O-N 2.83Å; R21-D24 HydrophobicContact CB-CB 4.18Å; R21-D24 IonicContact CZ-OD1 3.84Å; R21-D24 IonicContact CZ-OD2 2.65Å; R21-D24 IonicContact NE-OD1 2.84Å; R21-D24 IonicContact NE-OD2 3.04Å; R21-D24 PolarHBondContact NE-OD2 3.32Å; R21-D24 IonicContact NH1-OD2 3.9Å; R21-D24 PolarHBondContact NH1-OD2 3.03Å; R21-D24 VanDerWaalsContact NH2-CG 3.27Å; R21-D24 IonicContact NH2-OD1 3.12Å; R21-D24 PolarHBondContact NH2-OD1 2.85Å; R21-D24 IonicContact NH2-OD2 3.83Å; R21-D24 PolarHBondContact NH2-OD2 2.99Å; R21-D24 WeakPolarHBondContact O-CB 3.41Å; R21-D24 PolarHBondContact O-N 3.39Å; R21-D24 VanDerWaalsContact O-N 3.12Å; R21-M25 PolarHBondContact O-N 3.09Å
22Y98.3Very high97.8Very high53 Ų5361.3 Ų61.321%0.20830%0.299CS..Hα-helixtrans-65.4-27.1-172-58.1-66.8000114.7E20 M25 A26 V49 N53 V54E20-Y22 VanDerWaalsContact C-N 3.31Å; E20-Y22 HydrophobicContact CB-CE2 3.98Å; E20-Y22 WeakPolarHBondContact O-CD2 3.35Å; E20-Y22 PolarHBondContact O-N 3.39Å; E20-Y22 VanDerWaalsContact O-N 3.12Å; Y22-M25 HydrophobicContact CD1-SD 3.99Å; Y22-M25 WeakPolarHBondContact O-CB 3.2Å; Y22-M25 PolarHBondContact O-N 3.35Å; Y22-A26 WeakPolarHBondContact O-CB 3.43Å; Y22-A26 PolarHBondContact O-N 3.15Å; Y22-V49 HydrophobicContact CE1-CG1 4.29Å; Y22-N53 HydrophobicContact CD1-CB 3.65Å; Y22-N53 HydrophobicContact CD2-CB 3.38Å; Y22-N53 HydrophobicContact CE1-CB 4.01Å; Y22-N53 WeakPolarHBondContact CE1-ND2 3.41Å; Y22-N53 HydrophobicContact CE2-CB 3.73Å; Y22-N53 HydrophobicContact CG-CB 3.3Å; Y22-V54 VanDerWaalsContact C-CG2 3.45Å; Y22-V54 WeakPolarHBondContact O-CG2 3.41Å
23D97.8Very high97.8Very high76 Ų7655.9 Ų55.941%0.40628%0.276SS..Hα-helixtrans-65.7-42.2173.1-62-78.6000111R21 M25 A26 Q27 R58R21-D23 VanDerWaalsContact C-N 3.3Å; R21-D23 PolarHBondContact O-N 2.83Å; D23-M25 VanDerWaalsContact C-N 3.35Å; D23-A26 PolarHBondContact O-N 3.4Å; D23-Q27 WeakPolarHBondContact O-CG 3.49Å; D23-Q27 PolarHBondContact O-N 3.24Å; D23-R58 IonicContact OD1-CZ 3.09Å; D23-R58 IonicContact OD1-NH1 3.56Å; D23-R58 PolarHBondContact OD1-NH1 2.69Å; D23-R58 VanDerWaalsContact OD1-NH1 3.12Å; D23-R58 IonicContact OD1-NH2 3.76Å; D23-R58 IonicContact OD2-NH1 3.79Å
24D97.9Very high97.7Very high56 Ų5660 Ų6030%0.29930%0.295SS..Hα-helixtrans-64.9-41.4174.3-63.214.2000110.7A16 R21 A26 Q27 A28A16-D24 HydrophobicContact CB-CB 4.01Å; R21-D24 HydrophobicContact CB-CB 4.18Å; R21-D24 IonicContact CZ-OD1 3.84Å; R21-D24 IonicContact CZ-OD2 2.65Å; R21-D24 IonicContact NE-OD1 2.84Å; R21-D24 IonicContact NE-OD2 3.04Å; R21-D24 PolarHBondContact NE-OD2 3.32Å; R21-D24 IonicContact NH1-OD2 3.9Å; R21-D24 PolarHBondContact NH1-OD2 3.03Å; R21-D24 VanDerWaalsContact NH2-CG 3.27Å; R21-D24 IonicContact NH2-OD1 3.12Å; R21-D24 PolarHBondContact NH2-OD1 2.85Å; R21-D24 IonicContact NH2-OD2 3.83Å; R21-D24 PolarHBondContact NH2-OD2 2.99Å; R21-D24 WeakPolarHBondContact O-CB 3.41Å; R21-D24 PolarHBondContact O-N 3.39Å; R21-D24 VanDerWaalsContact O-N 3.12Å; D24-A26 VanDerWaalsContact C-N 3.33Å; D24-A26 PolarHBondContact O-N 3.06Å; D24-Q27 PolarHBondContact O-N 2.99Å; D24-A28 WeakPolarHBondContact O-CB 3.4Å; D24-A28 PolarHBondContact O-N 3.32Å
25M98.1Very high97.5Very high0 Ų060.1 Ų60.10%030%0.299CS..Hα-helixtrans-59.6-43.8175.8-165.7-169.3-179.400111.1A13 A16 E17 R21 Y22 D23 A28 M29 L46 V49 A50A13-M25 HydrophobicContact CB-CG 4.09Å; A16-M25 HydrophobicContact CB-CB 3.84Å; A16-M25 HydrophobicContact CB-CG 4.49Å; E17-M25 HydrophobicContact CB-CE 3.91Å; E17-M25 HydrophobicContact CB-SD 3.95Å; E17-M25 HydrophobicContact CG-CE 4.17Å; E17-M25 HydrophobicContact CG-SD 4.4Å; R21-M25 PolarHBondContact O-N 3.09Å; Y22-M25 HydrophobicContact CD1-SD 3.99Å; Y22-M25 WeakPolarHBondContact O-CB 3.2Å; Y22-M25 PolarHBondContact O-N 3.35Å; D23-M25 VanDerWaalsContact C-N 3.35Å; M25-A28 PolarHBondContact O-N 3.22Å; M25-M29 WeakPolarHBondContact O-CB 3.49Å; M25-M29 WeakPolarHBondContact O-CG 3.16Å; M25-M29 PolarHBondContact O-N 3.04Å; M25-L46 HydrophobicContact CE-CB 3.87Å; M25-L46 HydrophobicContact CE-CD2 3.45Å; M25-L46 VanDerWaalsContact CE-CD2 3.45Å; M25-L46 HydrophobicContact CE-CG 4.28Å; M25-L46 WeakPolarHBondContact CE-O 3.3Å; M25-V49 HydrophobicContact CE-CB 4.1Å; M25-V49 HydrophobicContact CE-CG1 4.06Å; M25-V49 HydrophobicContact SD-CG1 4.24Å; M25-A50 HydrophobicContact CB-CB 3.89Å; M25-A50 HydrophobicContact CE-CB 4.24Å; M25-A50 HydrophobicContact CG-CB 3.58Å; M25-A50 VanDerWaalsContact SD-CA 3.56Å; M25-A50 HydrophobicContact SD-CB 3.57Å; M25-A50 VanDerWaalsContact SD-CB 3.57Å
26A98.3Very high97.2Very high5 Ų555.8 Ų55.84%0.04128%0.28CS..Hα-helixtrans-65.2-43.6178.500000111.3Y22 D23 D24 A28 M29 K30 A50 Y51 V54Y22-A26 WeakPolarHBondContact O-CB 3.43Å; Y22-A26 PolarHBondContact O-N 3.15Å; D23-A26 PolarHBondContact O-N 3.4Å; D24-A26 VanDerWaalsContact C-N 3.33Å; D24-A26 PolarHBondContact O-N 3.06Å; A26-A28 PolarHBondContact O-N 3.05Å; A26-M29 PolarHBondContact O-N 3.29Å; A26-K30 WeakPolarHBondContact O-CB 3.23Å; A26-K30 PolarHBondContact O-N 3.21Å; A26-A50 HydrophobicContact CB-CB 4.17Å; A26-Y51 HydrophobicContact CB-CD1 4.11Å; A26-Y51 HydrophobicContact CB-CD2 4.46Å; A26-Y51 HydrophobicContact CB-CE1 3.91Å; A26-Y51 HydrophobicContact CB-CE2 4.25Å; A26-Y51 HydrophobicContact CB-CG 4.39Å; A26-V54 HydrophobicContact CB-CG2 4.18Å
27Q97.9Very high96.9Very high132 Ų13259.4 Ų59.462%0.61730%0.302SS*.Hα-helixtrans-62.3-42.8176.2-72.4178.8-4.700112.8D23 D24 S31D23-Q27 WeakPolarHBondContact O-CG 3.49Å; D23-Q27 PolarHBondContact O-N 3.24Å; D24-Q27 PolarHBondContact O-N 2.99Å; Q27-S31 PolarHBondContact O-N 3Å; Q27-S31 VanDerWaalsContact O-N 3.15Å; Q27-S31 PolarHBondContact O-OG 3.22Å
28A97.8Very high96.8Very high10 Ų1059.3 Ų59.38%0.08330%0.301CS..Hα-helixtrans-63.5-49.7176.100000111.1K12 A13 D24 M25 A26 K30 S31 V32K12-A28 HydrophobicContact CB-CB 4.43Å; A13-A28 HydrophobicContact CB-CB 4.05Å; D24-A28 WeakPolarHBondContact O-CB 3.4Å; D24-A28 PolarHBondContact O-N 3.32Å; M25-A28 PolarHBondContact O-N 3.22Å; A26-A28 PolarHBondContact O-N 3.05Å; A28-K30 VanDerWaalsContact C-N 3.34Å; A28-K30 PolarHBondContact O-N 2.89Å; A28-S31 WeakPolarHBondContact O-CB 3.17Å; A28-S31 PolarHBondContact O-N 3.47Å; A28-S31 VanDerWaalsContact O-N 3.15Å; A28-V32 WeakPolarHBondContact O-CG2 2.92Å; A28-V32 PolarHBondContact O-N 3.41Å
29M98.2Very high96.8Very high0 Ų052.1 Ų52.10%027%0.268CS..Hα-helixtrans-70-28.5-178.9-69.3-52.1-51.400113.7A13 M25 A26 V32 T33 E43 L46 L47A13-M29 HydrophobicContact CB-CG 3.74Å; A13-M29 HydrophobicContact CB-SD 3.58Å; A13-M29 VanDerWaalsContact CB-SD 3.58Å; M25-M29 WeakPolarHBondContact O-CB 3.49Å; M25-M29 WeakPolarHBondContact O-CG 3.16Å; M25-M29 PolarHBondContact O-N 3.04Å; A26-M29 PolarHBondContact O-N 3.29Å; M29-V32 HydrophobicContact CE-CB 4.17Å; M29-V32 HydrophobicContact CE-CG1 4.14Å; M29-V32 HydrophobicContact CE-CG2 4.48Å; M29-V32 PolarHBondContact O-N 3.35Å; M29-V32 HydrophobicContact SD-CG2 4.32Å; M29-T33 WeakPolarHBondContact O-CB 3.29Å; M29-T33 PolarHBondContact O-N 2.9Å; M29-T33 PolarHBondContact O-OG1 3.22Å; M29-E43 HydrophobicContact CE-CB 4.19Å; M29-E43 WeakPolarHBondContact CE-O 3.48Å; M29-L46 HydrophobicContact CE-CB 4.18Å; M29-L46 HydrophobicContact CG-CB 4.18Å; M29-L46 HydrophobicContact SD-CB 3.87Å; M29-L46 HydrophobicContact SD-CD1 4.35Å; M29-L47 HydrophobicContact CB-CB 4.28Å; M29-L47 HydrophobicContact CB-CD1 3.71Å; M29-L47 HydrophobicContact CE-CB 4.16Å
30K98Very high96.8Very high55 Ų5551.3 Ų51.324%0.23926%0.262CS..Hα-helixtrans-58.8-51167.6-179.9177.5-177.11800110.4A26 A28 V32 T33 E34 E99 L103A26-K30 WeakPolarHBondContact O-CB 3.23Å; A26-K30 PolarHBondContact O-N 3.21Å; A28-K30 VanDerWaalsContact C-N 3.34Å; A28-K30 PolarHBondContact O-N 2.89Å; K30-V32 VanDerWaalsContact C-N 3.31Å; K30-V32 PolarHBondContact O-N 3.3Å; K30-T33 WeakPolarHBondContact O-CB 3.21Å; K30-T33 PolarHBondContact O-N 2.94Å; K30-T33 VanDerWaalsContact O-N 3.08Å; K30-E34 WeakPolarHBondContact CE-OE1 3.19Å; K30-E34 HydrophobicContact CG-CG 4.4Å; K30-E34 WeakPolarHBondContact O-CG 3.38Å; K30-E34 PolarHBondContact O-N 3.01Å; K30-E99 HydrophobicContact CD-CG 4.31Å; K30-E99 IonicContact NZ-OE2 3.77Å; K30-E99 PolarHBondContact NZ-OE2 2.86Å; K30-L103 HydrophobicContact CB-CD1 4.32Å; K30-L103 HydrophobicContact CG-CD1 4.13Å; K30-L103 HydrophobicContact CG-CD2 4.11Å
31S97.3Very high96.7Very high48 Ų4848.2 Ų48.234%0.33625%0.25SS..Hα-helixtrans-61.1-39.9179.3-560000111.8L9 Q27 A28 E34 T35L9-S31 VanDerWaalsContact CD1-CB 3.44Å; Q27-S31 PolarHBondContact O-N 3Å; Q27-S31 VanDerWaalsContact O-N 3.15Å; Q27-S31 PolarHBondContact O-OG 3.22Å; A28-S31 WeakPolarHBondContact O-CB 3.17Å; A28-S31 PolarHBondContact O-N 3.47Å; A28-S31 VanDerWaalsContact O-N 3.15Å; S31-E34 PolarHBondContact O-N 2.95Å; S31-T35 WeakPolarHBondContact O-CG2 3.48Å; S31-T35 PolarHBondContact O-N 2.96Å
32V97.3Very high96.6Very high0 Ų046.5 Ų46.50%025%0.248CC..Hα-helixtrans-60.2-46.7172.6174.10000111K6 L9 V10 A28 M29 K30 E34 T35 L39K6-V32 HydrophobicContact CD-CG1 4.44Å; K6-V32 HydrophobicContact CG-CG1 4.07Å; L9-V32 HydrophobicContact CB-CG2 3.42Å; L9-V32 VanDerWaalsContact CB-CG2 3.42Å; L9-V32 HydrophobicContact CD1-CG2 3.84Å; L9-V32 HydrophobicContact CG-CG2 4.33Å; V10-V32 HydrophobicContact CG2-CG1 4.3Å; V10-V32 HydrophobicContact CG2-CG2 3.94Å; A28-V32 WeakPolarHBondContact O-CG2 2.92Å; A28-V32 PolarHBondContact O-N 3.41Å; M29-V32 HydrophobicContact CE-CB 4.17Å; M29-V32 HydrophobicContact CE-CG1 4.14Å; M29-V32 HydrophobicContact CE-CG2 4.48Å; M29-V32 PolarHBondContact O-N 3.35Å; M29-V32 HydrophobicContact SD-CG2 4.32Å; K30-V32 VanDerWaalsContact C-N 3.31Å; K30-V32 PolarHBondContact O-N 3.3Å; V32-E34 PolarHBondContact O-N 3.46Å; V32-T35 WeakPolarHBondContact O-CB 3.31Å; V32-T35 WeakPolarHBondContact O-CG2 3.5Å; V32-T35 PolarHBondContact O-N 2.93Å; V32-T35 PolarHBondContact O-OG1 3.44Å; V32-L39 HydrophobicContact CG1-CD2 3.7Å
33T97.3Very high96.6Very high2 Ų245.1 Ų45.11%0.01224%0.244CC..Hα-helixtrans-65.6-39.5-178.2-59.10000112M29 K30 T35 G36 L103 Y107 L108M29-T33 WeakPolarHBondContact O-CB 3.29Å; M29-T33 PolarHBondContact O-N 2.9Å; M29-T33 PolarHBondContact O-OG1 3.22Å; K30-T33 WeakPolarHBondContact O-CB 3.21Å; K30-T33 PolarHBondContact O-N 2.94Å; K30-T33 VanDerWaalsContact O-N 3.08Å; T33-T35 PolarHBondContact O-N 3.43Å; T33-G36 PolarHBondContact O-N 3.01Å; T33-L103 HydrophobicContact CG2-CB 4.16Å; T33-L103 HydrophobicContact CG2-CD2 3.99Å; T33-L103 HydrophobicContact CG2-CG 4.5Å; T33-Y107 HydrophobicContact CG2-CD2 4.36Å; T33-Y107 HydrophobicContact CG2-CG 4.39Å; T33-L108 HydrophobicContact CG2-CD1 3.96Å; T33-L108 HydrophobicContact CG2-CD2 3.73Å; T33-L108 HydrophobicContact CG2-CG 3.74Å
34E96.1Very high96.5Very high87 Ų8742 Ų4241%0.40723%0.226SC..Hα-helixtrans-70.9-12.4-179.5-71.2-178.5152.800113.6K30 S31 V32 G36 L103 Y107K30-E34 WeakPolarHBondContact CE-OE1 3.19Å; K30-E34 HydrophobicContact CG-CG 4.4Å; K30-E34 WeakPolarHBondContact O-CG 3.38Å; K30-E34 PolarHBondContact O-N 3.01Å; S31-E34 PolarHBondContact O-N 2.95Å; V32-E34 PolarHBondContact O-N 3.46Å; E34-G36 PolarHBondContact O-N 3.32Å; E34-L103 HydrophobicContact CG-CD2 3.81Å; E34-Y107 HydrophobicContact CB-CE2 4.42Å; E34-Y107 HydrophobicContact CG-CD2 4.37Å; E34-Y107 HydrophobicContact CG-CE2 3.72Å
35T93.8Very high96.5Very high43 Ų4342.9 Ų42.926%0.26423%0.231SC..THydrogen-bonded Turntrans-60.8-23.1166.369.90000112.3M1 S31 V32 T33 V37M1-T35 HydrophobicContact CB-CG2 3.79Å; M1-T35 HydrophobicContact CG-CG2 3.91Å; M1-T35 HydrophobicContact SD-CG2 3.35Å; M1-T35 WeakPolarHBondContact SD-CG2 3.45Å; S31-T35 WeakPolarHBondContact O-CG2 3.48Å; S31-T35 PolarHBondContact O-N 2.96Å; V32-T35 WeakPolarHBondContact O-CB 3.31Å; V32-T35 WeakPolarHBondContact O-CG2 3.5Å; V32-T35 PolarHBondContact O-N 2.93Å; V32-T35 PolarHBondContact O-OG1 3.44Å; T33-T35 PolarHBondContact O-N 3.43Å; T35-V37 PolarHBondContact O-N 2.86Å; T35-V37 PolarHBondContact OG1-N 3.41Å
36G92Very high96.5Very high16 Ų1643.3 Ų43.317%0.16523%0.233CC..  trans72.210.7-178.200000114.1T33 E34 K111T33-G36 PolarHBondContact O-N 3.01Å; E34-G36 PolarHBondContact O-N 3.32Å; G36-K111 VanDerWaalsContact C-NZ 3.34Å; G36-K111 WeakPolarHBondContact O-CD 3.31Å; G36-K111 WeakPolarHBondContact O-CE 3.37Å; G36-K111 PolarHBondContact O-NZ 3.32Å
37V92.7Very high96.5Very high82 Ų8243.2 Ų43.250%0.49723%0.232SC..PPolyproline II helixtrans-79.2138167.8-177.60000108.2T35 L39T35-V37 PolarHBondContact O-N 2.86Å; T35-V37 PolarHBondContact OG1-N 3.41Å; V37-L39 PolarHBondContact O-N 3.38Å
38E95.3Very high96.5Very high66 Ų6638.5 Ų38.531%0.30821%0.213SC..PPolyproline II helixtrans-57.2134.9174.7-173.7172.2-159.800110.1A112 S113E38-A112 WeakPolarHBondContact OE1-CA 3.3Å; E38-S113 PolarHBondContact OE1-N 2.86Å; E38-S113 PolarHBondContact OE1-OG 3.4Å; E38-S113 WeakPolarHBondContact OE2-CB 3.45Å; E38-S113 PolarHBondContact OE2-OG 2.89Å
39L97Very high96.6Very high7 Ų740.1 Ų40.14%0.03722%0.222CC..PPolyproline II helixtrans-77.4140.4-179.3-58.7-172.5000110.6V32 V37 E43 R44 L47 L108V32-L39 HydrophobicContact CG1-CD2 3.7Å; V37-L39 PolarHBondContact O-N 3.38Å; L39-E43 VanDerWaalsContact CA-OE2 3.31Å; L39-E43 WeakPolarHBondContact CA-OE2 3.26Å; L39-E43 HydrophobicContact CB-CB 3.93Å; L39-E43 HydrophobicContact CD2-CB 4.22Å; L39-E43 HydrophobicContact CG-CB 4.46Å; L39-R44 HydrophobicContact CB-CB 4.32Å; L39-L47 HydrophobicContact CD1-CB 4.44Å; L39-L47 HydrophobicContact CD1-CD2 4.01Å; L39-L108 HydrophobicContact CD1-CD2 3.63Å; L39-L108 HydrophobicContact CG-CD2 3.79Å
40S96.3Very high96.6Very high53 Ų5340.1 Ų40.137%0.37122%0.222SC..PPolyproline II helixtrans-66.1166.6165.377.50000110.9E42 E43 R44S40-E42 PolarHBondContact O-N 3.31Å; S40-E42 PolarHBondContact OG-N 3.2Å; S40-E43 PolarHBondContact N-OE2 2.82Å; S40-E43 PolarHBondContact O-N 3.29Å; S40-E43 WeakPolarHBondContact OG-CG 3.37Å; S40-E43 PolarHBondContact OG-N 3.12Å; S40-R44 VanDerWaalsContact O-CB 3.26Å; S40-R44 WeakPolarHBondContact O-CB 3.39Å; S40-R44 PolarHBondContact O-N 3.33Å
41N95Very high96.6Very high82 Ų8237.6 Ų37.644%0.43921%0.211SC..Hα-helixtrans-57.4-38.7175.1-76.3-15.3000112.4R44 N45N41-R44 PolarHBondContact OD1-NH1 3.33Å; N41-N45 WeakPolarHBondContact O-CB 3.35Å; N41-N45 PolarHBondContact O-N 3.31Å; N41-N45 PolarHBondContact O-ND2 2.88Å; N41-N45 PolarHBondContact O-OD1 3.13Å
42E96.2Very high96.6Very high103 Ų10341.7 Ų41.748%0.48122%0.223SC..Hα-helixtrans-65.5-49.1176.7-173.6-177.9-154.200111.2K14 S40 R44 N45 L46K14-E42 WeakPolarHBondContact CE-OE1 3.45Å; K14-E42 IonicContact NZ-OE1 3.76Å; K14-E42 PolarHBondContact NZ-OE1 3.02Å; K14-E42 IonicContact NZ-OE2 2.65Å; K14-E42 PolarHBondContact NZ-OE2 2.87Å; K14-E42 VanDerWaalsContact NZ-OE2 3.1Å; S40-E42 PolarHBondContact O-N 3.31Å; S40-E42 PolarHBondContact OG-N 3.2Å; E42-R44 PolarHBondContact O-N 2.88Å; E42-N45 PolarHBondContact O-N 3.34Å; E42-L46 HydrophobicContact CG-CD1 4.43Å; E42-L46 WeakPolarHBondContact O-CG 3.35Å; E42-L46 PolarHBondContact O-N 2.69Å
43E97.5Very high96.7Very high24 Ų2444.4 Ų44.411%0.11224%0.238CC..Hα-helixtrans-62.7-42179.7-69167.516800111.9K6 V10 M29 L39 S40 N45 L46 L47K6-E43 VanDerWaalsContact CE-CD 3.44Å; K6-E43 WeakPolarHBondContact CE-OE1 3.47Å; K6-E43 WeakPolarHBondContact CE-OE2 3.46Å; K6-E43 IonicContact NZ-OE1 2.71Å; K6-E43 PolarHBondContact NZ-OE1 2.95Å; K6-E43 IonicContact NZ-OE2 3.17Å; K6-E43 PolarHBondContact NZ-OE2 2.84Å; V10-E43 HydrophobicContact CG2-CG 3.94Å; M29-E43 HydrophobicContact CE-CB 4.19Å; M29-E43 WeakPolarHBondContact CE-O 3.48Å; L39-E43 VanDerWaalsContact CA-OE2 3.31Å; L39-E43 WeakPolarHBondContact CA-OE2 3.26Å; L39-E43 HydrophobicContact CB-CB 3.93Å; L39-E43 HydrophobicContact CD2-CB 4.22Å; L39-E43 HydrophobicContact CG-CB 4.46Å; S40-E43 PolarHBondContact N-OE2 2.82Å; S40-E43 PolarHBondContact O-N 3.29Å; S40-E43 WeakPolarHBondContact OG-CG 3.37Å; S40-E43 PolarHBondContact OG-N 3.12Å; E43-N45 VanDerWaalsContact C-N 3.32Å; E43-N45 PolarHBondContact O-N 3.38Å; E43-L46 PolarHBondContact O-N 3.36Å; E43-L47 PolarHBondContact O-N 3.06Å
44R97.6Very high96.7Very high11 Ų1144.7 Ų44.74%0.04224%0.239CC..Hα-helixtrans-59.5-43.4174.3179.9-171.177.1-163.9-3.3111.6L39 S40 N41 E42 L47 S48 S117 F120 Y121L39-R44 HydrophobicContact CB-CB 4.32Å; S40-R44 VanDerWaalsContact O-CB 3.26Å; S40-R44 WeakPolarHBondContact O-CB 3.39Å; S40-R44 PolarHBondContact O-N 3.33Å; N41-R44 PolarHBondContact OD1-NH1 3.33Å; E42-R44 PolarHBondContact O-N 2.88Å; R44-L47 PolarHBondContact O-N 3Å; R44-S48 PolarHBondContact O-N 3.44Å; R44-S117 PolarHBondContact NH1-OG 3.04Å; R44-F120 HydrophobicContact CG-CD1 3.54Å; R44-F120 HydrophobicContact CG-CE1 3.4Å; R44-F120 VanDerWaalsContact CG-CE1 3.4Å; R44-F120 HydrophobicContact CG-CE2 4.45Å; R44-F120 HydrophobicContact CG-CG 4.15Å; R44-F120 HydrophobicContact CG-CZ 3.89Å; R44-Y121 HydrophobicContact CG-CE1 3.6Å
45N96.8Very high96.9Very high75 Ų7540.6 Ų40.640%0.40122%0.22SC..Hα-helixtrans-66.8-41.9178.4-71.3-10.1000111.1N41 E42 E43 L47 S48 V49N41-N45 WeakPolarHBondContact O-CB 3.35Å; N41-N45 PolarHBondContact O-N 3.31Å; N41-N45 PolarHBondContact O-ND2 2.88Å; N41-N45 PolarHBondContact O-OD1 3.13Å; E42-N45 PolarHBondContact O-N 3.34Å; E43-N45 VanDerWaalsContact C-N 3.32Å; E43-N45 PolarHBondContact O-N 3.38Å; N45-L47 PolarHBondContact O-N 2.96Å; N45-S48 WeakPolarHBondContact O-CB 3.28Å; N45-S48 PolarHBondContact O-N 3.23Å; N45-V49 WeakPolarHBondContact O-CG2 3.36Å; N45-V49 PolarHBondContact O-N 2.9Å
46L98.3Very high97.1Very high8 Ų839.7 Ų39.74%0.04222%0.219CC..Hα-helixtrans-58.2-47.9173.8-71.1169.7000111.4V10 K14 E17 M25 M29 E42 E43 S48 V49 A50V10-L46 HydrophobicContact CG1-CD1 3.96Å; K14-L46 HydrophobicContact CG-CD1 4.03Å; K14-L46 HydrophobicContact CG-CD2 4.21Å; E17-L46 WeakPolarHBondContact OE2-CD2 3.34Å; M25-L46 HydrophobicContact CE-CB 3.87Å; M25-L46 HydrophobicContact CE-CD2 3.45Å; M25-L46 VanDerWaalsContact CE-CD2 3.45Å; M25-L46 HydrophobicContact CE-CG 4.28Å; M25-L46 WeakPolarHBondContact CE-O 3.3Å; M29-L46 HydrophobicContact CE-CB 4.18Å; M29-L46 HydrophobicContact CG-CB 4.18Å; M29-L46 HydrophobicContact SD-CB 3.87Å; M29-L46 HydrophobicContact SD-CD1 4.35Å; E42-L46 HydrophobicContact CG-CD1 4.43Å; E42-L46 WeakPolarHBondContact O-CG 3.35Å; E42-L46 PolarHBondContact O-N 2.69Å; E43-L46 PolarHBondContact O-N 3.36Å; L46-S48 VanDerWaalsContact C-N 3.29Å; L46-S48 PolarHBondContact O-N 2.81Å; L46-V49 PolarHBondContact O-N 3.49Å; L46-A50 WeakPolarHBondContact O-CB 3.34Å; L46-A50 PolarHBondContact O-N 3.45Å
47L98.5Very high97.4Very high3 Ų341.3 Ų41.32%0.01623%0.231CC..Hα-helixtrans-55.9-46.1175.618074000111.4M29 L39 E43 R44 N45 Y51 L103 L108M29-L47 HydrophobicContact CB-CB 4.28Å; M29-L47 HydrophobicContact CB-CD1 3.71Å; M29-L47 HydrophobicContact CE-CB 4.16Å; L39-L47 HydrophobicContact CD1-CB 4.44Å; L39-L47 HydrophobicContact CD1-CD2 4.01Å; E43-L47 PolarHBondContact O-N 3.06Å; R44-L47 PolarHBondContact O-N 3Å; N45-L47 PolarHBondContact O-N 2.96Å; L47-Y51 HydrophobicContact CD1-CD2 3.64Å; L47-Y51 HydrophobicContact CD1-CE2 3.49Å; L47-Y51 VanDerWaalsContact CD1-CE2 3.49Å; L47-Y51 HydrophobicContact CG-CD2 4.21Å; L47-Y51 HydrophobicContact CG-CE2 4.49Å; L47-Y51 PolarHBondContact O-N 3Å; L47-L103 HydrophobicContact CD1-CD1 4.49Å; L47-L108 HydrophobicContact CD2-CD1 3.47Å; L47-L108 VanDerWaalsContact CD2-CD1 3.47Å
48S98.3Very high97.6Very high33 Ų3340.1 Ų40.123%0.23122%0.218CC..Hα-helixtrans-63.4-46.5178.9176.60000112.1R44 N45 L46 K52R44-S48 PolarHBondContact O-N 3.44Å; N45-S48 WeakPolarHBondContact O-CB 3.28Å; N45-S48 PolarHBondContact O-N 3.23Å; L46-S48 VanDerWaalsContact C-N 3.29Å; L46-S48 PolarHBondContact O-N 2.81Å; S48-K52 WeakPolarHBondContact O-CB 3.28Å; S48-K52 PolarHBondContact O-N 2.78Å
49V98.3Very high97.8Very high45 Ų4538.4 Ų38.427%0.27321%0.208SC..Hα-helixtrans-62-45178.8169.40000110.9Y22 M25 N45 L46 N53Y22-V49 HydrophobicContact CE1-CG1 4.29Å; M25-V49 HydrophobicContact CE-CB 4.1Å; M25-V49 HydrophobicContact CE-CG1 4.06Å; M25-V49 HydrophobicContact SD-CG1 4.24Å; N45-V49 WeakPolarHBondContact O-CG2 3.36Å; N45-V49 PolarHBondContact O-N 2.9Å; L46-V49 PolarHBondContact O-N 3.49Å; V49-N53 PolarHBondContact O-N 2.88Å; V49-N53 VanDerWaalsContact O-N 3.13Å; V49-N53 PolarHBondContact O-ND2 3.26Å
50A98.5Very high97.8Very high0 Ų041.2 Ų41.20%023%0.229CC..Hα-helixtrans-55.1-60.917900000111.2M25 A26 L46 K52 N53 V54M25-A50 HydrophobicContact CB-CB 3.89Å; M25-A50 HydrophobicContact CE-CB 4.24Å; M25-A50 HydrophobicContact CG-CB 3.58Å; M25-A50 VanDerWaalsContact SD-CA 3.56Å; M25-A50 HydrophobicContact SD-CB 3.57Å; M25-A50 VanDerWaalsContact SD-CB 3.57Å; A26-A50 HydrophobicContact CB-CB 4.17Å; L46-A50 WeakPolarHBondContact O-CB 3.34Å; L46-A50 PolarHBondContact O-N 3.45Å; A50-K52 PolarHBondContact O-N 2.71Å; A50-N53 PolarHBondContact O-N 3.14Å; A50-V54 WeakPolarHBondContact O-CG2 3.43Å; A50-V54 PolarHBondContact O-N 2.69Å; A50-V54 VanDerWaalsContact O-N 3.09Å
51Y98.7Very high97.9Very high2 Ų241.4 Ų41.41%0.00823%0.23CC..Hα-helixtrans-71.9-31.9-174.8-78-74.5000112.9A26 L47 N53 V54 V55 I96 E99 V100 L103 Y128A26-Y51 HydrophobicContact CB-CD1 4.11Å; A26-Y51 HydrophobicContact CB-CD2 4.46Å; A26-Y51 HydrophobicContact CB-CE1 3.91Å; A26-Y51 HydrophobicContact CB-CE2 4.25Å; A26-Y51 HydrophobicContact CB-CG 4.39Å; L47-Y51 HydrophobicContact CD1-CD2 3.64Å; L47-Y51 HydrophobicContact CD1-CE2 3.49Å; L47-Y51 VanDerWaalsContact CD1-CE2 3.49Å; L47-Y51 HydrophobicContact CG-CD2 4.21Å; L47-Y51 HydrophobicContact CG-CE2 4.49Å; L47-Y51 PolarHBondContact O-N 3Å; Y51-N53 VanDerWaalsContact C-N 3.3Å; Y51-N53 PolarHBondContact O-N 3.34Å; Y51-V54 PolarHBondContact O-N 2.91Å; Y51-V55 WeakPolarHBondContact O-CB 3.25Å; Y51-V55 VanDerWaalsContact O-CG1 3.25Å; Y51-V55 WeakPolarHBondContact O-CG1 3.14Å; Y51-V55 PolarHBondContact O-N 2.95Å; Y51-I96 HydrophobicContact CD1-CG2 4.21Å; Y51-E99 HydrophobicContact CE1-CG 4.47Å; Y51-E99 VanDerWaalsContact CE1-OE1 3.22Å; Y51-E99 WeakPolarHBondContact CE1-OE1 3.45Å; Y51-E99 VanDerWaalsContact CZ-OE1 3.3Å; Y51-E99 PolarHBondContact OH-OE1 3.29Å; Y51-V100 HydrophobicContact CD1-CG2 3.22Å; Y51-V100 HydrophobicContact CD2-CG2 3.86Å; Y51-V100 HydrophobicContact CE1-CG2 3.55Å; Y51-V100 HydrophobicContact CE2-CG2 4.15Å; Y51-V100 HydrophobicContact CG-CG2 3.37Å; Y51-L103 HydrophobicContact CE2-CD1 3.86Å; Y51-L103 WeakPolarHBondContact OH-CD1 3.42Å; Y51-Y128 WeakPolarHBondContact CB-OH 3.28Å; Y51-Y128 PolarHBondContact O-OH 2.79Å
52K98.1Very high98.1Very high134 Ų13439.3 Ų39.358%0.58322%0.216SC*.Hα-helixtrans-58.3-43.2174.1179.4-175.5175.5-171.90111.3S48 A50 G56 Y128S48-K52 WeakPolarHBondContact O-CB 3.28Å; S48-K52 PolarHBondContact O-N 2.78Å; A50-K52 PolarHBondContact O-N 2.71Å; K52-G56 WeakPolarHBondContact O-CA 3.39Å; K52-G56 PolarHBondContact O-N 3.32Å; K52-Y128 PolarHBondContact N-OH 2.85Å
53N98.3Very high98.1Very high57 Ų5739.1 Ų39.131%0.30521%0.211SC..Hα-helixtrans-72.2-43.9178.5-78.2-69.3000112.2Y22 V49 A50 Y51 V55 G56 A57Y22-N53 HydrophobicContact CD1-CB 3.65Å; Y22-N53 HydrophobicContact CD2-CB 3.38Å; Y22-N53 HydrophobicContact CE1-CB 4.01Å; Y22-N53 WeakPolarHBondContact CE1-ND2 3.41Å; Y22-N53 HydrophobicContact CE2-CB 3.73Å; Y22-N53 HydrophobicContact CG-CB 3.3Å; V49-N53 PolarHBondContact O-N 2.88Å; V49-N53 VanDerWaalsContact O-N 3.13Å; V49-N53 PolarHBondContact O-ND2 3.26Å; A50-N53 PolarHBondContact O-N 3.14Å; Y51-N53 VanDerWaalsContact C-N 3.3Å; Y51-N53 PolarHBondContact O-N 3.34Å; N53-V55 PolarHBondContact O-N 3.11Å; N53-G56 PolarHBondContact O-N 3.24Å; N53-A57 PolarHBondContact O-N 3.44Å
54V98.4Very high98.1Very high7 Ų742.1 Ų42.14%0.04223%0.231CC..Hα-helixtrans-58.4-50.9177.5171.90000111.4Y22 A26 A50 Y51 R58 I96Y22-V54 VanDerWaalsContact C-CG2 3.45Å; Y22-V54 WeakPolarHBondContact O-CG2 3.41Å; A26-V54 HydrophobicContact CB-CG2 4.18Å; A50-V54 WeakPolarHBondContact O-CG2 3.43Å; A50-V54 PolarHBondContact O-N 2.69Å; A50-V54 VanDerWaalsContact O-N 3.09Å; Y51-V54 PolarHBondContact O-N 2.91Å; V54-R58 VanDerWaalsContact O-CD 3.28Å; V54-R58 WeakPolarHBondContact O-CD 3.43Å; V54-I96 HydrophobicContact CG1-CD1 3.67Å; V54-I96 HydrophobicContact CG1-CG1 4Å; V54-I96 HydrophobicContact CG1-CG2 4.1Å
55V98.5Very high98Very high2 Ų242.3 Ų42.31%0.01223%0.232CC..Hα-helixtrans-70-36178.878.50000111.6Y51 N53 A57 R58 R59 L93 I96 Y128 Y131Y51-V55 WeakPolarHBondContact O-CB 3.25Å; Y51-V55 VanDerWaalsContact O-CG1 3.25Å; Y51-V55 WeakPolarHBondContact O-CG1 3.14Å; Y51-V55 PolarHBondContact O-N 2.95Å; N53-V55 PolarHBondContact O-N 3.11Å; V55-A57 PolarHBondContact O-N 3.41Å; V55-R58 PolarHBondContact O-N 2.92Å; V55-R59 WeakPolarHBondContact O-CG 3.43Å; V55-R59 PolarHBondContact O-N 2.55Å; V55-L93 HydrophobicContact CG2-CG 4.37Å; V55-I96 HydrophobicContact CB-CG2 4.04Å; V55-I96 HydrophobicContact CG2-CG2 4.31Å; V55-Y128 HydrophobicContact CB-CE1 4.05Å; V55-Y128 HydrophobicContact CG1-CE1 3.94Å; V55-Y128 HydrophobicContact CG2-CE1 4.2Å; V55-Y131 HydrophobicContact CG1-CD2 3.93Å; V55-Y131 HydrophobicContact CG1-CE2 3.8Å; V55-Y131 HydrophobicContact CG2-CD2 3.97Å
56G98.2Very high97.9Very high23 Ų2339.5 Ų39.524%0.23722%0.218CC..Hα-helixtrans-58.6-44.6177.300000112.4K52 N53 R58 R59 S60K52-G56 WeakPolarHBondContact O-CA 3.39Å; K52-G56 PolarHBondContact O-N 3.32Å; N53-G56 PolarHBondContact O-N 3.24Å; G56-R58 VanDerWaalsContact C-N 3.35Å; G56-R58 PolarHBondContact O-N 2.93Å; G56-R59 PolarHBondContact O-N 3.43Å; G56-S60 PolarHBondContact O-N 3.3Å; G56-S60 PolarHBondContact O-OG 2.93Å
57A98.1Very high97.7Very high50 Ų5042.1 Ų42.141%0.41324%0.237SC..Hα-helixtrans-61.1-40.817700000112.7N53 V55 S61N53-A57 PolarHBondContact O-N 3.44Å; V55-A57 PolarHBondContact O-N 3.41Å; A57-S61 WeakPolarHBondContact O-CB 3.43Å; A57-S61 PolarHBondContact O-N 3.49Å; A57-S61 PolarHBondContact O-OG 3.37Å
58R98.4Very high97.4Very high58 Ų5844.7 Ų44.722%0.21925%0.251CS..Hα-helixtrans-70.7-40.3177.7-84.768.3-177.8-165.9-1.8111.3D23 V54 V55 G56 S61 W62 V89 E92 L93 I96D23-R58 IonicContact OD1-CZ 3.09Å; D23-R58 IonicContact OD1-NH1 3.56Å; D23-R58 PolarHBondContact OD1-NH1 2.69Å; D23-R58 VanDerWaalsContact OD1-NH1 3.12Å; D23-R58 IonicContact OD1-NH2 3.76Å; D23-R58 IonicContact OD2-NH1 3.79Å; V54-R58 VanDerWaalsContact O-CD 3.28Å; V54-R58 WeakPolarHBondContact O-CD 3.43Å; V55-R58 PolarHBondContact O-N 2.92Å; G56-R58 VanDerWaalsContact C-N 3.35Å; G56-R58 PolarHBondContact O-N 2.93Å; R58-S61 PolarHBondContact O-N 3.49Å; R58-W62 WeakPolarHBondContact O-CB 3.2Å; R58-W62 PolarHBondContact O-N 3.09Å; R58-V89 HydrophobicContact CB-CG1 4.28Å; R58-V89 HydrophobicContact CG-CG1 4.5Å; R58-V89 VanDerWaalsContact O-CG1 3.28Å; R58-V89 WeakPolarHBondContact O-CG1 3.33Å; R58-E92 HydrophobicContact CG-CB 4.26Å; R58-E92 IonicContact NE-OE2 3.17Å; R58-L93 HydrophobicContact CB-CB 4.33Å; R58-I96 HydrophobicContact CG-CD1 3.98Å
59R98.1Very high97.2Very high29 Ų2944.4 Ų44.411%0.10925%0.246CC..Hα-helixtrans-60.8-46174.1-72.8178.271.8-140.211.9112.4V55 G56 S61 W62 R63 L93 Y131 E134V55-R59 WeakPolarHBondContact O-CG 3.43Å; V55-R59 PolarHBondContact O-N 2.55Å; G56-R59 PolarHBondContact O-N 3.43Å; R59-S61 VanDerWaalsContact C-N 3.34Å; R59-S61 PolarHBondContact O-N 2.98Å; R59-W62 PolarHBondContact O-N 3.16Å; R59-R63 VanDerWaalsContact CZ-NH2 3.29Å; R59-R63 WeakPolarHBondContact O-CG 3.45Å; R59-R63 PolarHBondContact O-N 3.15Å; R59-L93 HydrophobicContact CB-CD1 4.49Å; R59-L93 HydrophobicContact CG-CD1 3.54Å; R59-Y131 VanDerWaalsContact CZ-CD1 3.44Å; R59-E134 IonicContact CZ-OE2 2.85Å; R59-E134 IonicContact NE-OE2 2.69Å; R59-E134 PolarHBondContact NE-OE2 3.48Å; R59-E134 IonicContact NH2-OE1 3.57Å; R59-E134 IonicContact NH2-OE2 3.47Å; R59-E134 PolarHBondContact NH2-OE2 2.95Å
60S98.2Very high96.7Very high67 Ų6749.7 Ų49.747%0.46927%0.267SS..Hα-helixtrans-61.4-44.6176.6-65.80000111.4G56 R63 V64G56-S60 PolarHBondContact O-N 3.3Å; G56-S60 PolarHBondContact O-OG 2.93Å; S60-R63 PolarHBondContact O-N 3.03Å; S60-V64 WeakPolarHBondContact O-CG2 3.45Å; S60-V64 PolarHBondContact O-N 3.12Å
61S98Very high96.3Very high56 Ų5655.5 Ų55.539%0.39229%0.293SS..Hα-helixtrans-60-47.3175.6-62.90000111.3A57 R58 R59 R63 V64 I65A57-S61 WeakPolarHBondContact O-CB 3.43Å; A57-S61 PolarHBondContact O-N 3.49Å; A57-S61 PolarHBondContact O-OG 3.37Å; R58-S61 PolarHBondContact O-N 3.49Å; R59-S61 VanDerWaalsContact C-N 3.34Å; R59-S61 PolarHBondContact O-N 2.98Å; S61-R63 PolarHBondContact O-N 3.34Å; S61-V64 PolarHBondContact O-N 2.89Å; S61-I65 VanDerWaalsContact O-CD1 3.23Å; S61-I65 WeakPolarHBondContact O-CD1 3.45Å; S61-I65 WeakPolarHBondContact O-CG1 3.47Å; S61-I65 PolarHBondContact O-N 3.27Å
62W98.1Very high95.3Very high39 Ų3961.8 Ų61.815%0.14833%0.331CS..Hα-helixtrans-56.7-48.8178178.580.1000112.1R58 R59 V64 I65 S66 V89 E90 E134 V135R58-W62 WeakPolarHBondContact O-CB 3.2Å; R58-W62 PolarHBondContact O-N 3.09Å; R59-W62 PolarHBondContact O-N 3.16Å; W62-V64 VanDerWaalsContact C-N 3.35Å; W62-V64 PolarHBondContact O-N 2.94Å; W62-I65 PolarHBondContact O-N 2.85Å; W62-S66 WeakPolarHBondContact O-CB 3.44Å; W62-S66 PolarHBondContact O-N 3.01Å; W62-S66 PolarHBondContact O-OG 3Å; W62-V89 HydrophobicContact CB-CG1 3.84Å; W62-E90 VanDerWaalsContact CD1-CG 3.41Å; W62-E90 VanDerWaalsContact NE1-CG 3.32Å; W62-E90 PolarHBondContact NE1-OE1 2.93Å; W62-E134 HydrophobicContact CE3-CG 4.38Å; W62-E134 HydrophobicContact CH2-CG 4.07Å; W62-E134 WeakPolarHBondContact CH2-O 3.4Å; W62-E134 HydrophobicContact CZ3-CG 3.66Å; W62-V135 HydrophobicContact CD2-CG1 3.77Å; W62-V135 HydrophobicContact CE3-CG1 4.24Å; W62-V135 HydrophobicContact CG-CG1 4.11Å; W62-V135 HydrophobicContact CH2-CG1 4.41Å; W62-V135 HydrophobicContact CZ2-CB 4.38Å; W62-V135 HydrophobicContact CZ2-CG1 3.96Å
63R97.2Very high94.6Very high98 Ų9864.5 Ų64.537%0.3735%0.346SS..Hα-helixtrans-58.9-44.4178.6-70.8-176.5-171.8125.3-4.6112.9R59 S60 S61 S67 E134R59-R63 VanDerWaalsContact CZ-NH2 3.29Å; R59-R63 WeakPolarHBondContact O-CG 3.45Å; R59-R63 PolarHBondContact O-N 3.15Å; S60-R63 PolarHBondContact O-N 3.03Å; S61-R63 PolarHBondContact O-N 3.34Å; R63-S67 WeakPolarHBondContact O-CB 3.45Å; R63-S67 PolarHBondContact O-N 3.12Å; R63-E134 IonicContact CZ-OE1 3.66Å; R63-E134 IonicContact NE-OE1 3.08Å; R63-E134 PolarHBondContact NE-OE1 2.86Å; R63-E134 IonicContact NH2-OE1 3Å; R63-E134 PolarHBondContact NH2-OE1 3.28Å; R63-E134 IonicContact NH2-OE2 2.91Å; R63-E134 PolarHBondContact NH2-OE2 3.32Å
64V96.6Very high93.7Very high88 Ų8862.4 Ų62.453%0.53334%0.337SS..Hα-helixtrans-62.8-45.6178.7171.80000110.5S60 S61 W62 S67 I68S60-V64 WeakPolarHBondContact O-CG2 3.45Å; S60-V64 PolarHBondContact O-N 3.12Å; S61-V64 PolarHBondContact O-N 2.89Å; W62-V64 VanDerWaalsContact C-N 3.35Å; W62-V64 PolarHBondContact O-N 2.94Å; V64-S67 PolarHBondContact O-N 2.85Å; V64-I68 HydrophobicContact CG1-CD1 3.93Å; V64-I68 VanDerWaalsContact O-CG1 3.31Å; V64-I68 WeakPolarHBondContact O-CG1 3.4Å; V64-I68 PolarHBondContact O-N 3.33Å
65I96.1Very high93.3Very high15 Ų1565.6 Ų65.68%0.07736%0.359CS..Hα-helixtrans-69.1-42.3-178.2-59.1155.2000110.9S61 W62 S67 I68 E69 A82 Y85 R86 V89S61-I65 VanDerWaalsContact O-CD1 3.23Å; S61-I65 WeakPolarHBondContact O-CD1 3.45Å; S61-I65 WeakPolarHBondContact O-CG1 3.47Å; S61-I65 PolarHBondContact O-N 3.27Å; W62-I65 PolarHBondContact O-N 2.85Å; I65-S67 VanDerWaalsContact C-N 3.29Å; I65-S67 PolarHBondContact O-N 3.09Å; I65-I68 WeakPolarHBondContact O-CB 3.46Å; I65-I68 PolarHBondContact O-N 3.39Å; I65-E69 PolarHBondContact O-N 2.93Å; I65-A82 WeakPolarHBondContact CG2-O 3.46Å; I65-Y85 HydrophobicContact CD1-CD1 3.27Å; I65-Y85 HydrophobicContact CD1-CE1 3.43Å; I65-Y85 VanDerWaalsContact CD1-CE1 3.43Å; I65-Y85 HydrophobicContact CD1-CG 4.35Å; I65-Y85 HydrophobicContact CG1-CD1 3.76Å; I65-Y85 HydrophobicContact CG1-CE1 4.11Å; I65-Y85 HydrophobicContact CG2-CD1 4.27Å; I65-R86 HydrophobicContact CG2-CB 3.81Å; I65-V89 HydrophobicContact CD1-CB 4.41Å; I65-V89 HydrophobicContact CD1-CG2 3.62Å
66S95.1Very high92.9Very high15 Ų1569.3 Ų69.311%0.10539%0.39CS..Hα-helixtrans-57.8-42.1174.1-65.10000111.6W62 E69 Q70 R86W62-S66 WeakPolarHBondContact O-CB 3.44Å; W62-S66 PolarHBondContact O-N 3.01Å; W62-S66 PolarHBondContact O-OG 3Å; S66-E69 PolarHBondContact O-N 2.96Å; S66-Q70 WeakPolarHBondContact O-CG 3.19Å; S66-Q70 PolarHBondContact O-N 3.47Å; S66-Q70 VanDerWaalsContact O-N 3.15Å; S66-R86 WeakPolarHBondContact OG-CD 3.36Å
67S94.2Very high92.6Very high63 Ų6377.3 Ų77.344%0.44141%0.413SS..Hα-helixtrans-63.4-40.3173.6179.60000112.2R63 V64 I65 Q70 K71R63-S67 WeakPolarHBondContact O-CB 3.45Å; R63-S67 PolarHBondContact O-N 3.12Å; V64-S67 PolarHBondContact O-N 2.85Å; I65-S67 VanDerWaalsContact C-N 3.29Å; I65-S67 PolarHBondContact O-N 3.09Å; S67-Q70 PolarHBondContact O-N 3.34Å; S67-K71 WeakPolarHBondContact O-CG 3.36Å; S67-K71 PolarHBondContact O-N 3.36Å
68I92.8Very high92.3Very high58 Ų5880.5 Ų80.530%0.29742%0.418SS..Hα-helixtrans-65.5-40.7176.4-68.3164.6000111.5V64 I65 Q70 K71 A82V64-I68 HydrophobicContact CG1-CD1 3.93Å; V64-I68 VanDerWaalsContact O-CG1 3.31Å; V64-I68 WeakPolarHBondContact O-CG1 3.4Å; V64-I68 PolarHBondContact O-N 3.33Å; I65-I68 WeakPolarHBondContact O-CB 3.46Å; I65-I68 PolarHBondContact O-N 3.39Å; I68-Q70 VanDerWaalsContact C-N 3.28Å; I68-Q70 PolarHBondContact O-N 3.46Å; I68-K71 PolarHBondContact O-N 3.48Å; I68-A82 HydrophobicContact CG2-CB 4.15Å
69E92.2Very high92Very high27 Ų2781.2 Ų81.213%0.12642%0.423CS..Hα-helixtrans-60.7-38.9177.1-174.9-178.8172.500111.4I65 S66 K71 A82 R83 R86I65-E69 PolarHBondContact O-N 2.93Å; S66-E69 PolarHBondContact O-N 2.96Å; E69-K71 VanDerWaalsContact C-N 3.33Å; E69-K71 PolarHBondContact O-N 3.23Å; E69-A82 HydrophobicContact CB-CB 3.93Å; E69-A82 HydrophobicContact CG-CB 4.46Å; E69-R83 HydrophobicContact CG-CB 4.47Å; E69-R83 WeakPolarHBondContact OE1-CB 3.45Å; E69-R83 IonicContact OE1-CZ 3.43Å; E69-R83 IonicContact OE1-NE 2.84Å; E69-R83 PolarHBondContact OE1-NE 2.88Å; E69-R83 IonicContact OE1-NH2 3.17Å; E69-R83 PolarHBondContact OE1-NH2 3.29Å; E69-R86 IonicContact OE1-NH2 3.96Å; E69-R86 WeakPolarHBondContact OE2-CD 3.33Å; E69-R86 IonicContact OE2-CZ 3.69Å; E69-R86 IonicContact OE2-NE 3.89Å; E69-R86 PolarHBondContact OE2-NE 2.99Å; E69-R86 IonicContact OE2-NH2 3.59Å
70Q89.6Confident91.9Very high156 Ų15685.3 Ų85.373%0.72944%0.444SS*.Hα-helixtrans-77.9-9.3-178.2-69.9174.7-1.500114.6S66 S67 I68 T72S66-Q70 WeakPolarHBondContact O-CG 3.19Å; S66-Q70 PolarHBondContact O-N 3.47Å; S66-Q70 VanDerWaalsContact O-N 3.15Å; S67-Q70 PolarHBondContact O-N 3.34Å; I68-Q70 VanDerWaalsContact C-N 3.28Å; I68-Q70 PolarHBondContact O-N 3.46Å; Q70-T72 PolarHBondContact O-N 3.24Å
71K89.3Confident91.7Very high122 Ų12286.8 Ų86.853%0.5345%0.446SS..  trans-66.9120.3-180-76.7-180-178-172.80111.3S67 I68 E69 E73 A74S67-K71 WeakPolarHBondContact O-CG 3.36Å; S67-K71 PolarHBondContact O-N 3.36Å; I68-K71 PolarHBondContact O-N 3.48Å; E69-K71 VanDerWaalsContact C-N 3.33Å; E69-K71 PolarHBondContact O-N 3.23Å; K71-E73 VanDerWaalsContact C-N 3.33Å; K71-E73 PolarHBondContact O-N 3.15Å; K71-A74 WeakPolarHBondContact O-CB 3.22Å; K71-A74 PolarHBondContact O-N 3.08Å
72T77Confident91.6Very high133 Ų13384.6 Ų84.682%0.81643%0.431SS*.THydrogen-bonded Turntrans-64.8-30-175.447.50000114.1Q70 A74Q70-T72 PolarHBondContact O-N 3.24Å; T72-A74 VanDerWaalsContact C-N 3.27Å; T72-A74 PolarHBondContact O-N 3.48Å
73E84.9Confident91.5Very high191 Ų19189.1 Ų89.189%0.89345%0.448SS*.THydrogen-bonded Turntrans-80.3-3-178.9-60.9179.2172.100113.9K71K71-E73 VanDerWaalsContact C-N 3.33Å; K71-E73 PolarHBondContact O-N 3.15Å
74A78.7Confident91.5Very high14 Ų1489 Ų8912%0.11645%0.452CS..SBendtrans-75.1138.1-179.200000111.5K71 T72 K78 Q79K71-A74 WeakPolarHBondContact O-CB 3.22Å; K71-A74 PolarHBondContact O-N 3.08Å; T72-A74 VanDerWaalsContact C-N 3.27Å; T72-A74 PolarHBondContact O-N 3.48Å; A74-K78 HydrophobicContact CB-CB 4.25Å; A74-K78 HydrophobicContact CB-CD 4.04Å; A74-K78 HydrophobicContact CB-CG 4.26Å; A74-Q79 HydrophobicContact CB-CG 3.79Å; A74-Q79 PolarHBondContact O-NE2 3.02Å
75S89.9Confident91.5Very high74 Ų7491 Ų9152%0.51745%0.451SS..  trans-60151.6170.367.50000110.9R77 K78 Q79S75-R77 PolarHBondContact O-N 3.46Å; S75-R77 VanDerWaalsContact O-N 3.11Å; S75-K78 WeakPolarHBondContact O-CA 3.48Å; S75-K78 WeakPolarHBondContact O-CB 3.36Å; S75-K78 PolarHBondContact O-N 3.25Å; S75-K78 PolarHBondContact OG-N 3.42Å; S75-Q79 PolarHBondContact O-N 2.86Å
76A90.3Very high91.6Very high79 Ų7992.3 Ų92.365%0.65346%0.455SS*.Hα-helixtrans-51.7-38.5177.100000112.4Q79 Q80A76-Q79 PolarHBondContact O-N 3.27Å; A76-Q80 WeakPolarHBondContact O-CB 3.43Å; A76-Q80 PolarHBondContact O-N 2.91Å
77R92Very high91.7Very high191 Ų19196 Ų9672%0.72147%0.471SS*.Hα-helixtrans-62.8-42174.8-175.6177-179.6-178.20.6112.5S75 L81S75-R77 PolarHBondContact O-N 3.46Å; S75-R77 VanDerWaalsContact O-N 3.11Å; R77-L81 HydrophobicContact CG-CD1 4.29Å; R77-L81 VanDerWaalsContact O-CG 3.32Å; R77-L81 WeakPolarHBondContact O-CG 3.35Å; R77-L81 PolarHBondContact O-N 3.1Å
78K91.6Very high91.9Very high118 Ų118100.3 Ų100.351%0.51348%0.477SS..Hα-helixtrans-68.9-39.2178.6-175.5177.1179-178.50111.4A74 S75 L81 A82A74-K78 HydrophobicContact CB-CB 4.25Å; A74-K78 HydrophobicContact CB-CD 4.04Å; A74-K78 HydrophobicContact CB-CG 4.26Å; S75-K78 WeakPolarHBondContact O-CA 3.48Å; S75-K78 WeakPolarHBondContact O-CB 3.36Å; S75-K78 PolarHBondContact O-N 3.25Å; S75-K78 PolarHBondContact OG-N 3.42Å; K78-L81 PolarHBondContact O-N 3.33Å; K78-A82 WeakPolarHBondContact O-CB 3.34Å; K78-A82 PolarHBondContact O-N 3.22Å
79Q93Very high92.2Very high72 Ų7297.8 Ų97.834%0.33646%0.464SS..Hα-helixtrans-62.5-44.3174.5-69.4178.2-10.500111.5A74 S75 A76 A82 R83A74-Q79 HydrophobicContact CB-CG 3.79Å; A74-Q79 PolarHBondContact O-NE2 3.02Å; S75-Q79 PolarHBondContact O-N 2.86Å; A76-Q79 PolarHBondContact O-N 3.27Å; Q79-A82 PolarHBondContact O-N 2.82Å; Q79-R83 PolarHBondContact O-N 3.37Å
80Q94.3Very high92.4Very high116 Ų11697.6 Ų97.654%0.54246%0.464SS..Hα-helixtrans-60.2-48.4175.5-176.9-177.1-8.300111.9A76 A82 R83 E84A76-Q80 WeakPolarHBondContact O-CB 3.43Å; A76-Q80 PolarHBondContact O-N 2.91Å; Q80-A82 VanDerWaalsContact C-N 3.3Å; Q80-A82 PolarHBondContact O-N 3.21Å; Q80-R83 WeakPolarHBondContact O-CB 3.4Å; Q80-R83 PolarHBondContact O-N 3.38Å; Q80-E84 WeakPolarHBondContact CG-OE1 3.44Å; Q80-E84 PolarHBondContact NE2-OE1 3.48Å; Q80-E84 WeakPolarHBondContact O-CG 3.45Å; Q80-E84 PolarHBondContact O-N 3.34Å
81L95.4Very high92.8Very high97 Ų9795.8 Ų95.851%0.50845%0.453SS..Hα-helixtrans-61.5-38.9177.7-71.4170.7000112.1R77 K78 Y85R77-L81 HydrophobicContact CG-CD1 4.29Å; R77-L81 VanDerWaalsContact O-CG 3.32Å; R77-L81 WeakPolarHBondContact O-CG 3.35Å; R77-L81 PolarHBondContact O-N 3.1Å; K78-L81 PolarHBondContact O-N 3.33Å; L81-Y85 WeakPolarHBondContact O-CB 3.25Å; L81-Y85 PolarHBondContact O-N 2.98Å; L81-Y85 VanDerWaalsContact O-N 3.08Å
82A95.5Very high93.3Very high10 Ų1092.4 Ų92.48%0.08344%0.439CS..Hα-helixtrans-64-42.3175.600000111.5I65 I68 E69 K78 Q79 Q80 Y85 R86I65-A82 WeakPolarHBondContact CG2-O 3.46Å; I68-A82 HydrophobicContact CG2-CB 4.15Å; E69-A82 HydrophobicContact CB-CB 3.93Å; E69-A82 HydrophobicContact CG-CB 4.46Å; K78-A82 WeakPolarHBondContact O-CB 3.34Å; K78-A82 PolarHBondContact O-N 3.22Å; Q79-A82 PolarHBondContact O-N 2.82Å; Q80-A82 VanDerWaalsContact C-N 3.3Å; Q80-A82 PolarHBondContact O-N 3.21Å; A82-Y85 PolarHBondContact O-N 3.13Å; A82-R86 WeakPolarHBondContact O-CB 3.09Å; A82-R86 PolarHBondContact O-N 3.36Å
83R96Very high94.3Very high134 Ų13486 Ų8651%0.50640%0.4SS..Hα-helixtrans-60.5-52.3175.4178.5173.4-62.9-161.62.2112.5E69 Q79 Q80 Y85 R86 E87E69-R83 HydrophobicContact CG-CB 4.47Å; E69-R83 WeakPolarHBondContact OE1-CB 3.45Å; E69-R83 IonicContact OE1-CZ 3.43Å; E69-R83 IonicContact OE1-NE 2.84Å; E69-R83 PolarHBondContact OE1-NE 2.88Å; E69-R83 IonicContact OE1-NH2 3.17Å; E69-R83 PolarHBondContact OE1-NH2 3.29Å; Q79-R83 PolarHBondContact O-N 3.37Å; Q80-R83 WeakPolarHBondContact O-CB 3.4Å; Q80-R83 PolarHBondContact O-N 3.38Å; R83-Y85 PolarHBondContact O-N 3Å; R83-R86 WeakPolarHBondContact O-CB 3.48Å; R83-R86 PolarHBondContact O-N 3.48Å; R83-R86 VanDerWaalsContact O-N 3.12Å; R83-E87 HydrophobicContact CG-CG 4.48Å; R83-E87 WeakPolarHBondContact CG-OE1 3.32Å; R83-E87 WeakPolarHBondContact O-CG 3.31Å; R83-E87 PolarHBondContact O-N 2.93Å
84E97.2Very high94.9Very high97 Ų9782.6 Ų82.645%0.45338%0.379SS..Hα-helixtrans-57.6-39.6179.7-71.8171.2-17100111Q80 R88Q80-E84 WeakPolarHBondContact CG-OE1 3.44Å; Q80-E84 PolarHBondContact NE2-OE1 3.48Å; Q80-E84 WeakPolarHBondContact O-CG 3.45Å; Q80-E84 PolarHBondContact O-N 3.34Å; E84-R88 PolarHBondContact O-N 3.42Å; E84-R88 VanDerWaalsContact O-N 3.16Å
85Y97.5Very high95.9Very high128 Ų12887 Ų8750%0.50240%0.398SS..Hα-helixtrans-72.4-38177.2-160.9-118000112.7I65 L81 A82 R83 R88 V89I65-Y85 HydrophobicContact CD1-CD1 3.27Å; I65-Y85 HydrophobicContact CD1-CE1 3.43Å; I65-Y85 VanDerWaalsContact CD1-CE1 3.43Å; I65-Y85 HydrophobicContact CD1-CG 4.35Å; I65-Y85 HydrophobicContact CG1-CD1 3.76Å; I65-Y85 HydrophobicContact CG1-CE1 4.11Å; I65-Y85 HydrophobicContact CG2-CD1 4.27Å; L81-Y85 WeakPolarHBondContact O-CB 3.25Å; L81-Y85 PolarHBondContact O-N 2.98Å; L81-Y85 VanDerWaalsContact O-N 3.08Å; A82-Y85 PolarHBondContact O-N 3.13Å; R83-Y85 PolarHBondContact O-N 3Å; Y85-R88 WeakPolarHBondContact O-CB 3.22Å; Y85-R88 PolarHBondContact O-N 3.5Å; Y85-V89 WeakPolarHBondContact O-CG2 3.4Å; Y85-V89 PolarHBondContact O-N 2.88Å; Y85-V89 VanDerWaalsContact O-N 3.09Å
86R97.3Very high96.3Very high43 Ų4384.5 Ų84.516%0.16238%0.378CS..Hα-helixtrans-58.1-50.3172.9-178.7-175.65476.48110.4I65 S66 E69 A82 R83 R88 V89 E90I65-R86 HydrophobicContact CG2-CB 3.81Å; S66-R86 WeakPolarHBondContact OG-CD 3.36Å; E69-R86 IonicContact OE1-NH2 3.96Å; E69-R86 WeakPolarHBondContact OE2-CD 3.33Å; E69-R86 IonicContact OE2-CZ 3.69Å; E69-R86 IonicContact OE2-NE 3.89Å; E69-R86 PolarHBondContact OE2-NE 2.99Å; E69-R86 IonicContact OE2-NH2 3.59Å; A82-R86 WeakPolarHBondContact O-CB 3.09Å; A82-R86 PolarHBondContact O-N 3.36Å; R83-R86 WeakPolarHBondContact O-CB 3.48Å; R83-R86 PolarHBondContact O-N 3.48Å; R83-R86 VanDerWaalsContact O-N 3.12Å; R86-R88 VanDerWaalsContact C-N 3.27Å; R86-R88 PolarHBondContact O-N 3.25Å; R86-V89 PolarHBondContact O-N 3.21Å; R86-E90 HydrophobicContact CG-CG 4.42Å; R86-E90 IonicContact CZ-OE1 3.09Å; R86-E90 IonicContact NH1-OE1 3.59Å; R86-E90 PolarHBondContact NH1-OE1 3.25Å; R86-E90 IonicContact NH1-OE2 2.63Å; R86-E90 PolarHBondContact NH1-OE2 3.32Å; R86-E90 VanDerWaalsContact NH1-OE2 3.09Å; R86-E90 WeakPolarHBondContact O-CG 3.44Å; R86-E90 PolarHBondContact O-N 3.08Å
87E97.4Very high96.7Very high94 Ų9480.8 Ų80.844%0.43935%0.347SS..Hα-helixtrans-61.1-35.5-179.1-71.9173.5-176.500112.3R83 E90 K91R83-E87 HydrophobicContact CG-CG 4.48Å; R83-E87 WeakPolarHBondContact CG-OE1 3.32Å; R83-E87 WeakPolarHBondContact O-CG 3.31Å; R83-E87 PolarHBondContact O-N 2.93Å; E87-E90 PolarHBondContact O-N 3.38Å; E87-K91 PolarHBondContact O-N 3.44Å
88R98.2Very high97Very high153 Ų15377.7 Ų77.758%0.57734%0.336SS*.Hα-helixtrans-61.9-48.8171.1178.5-179.2172.2164.71.7111.7E84 Y85 R86 E90 K91 E92E84-R88 PolarHBondContact O-N 3.42Å; E84-R88 VanDerWaalsContact O-N 3.16Å; Y85-R88 WeakPolarHBondContact O-CB 3.22Å; Y85-R88 PolarHBondContact O-N 3.5Å; R86-R88 VanDerWaalsContact C-N 3.27Å; R86-R88 PolarHBondContact O-N 3.25Å; R88-E90 VanDerWaalsContact C-N 3.3Å; R88-E90 PolarHBondContact O-N 2.78Å; R88-K91 WeakPolarHBondContact O-CB 3.14Å; R88-K91 PolarHBondContact O-N 3.46Å; R88-E92 IonicContact CZ-OE1 3.83Å; R88-E92 IonicContact NE-OE1 3.91Å; R88-E92 PolarHBondContact NE-OE1 3.49Å; R88-E92 VanDerWaalsContact NE-OE1 3.09Å; R88-E92 IonicContact NH2-OE1 3.96Å; R88-E92 WeakPolarHBondContact O-CG 3.22Å; R88-E92 PolarHBondContact O-N 3.4Å
89V98.2Very high97.3Very high5 Ų575.2 Ų75.23%0.0333%0.327CS..Hα-helixtrans-63.9-37.1178.71770000111.3R58 W62 I65 Y85 R86 K91 E92 L93R58-V89 HydrophobicContact CB-CG1 4.28Å; R58-V89 HydrophobicContact CG-CG1 4.5Å; R58-V89 VanDerWaalsContact O-CG1 3.28Å; R58-V89 WeakPolarHBondContact O-CG1 3.33Å; W62-V89 HydrophobicContact CB-CG1 3.84Å; I65-V89 HydrophobicContact CD1-CB 4.41Å; I65-V89 HydrophobicContact CD1-CG2 3.62Å; Y85-V89 WeakPolarHBondContact O-CG2 3.4Å; Y85-V89 PolarHBondContact O-N 2.88Å; Y85-V89 VanDerWaalsContact O-N 3.09Å; R86-V89 PolarHBondContact O-N 3.21Å; V89-K91 VanDerWaalsContact C-N 3.33Å; V89-K91 PolarHBondContact O-N 2.92Å; V89-E92 PolarHBondContact O-N 3.18Å; V89-L93 WeakPolarHBondContact O-CB 3.35Å; V89-L93 PolarHBondContact O-N 3.32Å
90E98.1Very high97.6Very high23 Ų2371.9 Ų71.911%0.10731%0.311CS..Hα-helixtrans-62.7-39.1173.7-70.8177174.800112.4W62 R86 E87 R88 R94 V135W62-E90 VanDerWaalsContact CD1-CG 3.41Å; W62-E90 VanDerWaalsContact NE1-CG 3.32Å; W62-E90 PolarHBondContact NE1-OE1 2.93Å; R86-E90 HydrophobicContact CG-CG 4.42Å; R86-E90 IonicContact CZ-OE1 3.09Å; R86-E90 IonicContact NH1-OE1 3.59Å; R86-E90 PolarHBondContact NH1-OE1 3.25Å; R86-E90 IonicContact NH1-OE2 2.63Å; R86-E90 PolarHBondContact NH1-OE2 3.32Å; R86-E90 VanDerWaalsContact NH1-OE2 3.09Å; R86-E90 WeakPolarHBondContact O-CG 3.44Å; R86-E90 PolarHBondContact O-N 3.08Å; E87-E90 PolarHBondContact O-N 3.38Å; R88-E90 VanDerWaalsContact C-N 3.3Å; R88-E90 PolarHBondContact O-N 2.78Å; E90-R94 WeakPolarHBondContact O-CB 3.31Å; E90-R94 VanDerWaalsContact O-CG 3.26Å; E90-R94 WeakPolarHBondContact O-CG 3.48Å; E90-R94 PolarHBondContact O-N 3Å; E90-R94 PolarHBondContact O-NE 2.94Å; E90-V135 HydrophobicContact CG-CB 4.07Å; E90-V135 HydrophobicContact CG-CG1 4.35Å
91K98.2Very high97.8Very high117 Ų11766.6 Ų66.651%0.50929%0.287SS..Hα-helixtrans-61.9-50.2173.5-178179.8170.3-1780111E87 R88 V89 L93 R94 E95E87-K91 PolarHBondContact O-N 3.44Å; R88-K91 WeakPolarHBondContact O-CB 3.14Å; R88-K91 PolarHBondContact O-N 3.46Å; V89-K91 VanDerWaalsContact C-N 3.33Å; V89-K91 PolarHBondContact O-N 2.92Å; K91-L93 VanDerWaalsContact C-N 3.34Å; K91-L93 PolarHBondContact O-N 2.86Å; K91-R94 PolarHBondContact O-N 3.15Å; K91-E95 WeakPolarHBondContact CE-OE1 3.36Å; K91-E95 IonicContact NZ-OE1 2.71Å; K91-E95 WeakPolarHBondContact O-CG 3.25Å; K91-E95 PolarHBondContact O-N 2.97Å
92E98.4Very high98Very high51 Ų5163.8 Ų63.824%0.23828%0.281CS..Hα-helixtrans-59-44.7178-67.2173.9-165.600111.4R58 R88 V89 R94 E95 I96R58-E92 HydrophobicContact CG-CB 4.26Å; R58-E92 IonicContact NE-OE2 3.17Å; R88-E92 IonicContact CZ-OE1 3.83Å; R88-E92 IonicContact NE-OE1 3.91Å; R88-E92 PolarHBondContact NE-OE1 3.49Å; R88-E92 VanDerWaalsContact NE-OE1 3.09Å; R88-E92 IonicContact NH2-OE1 3.96Å; R88-E92 WeakPolarHBondContact O-CG 3.22Å; R88-E92 PolarHBondContact O-N 3.4Å; V89-E92 PolarHBondContact O-N 3.18Å; E92-R94 PolarHBondContact O-N 3.44Å; E92-E95 PolarHBondContact O-N 3.49Å; E92-I96 WeakPolarHBondContact O-CD1 3.4Å; E92-I96 VanDerWaalsContact O-CG1 3.3Å; E92-I96 WeakPolarHBondContact O-CG1 3.38Å; E92-I96 PolarHBondContact O-N 2.91Å
93L98.4Very high98.1Very high0 Ų063.5 Ų63.50%028%0.278CS..Hα-helixtrans-60.4-45.3176.6-174.7155.7000111.6V55 R58 R59 V89 K91 I96 C97 L132 V135V55-L93 HydrophobicContact CG2-CG 4.37Å; R58-L93 HydrophobicContact CB-CB 4.33Å; R59-L93 HydrophobicContact CB-CD1 4.49Å; R59-L93 HydrophobicContact CG-CD1 3.54Å; V89-L93 WeakPolarHBondContact O-CB 3.35Å; V89-L93 PolarHBondContact O-N 3.32Å; K91-L93 VanDerWaalsContact C-N 3.34Å; K91-L93 PolarHBondContact O-N 2.86Å; L93-I96 PolarHBondContact O-N 3.27Å; L93-C97 WeakPolarHBondContact O-CB 3.04Å; L93-C97 PolarHBondContact O-N 3.13Å; L93-C97 PolarHBondContact O-SG 3.5Å; L93-L132 HydrophobicContact CD2-CD2 4.49Å; L93-V135 HydrophobicContact CD1-CG1 3.99Å; L93-V135 HydrophobicContact CD2-CG1 4.41Å; L93-V135 HydrophobicContact CD2-CG2 3.93Å
94R98.3Very high98.3Very high118 Ų11857.1 Ų57.145%0.44525%0.254SS..Hα-helixtrans-61.7-44177.5-77.1-175.7-65.5-173.2-1.2111.7E90 K91 E92 C97 Y98 L132E90-R94 WeakPolarHBondContact O-CB 3.31Å; E90-R94 VanDerWaalsContact O-CG 3.26Å; E90-R94 WeakPolarHBondContact O-CG 3.48Å; E90-R94 PolarHBondContact O-N 3Å; E90-R94 PolarHBondContact O-NE 2.94Å; K91-R94 PolarHBondContact O-N 3.15Å; E92-R94 PolarHBondContact O-N 3.44Å; R94-C97 PolarHBondContact O-N 2.79Å; R94-Y98 HydrophobicContact CB-CD2 4.36Å; R94-Y98 HydrophobicContact CB-CE2 4.42Å; R94-Y98 WeakPolarHBondContact O-CD2 3.44Å; R94-Y98 PolarHBondContact O-N 3.4Å; R94-L132 HydrophobicContact CB-CD2 4.16Å; R94-L132 HydrophobicContact CG-CD2 3.7Å
95E98.4Very high98.3Very high108 Ų10855.6 Ų55.651%0.50525%0.249SC..Hα-helixtrans-60-47.4177.8-72.8170.6177.100111.3K91 E92 C97 Y98 E99K91-E95 WeakPolarHBondContact CE-OE1 3.36Å; K91-E95 IonicContact NZ-OE1 2.71Å; K91-E95 WeakPolarHBondContact O-CG 3.25Å; K91-E95 PolarHBondContact O-N 2.97Å; E92-E95 PolarHBondContact O-N 3.49Å; E95-C97 PolarHBondContact O-N 3.45Å; E95-Y98 PolarHBondContact O-N 3.27Å; E95-E99 WeakPolarHBondContact O-CB 3.06Å; E95-E99 PolarHBondContact O-N 3.46Å
96I98.6Very high98.4Very high21 Ų2156.2 Ų56.211%0.10825%0.254CS..Hα-helixtrans-60-46.2175.8-66156.1000110.9Y51 V54 V55 R58 E92 L93 E99 V100Y51-I96 HydrophobicContact CD1-CG2 4.21Å; V54-I96 HydrophobicContact CG1-CD1 3.67Å; V54-I96 HydrophobicContact CG1-CG1 4Å; V54-I96 HydrophobicContact CG1-CG2 4.1Å; V55-I96 HydrophobicContact CB-CG2 4.04Å; V55-I96 HydrophobicContact CG2-CG2 4.31Å; R58-I96 HydrophobicContact CG-CD1 3.98Å; E92-I96 WeakPolarHBondContact O-CD1 3.4Å; E92-I96 VanDerWaalsContact O-CG1 3.3Å; E92-I96 WeakPolarHBondContact O-CG1 3.38Å; E92-I96 PolarHBondContact O-N 2.91Å; L93-I96 PolarHBondContact O-N 3.27Å; I96-E99 PolarHBondContact O-N 3.42Å; I96-V100 WeakPolarHBondContact O-CG2 3.46Å; I96-V100 PolarHBondContact O-N 3.25Å; I96-V100 VanDerWaalsContact O-N 3.11Å
97C98.7Very high98.4Very high0 Ų056.1 Ų56.10%025%0.254CS..Hα-helixtrans-65.3-46.4-178-660000112L93 R94 E95 E99 V100 L101 Y128 L132L93-C97 WeakPolarHBondContact O-CB 3.04Å; L93-C97 PolarHBondContact O-N 3.13Å; L93-C97 PolarHBondContact O-SG 3.5Å; R94-C97 PolarHBondContact O-N 2.79Å; E95-C97 PolarHBondContact O-N 3.45Å; C97-E99 VanDerWaalsContact C-N 3.31Å; C97-E99 PolarHBondContact O-N 2.8Å; C97-V100 PolarHBondContact O-N 2.76Å; C97-L101 WeakPolarHBondContact O-CB 3.35Å; C97-L101 WeakPolarHBondContact O-CG 3.48Å; C97-L101 PolarHBondContact O-N 3.11Å; C97-Y128 HydrophobicContact CB-CD1 4.06Å; C97-L132 HydrophobicContact CB-CD1 3.97Å; C97-L132 HydrophobicContact CB-CD2 3.65Å; C97-L132 HydrophobicContact CB-CG 3.61Å
98Y98.6Very high98.4Very high126 Ų12652 Ų5249%0.49424%0.235SC..Hα-helixtrans-68.9-29.1178.8-75.1-58000113.1R94 E95 L101 G102 L132R94-Y98 HydrophobicContact CB-CD2 4.36Å; R94-Y98 HydrophobicContact CB-CE2 4.42Å; R94-Y98 WeakPolarHBondContact O-CD2 3.44Å; R94-Y98 PolarHBondContact O-N 3.4Å; E95-Y98 PolarHBondContact O-N 3.27Å; Y98-L101 HydrophobicContact CD1-CD1 3.88Å; Y98-L101 HydrophobicContact CE1-CD1 4.19Å; Y98-G102 PolarHBondContact O-N 2.91Å; Y98-L132 HydrophobicContact CD1-CD1 4.33Å; Y98-L132 HydrophobicContact CE1-CD1 3.86Å; Y98-L132 HydrophobicContact CE2-CD1 4.34Å; Y98-L132 HydrophobicContact CE2-CD2 4.12Å
99E98.6Very high98.4Very high67 Ų6745.4 Ų45.431%0.31321%0.211SC..Hα-helixtrans-60.2-51.7169.3178.9171102.400110.9K30 Y51 E95 I96 C97 L101 G102 L103K30-E99 HydrophobicContact CD-CG 4.31Å; K30-E99 IonicContact NZ-OE2 3.77Å; K30-E99 PolarHBondContact NZ-OE2 2.86Å; Y51-E99 HydrophobicContact CE1-CG 4.47Å; Y51-E99 VanDerWaalsContact CE1-OE1 3.22Å; Y51-E99 WeakPolarHBondContact CE1-OE1 3.45Å; Y51-E99 VanDerWaalsContact CZ-OE1 3.3Å; Y51-E99 PolarHBondContact OH-OE1 3.29Å; E95-E99 WeakPolarHBondContact O-CB 3.06Å; E95-E99 PolarHBondContact O-N 3.46Å; I96-E99 PolarHBondContact O-N 3.42Å; C97-E99 VanDerWaalsContact C-N 3.31Å; C97-E99 PolarHBondContact O-N 2.8Å; E99-L101 PolarHBondContact O-N 3.45Å; E99-G102 PolarHBondContact O-N 2.9Å; E99-L103 WeakPolarHBondContact O-CG 3.41Å; E99-L103 PolarHBondContact O-N 3.24Å
100V98.7Very high98.4Very high2 Ų249.3 Ų49.31%0.01224%0.236CC..Hα-helixtrans-62.3-45178.7173.10000111.8Y51 I96 C97 G102 L103 L104 M124 Y128Y51-V100 HydrophobicContact CD1-CG2 3.22Å; Y51-V100 HydrophobicContact CD2-CG2 3.86Å; Y51-V100 HydrophobicContact CE1-CG2 3.55Å; Y51-V100 HydrophobicContact CE2-CG2 4.15Å; Y51-V100 HydrophobicContact CG-CG2 3.37Å; I96-V100 WeakPolarHBondContact O-CG2 3.46Å; I96-V100 PolarHBondContact O-N 3.25Å; I96-V100 VanDerWaalsContact O-N 3.11Å; C97-V100 PolarHBondContact O-N 2.76Å; V100-G102 VanDerWaalsContact C-N 3.27Å; V100-G102 PolarHBondContact O-N 3.38Å; V100-L103 WeakPolarHBondContact O-CB 3.4Å; V100-L103 PolarHBondContact O-N 3.21Å; V100-L103 VanDerWaalsContact O-N 3.13Å; V100-L104 HydrophobicContact CG1-CD1 3.72Å; V100-L104 HydrophobicContact CG1-CG 4.18Å; V100-L104 WeakPolarHBondContact O-CB 3.35Å; V100-L104 VanDerWaalsContact O-CG 3.26Å; V100-L104 WeakPolarHBondContact O-CG 3.35Å; V100-L104 PolarHBondContact O-N 3.03Å; V100-M124 HydrophobicContact CG1-CE 3.76Å; V100-Y128 HydrophobicContact CB-CD1 3.97Å; V100-Y128 HydrophobicContact CB-CD2 4.25Å; V100-Y128 HydrophobicContact CB-CE1 3.98Å; V100-Y128 HydrophobicContact CB-CE2 4.33Å; V100-Y128 HydrophobicContact CB-CG 4.11Å; V100-Y128 HydrophobicContact CG1-CD1 4.12Å; V100-Y128 HydrophobicContact CG1-CD2 3.49Å; V100-Y128 VanDerWaalsContact CG1-CD2 3.49Å; V100-Y128 HydrophobicContact CG1-CE1 4.12Å; V100-Y128 HydrophobicContact CG1-CE2 3.55Å; V100-Y128 HydrophobicContact CG1-CG 3.83Å; V100-Y128 HydrophobicContact CG2-CD1 4.22Å; V100-Y128 HydrophobicContact CG2-CE1 3.73Å; V100-Y128 HydrophobicContact CG2-CE2 4.44Å
101L98.8Very high98.2Very high5 Ų552.6 Ų52.63%0.02625%0.25CS..Hα-helixtrans-59.1-41.2176.5-69.2169.4000111.3C97 Y98 E99 L104 D105 K125 Y129 L132C97-L101 WeakPolarHBondContact O-CB 3.35Å; C97-L101 WeakPolarHBondContact O-CG 3.48Å; C97-L101 PolarHBondContact O-N 3.11Å; Y98-L101 HydrophobicContact CD1-CD1 3.88Å; Y98-L101 HydrophobicContact CE1-CD1 4.19Å; E99-L101 PolarHBondContact O-N 3.45Å; L101-L104 PolarHBondContact O-N 3.35Å; L101-D105 WeakPolarHBondContact O-CB 3.39Å; L101-D105 PolarHBondContact O-N 2.92Å; L101-K125 HydrophobicContact CD2-CB 4.48Å; L101-K125 HydrophobicContact CD2-CG 3.76Å; L101-Y129 HydrophobicContact CD1-CD1 3.89Å; L101-Y129 HydrophobicContact CD1-CE1 3.54Å; L101-Y129 HydrophobicContact CD1-CE2 4.21Å; L101-Y129 HydrophobicContact CD1-CG 4.35Å; L101-Y129 HydrophobicContact CD2-CD2 3.75Å; L101-Y129 HydrophobicContact CD2-CE1 4.37Å; L101-Y129 HydrophobicContact CD2-CE2 3.51Å; L101-Y129 HydrophobicContact CD2-CG 4.26Å; L101-Y129 HydrophobicContact CG-CE2 4.47Å; L101-L132 HydrophobicContact CD1-CD1 3.64Å
102G98.7Very high98.2Very high37 Ų3748 Ų4838%0.38124%0.235SC..Hα-helixtrans-61.7-41.7173.700000113Y98 E99 V100 K106Y98-G102 PolarHBondContact O-N 2.91Å; E99-G102 PolarHBondContact O-N 2.9Å; V100-G102 VanDerWaalsContact C-N 3.27Å; V100-G102 PolarHBondContact O-N 3.38Å; G102-K106 WeakPolarHBondContact O-CB 3.37Å; G102-K106 PolarHBondContact O-N 3.23Å
103L98.7Very high98Very high4 Ų449.9 Ų49.92%0.02125%0.253CS..Hα-helixtrans-63.9-44.9175.1-67.8176.8000112.1K30 T33 E34 L47 Y51 E99 V100 Y107 L108K30-L103 HydrophobicContact CB-CD1 4.32Å; K30-L103 HydrophobicContact CG-CD1 4.13Å; K30-L103 HydrophobicContact CG-CD2 4.11Å; T33-L103 HydrophobicContact CG2-CB 4.16Å; T33-L103 HydrophobicContact CG2-CD2 3.99Å; T33-L103 HydrophobicContact CG2-CG 4.5Å; E34-L103 HydrophobicContact CG-CD2 3.81Å; L47-L103 HydrophobicContact CD1-CD1 4.49Å; Y51-L103 HydrophobicContact CE2-CD1 3.86Å; Y51-L103 WeakPolarHBondContact OH-CD1 3.42Å; E99-L103 WeakPolarHBondContact O-CG 3.41Å; E99-L103 PolarHBondContact O-N 3.24Å; V100-L103 WeakPolarHBondContact O-CB 3.4Å; V100-L103 PolarHBondContact O-N 3.21Å; V100-L103 VanDerWaalsContact O-N 3.13Å; L103-Y107 HydrophobicContact CD2-CD2 3.98Å; L103-Y107 HydrophobicContact CD2-CE2 4.13Å; L103-Y107 PolarHBondContact O-N 3.27Å; L103-L108 PolarHBondContact O-N 3.08Å
104L98.8Very high97.9Very high0 Ų052.4 Ų52.40%027%0.267CS..Iπ-helixtrans-60.9-51.3179.2-71.3167.8000111.1V100 L101 L108 I109 Y121 M124 K125V100-L104 HydrophobicContact CG1-CD1 3.72Å; V100-L104 HydrophobicContact CG1-CG 4.18Å; V100-L104 WeakPolarHBondContact O-CB 3.35Å; V100-L104 VanDerWaalsContact O-CG 3.26Å; V100-L104 WeakPolarHBondContact O-CG 3.35Å; V100-L104 PolarHBondContact O-N 3.03Å; L101-L104 PolarHBondContact O-N 3.35Å; L104-L108 HydrophobicContact CD2-CB 4.43Å; L104-L108 HydrophobicContact CD2-CD1 3.83Å; L104-L108 HydrophobicContact CG-CD1 4.46Å; L104-L108 PolarHBondContact O-N 3.18Å; L104-I109 HydrophobicContact CB-CD1 3.94Å; L104-I109 HydrophobicContact CB-CG1 4.33Å; L104-I109 WeakPolarHBondContact O-CB 3.34Å; L104-I109 WeakPolarHBondContact O-CG1 3.4Å; L104-I109 PolarHBondContact O-N 3.47Å; L104-Y121 HydrophobicContact CD2-CD1 3.82Å; L104-Y121 HydrophobicContact CD2-CG 4.16Å; L104-M124 HydrophobicContact CD1-CB 4.28Å; L104-M124 HydrophobicContact CD1-CG 4.13Å; L104-M124 HydrophobicContact CD2-CB 4.32Å; L104-M124 HydrophobicContact CD2-CG 4.42Å; L104-M124 HydrophobicContact CD2-SD 4.1Å; L104-K125 HydrophobicContact CD1-CB 3.97Å
105D98.5Very high97.9Very high66 Ų6649.4 Ų49.435%0.35326%0.262SS..Iπ-helixtrans-73.9-32.9-174.2-75.1-17.8000113.2L101 P110 K125L101-D105 WeakPolarHBondContact O-CB 3.39Å; L101-D105 PolarHBondContact O-N 2.92Å; D105-P110 WeakPolarHBondContact O-CD 3.28Å; D105-P110 WeakPolarHBondContact O-CG 3.44Å; D105-K125 VanDerWaalsContact CG-NZ 3.25Å; D105-K125 WeakPolarHBondContact OD1-CE 3.36Å; D105-K125 IonicContact OD1-NZ 2.87Å; D105-K125 PolarHBondContact OD1-NZ 2.83Å; D105-K125 IonicContact OD2-NZ 2.73Å; D105-K125 PolarHBondContact OD2-NZ 2.84Å; D105-K125 VanDerWaalsContact OD2-NZ 3.08Å
106K98Very high97.8Very high140 Ų14047.7 Ų47.761%0.60925%0.254SS*.Iπ-helixtrans-89.8-36.6-176.4-170.3174.4175.5-164.50113.8G102G102-K106 WeakPolarHBondContact O-CB 3.37Å; G102-K106 PolarHBondContact O-N 3.23Å
107Y98Very high97.8Very high42 Ų4246.8 Ų46.817%0.16525%0.25CC..Iπ-helixtrans-120.5-32.4-168.4-55.7-77.2000114.5T33 E34 L103 K111T33-Y107 HydrophobicContact CG2-CD2 4.36Å; T33-Y107 HydrophobicContact CG2-CG 4.39Å; E34-Y107 HydrophobicContact CB-CE2 4.42Å; E34-Y107 HydrophobicContact CG-CD2 4.37Å; E34-Y107 HydrophobicContact CG-CE2 3.72Å; L103-Y107 HydrophobicContact CD2-CD2 3.98Å; L103-Y107 HydrophobicContact CD2-CE2 4.13Å; L103-Y107 PolarHBondContact O-N 3.27Å; Y107-K111 WeakPolarHBondContact O-CB 3.49Å; Y107-K111 WeakPolarHBondContact O-CD 3.49Å; Y107-K111 WeakPolarHBondContact O-CG 3.34Å
108L98.5Very high97.8Very high6 Ų649.1 Ų49.13%0.03126%0.26CS..Iπ-helixtrans-101-57.6-167.8-59.5168.9000113T33 L39 L47 L103 L104 K111 A112 Y121T33-L108 HydrophobicContact CG2-CD1 3.96Å; T33-L108 HydrophobicContact CG2-CD2 3.73Å; T33-L108 HydrophobicContact CG2-CG 3.74Å; L39-L108 HydrophobicContact CD1-CD2 3.63Å; L39-L108 HydrophobicContact CG-CD2 3.79Å; L47-L108 HydrophobicContact CD2-CD1 3.47Å; L47-L108 VanDerWaalsContact CD2-CD1 3.47Å; L103-L108 PolarHBondContact O-N 3.08Å; L104-L108 HydrophobicContact CD2-CB 4.43Å; L104-L108 HydrophobicContact CD2-CD1 3.83Å; L104-L108 HydrophobicContact CG-CD1 4.46Å; L104-L108 PolarHBondContact O-N 3.18Å; L108-K111 PolarHBondContact O-N 3.08Å; L108-K111 VanDerWaalsContact O-N 3.13Å; L108-A112 PolarHBondContact O-N 3.4Å; L108-Y121 HydrophobicContact CB-CD1 3.9Å; L108-Y121 HydrophobicContact CB-CD2 3.87Å; L108-Y121 HydrophobicContact CB-CE1 3.93Å; L108-Y121 HydrophobicContact CB-CE2 3.94Å; L108-Y121 HydrophobicContact CB-CG 3.9Å; L108-Y121 HydrophobicContact CD1-CD1 4.01Å; L108-Y121 HydrophobicContact CD1-CE1 3.86Å; L108-Y121 HydrophobicContact CD2-CE1 3.99Å; L108-Y121 HydrophobicContact CD2-CE2 4.48Å; L108-Y121 HydrophobicContact CG-CD1 4.43Å; L108-Y121 HydrophobicContact CG-CE1 4.14Å
109I98.3Very high97.8Very high15 Ų1543.1 Ų43.18%0.07724%0.236CC..THydrogen-bonded Turntrans-60.8-41-177-68.1173.2000112.4L104 K111 K118 L122 K125L104-I109 HydrophobicContact CB-CD1 3.94Å; L104-I109 HydrophobicContact CB-CG1 4.33Å; L104-I109 WeakPolarHBondContact O-CB 3.34Å; L104-I109 WeakPolarHBondContact O-CG1 3.4Å; L104-I109 PolarHBondContact O-N 3.47Å; I109-K111 VanDerWaalsContact C-N 3.31Å; I109-K111 PolarHBondContact O-N 3.49Å; I109-K118 HydrophobicContact CG2-CD 4.26Å; I109-K118 PolarHBondContact O-NZ 3.49Å; I109-L122 HydrophobicContact CD1-CD2 4.1Å; I109-L122 HydrophobicContact CG2-CD2 4.41Å; I109-K125 HydrophobicContact CD1-CB 4.27Å; I109-K125 HydrophobicContact CD1-CD 3.7Å
110P97.2Very high97.8Very high87 Ų8741.2 Ų41.257%0.56523%0.227SC*.THydrogen-bonded Turntrans-71.2-23177-21.334.5000114.2D105D105-P110 WeakPolarHBondContact O-CD 3.28Å; D105-P110 WeakPolarHBondContact O-CG 3.44Å
111K94.6Very high97.8Very high92 Ų9241.2 Ų41.240%0.423%0.227SC..THydrogen-bonded Turntrans-103.1-6.1-174.5-63.1-171.6178175.30114.1G36 Y107 L108 I109 S113G36-K111 VanDerWaalsContact C-NZ 3.34Å; G36-K111 WeakPolarHBondContact O-CD 3.31Å; G36-K111 WeakPolarHBondContact O-CE 3.37Å; G36-K111 PolarHBondContact O-NZ 3.32Å; Y107-K111 WeakPolarHBondContact O-CB 3.49Å; Y107-K111 WeakPolarHBondContact O-CD 3.49Å; Y107-K111 WeakPolarHBondContact O-CG 3.34Å; L108-K111 PolarHBondContact O-N 3.08Å; L108-K111 VanDerWaalsContact O-N 3.13Å; I109-K111 VanDerWaalsContact C-N 3.31Å; I109-K111 PolarHBondContact O-N 3.49Å; K111-S113 PolarHBondContact O-N 2.98Å
112A96.8Very high97.8Very high22 Ų2241 Ų4118%0.18223%0.226CC..  trans-59.7109.5176.600000110.6E38 L108 K118 Y121E38-A112 WeakPolarHBondContact OE1-CA 3.3Å; L108-A112 PolarHBondContact O-N 3.4Å; A112-K118 HydrophobicContact CB-CB 4.05Å; A112-K118 HydrophobicContact CB-CD 4.08Å; A112-Y121 HydrophobicContact CB-CD2 4.04Å; A112-Y121 HydrophobicContact CB-CE2 4.18Å
113S95.6Very high97.8Very high90 Ų9041 Ų4163%0.62922%0.215SC*.  trans-81.5-17.8-176.159.10000113.5E38 K111E38-S113 PolarHBondContact OE1-N 2.86Å; E38-S113 PolarHBondContact OE1-OG 3.4Å; E38-S113 WeakPolarHBondContact OE2-CB 3.45Å; E38-S113 PolarHBondContact OE2-OG 2.89Å; K111-S113 PolarHBondContact O-N 2.98Å
114N96.3Very high97.8Very high53 Ų5341.3 Ų41.328%0.28322%0.217SC..SBendtrans-129.6153.9-175.559.479.7000112.3E116 S117 K118N114-E116 VanDerWaalsContact C-N 3.31Å; N114-E116 PolarHBondContact O-N 3.47Å; N114-E116 PolarHBondContact OD1-N 2.94Å; N114-S117 PolarHBondContact ND2-OG 3.11Å; N114-S117 PolarHBondContact O-N 3.29Å; N114-S117 VanDerWaalsContact OD1-CB 3.28Å; N114-S117 WeakPolarHBondContact OD1-CB 3.36Å; N114-S117 PolarHBondContact OD1-N 3.39Å; N114-S117 PolarHBondContact OD1-OG 3.02Å; N114-K118 PolarHBondContact O-N 3.09Å; N114-K118 VanDerWaalsContact O-N 3.11Å
115P97.2Very high97.8Very high54 Ų5443.3 Ų43.335%0.35123%0.225SC..Hα-helixtrans-57.7-39.1-179.7-26.335.2000113.8S117 K118 V119 I158 K162P115-S117 PolarHBondContact O-N 3.27Å; P115-K118 PolarHBondContact O-N 3.23Å; P115-V119 WeakPolarHBondContact O-CB 3.33Å; P115-V119 VanDerWaalsContact O-CG2 3.28Å; P115-V119 WeakPolarHBondContact O-CG2 3.38Å; P115-V119 PolarHBondContact O-N 3.4Å; P115-I158 HydrophobicContact CB-CG2 4.16Å; P115-K162 HydrophobicContact CB-CB 3.67Å; P115-K162 HydrophobicContact CB-CG 4.11Å; P115-K162 HydrophobicContact CG-CB 3.99Å; P115-K162 HydrophobicContact CG-CG 4.11Å
116E97.1Very high97.8Very high73 Ų7340.1 Ų40.134%0.34121%0.208SC..Hα-helixtrans-59.9-48.9-179.2-70.4177.4-162.300112N114 K118 V119 F120 M163 H167 I169N114-E116 VanDerWaalsContact C-N 3.31Å; N114-E116 PolarHBondContact O-N 3.47Å; N114-E116 PolarHBondContact OD1-N 2.94Å; E116-K118 VanDerWaalsContact C-N 3.34Å; E116-V119 PolarHBondContact O-N 3.18Å; E116-F120 VanDerWaalsContact O-CB 3.27Å; E116-F120 WeakPolarHBondContact O-CB 3.42Å; E116-F120 PolarHBondContact O-N 3.15Å; E116-M163 HydrophobicContact CG-CE 4.06Å; E116-H167 IonicContact OE1-NE2 3.41Å; E116-H167 PolarHBondContact OE1-NE2 2.85Å; E116-I169 HydrophobicContact CB-CD1 4.18Å
117S98.1Very high97.9Very high1 Ų133.9 Ų33.91%0.00718%0.181CC..Hα-helixtrans-65.3-40.6178.4-61.60000111R44 N114 P115 F120 Y121R44-S117 PolarHBondContact NH1-OG 3.04Å; N114-S117 PolarHBondContact ND2-OG 3.11Å; N114-S117 PolarHBondContact O-N 3.29Å; N114-S117 VanDerWaalsContact OD1-CB 3.28Å; N114-S117 WeakPolarHBondContact OD1-CB 3.36Å; N114-S117 PolarHBondContact OD1-N 3.39Å; N114-S117 PolarHBondContact OD1-OG 3.02Å; P115-S117 PolarHBondContact O-N 3.27Å; S117-F120 PolarHBondContact O-N 2.65Å; S117-Y121 WeakPolarHBondContact O-CD2 3.45Å; S117-Y121 VanDerWaalsContact O-CG 3.27Å; S117-Y121 PolarHBondContact O-N 3.01Å
118K98.5Very high97.9Very high50 Ų5032.1 Ų32.122%0.21718%0.175CC..Hα-helixtrans-60.9-48.7176.7-170.671.4179.8-161.20111.7I109 A112 N114 P115 E116 Y121 L122 I158I109-K118 HydrophobicContact CG2-CD 4.26Å; I109-K118 PolarHBondContact O-NZ 3.49Å; A112-K118 HydrophobicContact CB-CB 4.05Å; A112-K118 HydrophobicContact CB-CD 4.08Å; N114-K118 PolarHBondContact O-N 3.09Å; N114-K118 VanDerWaalsContact O-N 3.11Å; P115-K118 PolarHBondContact O-N 3.23Å; E116-K118 VanDerWaalsContact C-N 3.34Å; K118-Y121 PolarHBondContact O-N 2.99Å; K118-L122 HydrophobicContact CD-CD1 4.38Å; K118-L122 HydrophobicContact CG-CD1 3.93Å; K118-L122 WeakPolarHBondContact O-CB 3.32Å; K118-L122 VanDerWaalsContact O-CG 3.32Å; K118-L122 WeakPolarHBondContact O-CG 3.48Å; K118-L122 PolarHBondContact O-N 3.34Å; K118-I158 HydrophobicContact CG-CD1 3.82Å
119V98.8Very high97.9Very high0 Ų033 Ų330%018%0.178CC..Hα-helixtrans-63.8-41.8177.5173.90000110.7P115 E116 Y121 L122 K123 A155 I158 A159 M163 I169 L173P115-V119 WeakPolarHBondContact O-CB 3.33Å; P115-V119 VanDerWaalsContact O-CG2 3.28Å; P115-V119 WeakPolarHBondContact O-CG2 3.38Å; P115-V119 PolarHBondContact O-N 3.4Å; E116-V119 PolarHBondContact O-N 3.18Å; V119-Y121 PolarHBondContact O-N 3.47Å; V119-L122 PolarHBondContact O-N 3.16Å; V119-K123 WeakPolarHBondContact O-CB 3.19Å; V119-K123 PolarHBondContact O-N 3.48Å; V119-A155 HydrophobicContact CG1-CB 4.33Å; V119-I158 HydrophobicContact CG2-CB 3.8Å; V119-I158 HydrophobicContact CG2-CG2 3.55Å; V119-A159 HydrophobicContact CG1-CB 4Å; V119-A159 HydrophobicContact CG2-CB 4.1Å; V119-M163 HydrophobicContact CB-SD 3.96Å; V119-M163 HydrophobicContact CG1-SD 4Å; V119-M163 HydrophobicContact CG2-SD 3.79Å; V119-I169 HydrophobicContact CB-CG2 4.25Å; V119-I169 HydrophobicContact CG1-CG2 3.73Å; V119-L173 HydrophobicContact CG1-CD2 4.03Å
120F98.6Very high97.9Very high26 Ų2633 Ų3311%0.11418%0.177CC..Hα-helixtrans-57.2-50176.6-172.1-79000111.7R44 E116 S117 M124 I169R44-F120 HydrophobicContact CG-CD1 3.54Å; R44-F120 HydrophobicContact CG-CE1 3.4Å; R44-F120 VanDerWaalsContact CG-CE1 3.4Å; R44-F120 HydrophobicContact CG-CE2 4.45Å; R44-F120 HydrophobicContact CG-CG 4.15Å; R44-F120 HydrophobicContact CG-CZ 3.89Å; E116-F120 VanDerWaalsContact O-CB 3.27Å; E116-F120 WeakPolarHBondContact O-CB 3.42Å; E116-F120 PolarHBondContact O-N 3.15Å; S117-F120 PolarHBondContact O-N 2.65Å; F120-M124 HydrophobicContact CE1-SD 4.42Å; F120-M124 WeakPolarHBondContact O-CB 3.46Å; F120-M124 PolarHBondContact O-N 2.7Å; F120-I169 HydrophobicContact CB-CD1 4.4Å; F120-I169 HydrophobicContact CB-CG2 4.42Å; F120-I169 HydrophobicContact CD2-CD1 4.05Å; F120-I169 HydrophobicContact CD2-CG1 4.22Å
121Y98.8Very high98Very high2 Ų229.8 Ų29.81%0.00815%0.153CC..Hα-helixtrans-70.3-38.3-178.9-61.9-46.8000112.9R44 L104 L108 A112 S117 K118 V119 M124 K125R44-Y121 HydrophobicContact CG-CE1 3.6Å; L104-Y121 HydrophobicContact CD2-CD1 3.82Å; L104-Y121 HydrophobicContact CD2-CG 4.16Å; L108-Y121 HydrophobicContact CB-CD1 3.9Å; L108-Y121 HydrophobicContact CB-CD2 3.87Å; L108-Y121 HydrophobicContact CB-CE1 3.93Å; L108-Y121 HydrophobicContact CB-CE2 3.94Å; L108-Y121 HydrophobicContact CB-CG 3.9Å; L108-Y121 HydrophobicContact CD1-CD1 4.01Å; L108-Y121 HydrophobicContact CD1-CE1 3.86Å; L108-Y121 HydrophobicContact CD2-CE1 3.99Å; L108-Y121 HydrophobicContact CD2-CE2 4.48Å; L108-Y121 HydrophobicContact CG-CD1 4.43Å; L108-Y121 HydrophobicContact CG-CE1 4.14Å; A112-Y121 HydrophobicContact CB-CD2 4.04Å; A112-Y121 HydrophobicContact CB-CE2 4.18Å; S117-Y121 WeakPolarHBondContact O-CD2 3.45Å; S117-Y121 VanDerWaalsContact O-CG 3.27Å; S117-Y121 PolarHBondContact O-N 3.01Å; K118-Y121 PolarHBondContact O-N 2.99Å; V119-Y121 PolarHBondContact O-N 3.47Å; Y121-M124 WeakPolarHBondContact O-CB 3.15Å; Y121-M124 PolarHBondContact O-N 3.38Å; Y121-K125 WeakPolarHBondContact O-CB 3.48Å; Y121-K125 PolarHBondContact O-N 2.75Å
122L98.9Very high98.2Very high1 Ų125.5 Ų25.51%0.00514%0.135CC..Hα-helixtrans-67.7-40.4175.8-73.3168000112I109 K118 V119 M124 K125 G126 E154 A155 I158I109-L122 HydrophobicContact CD1-CD2 4.1Å; I109-L122 HydrophobicContact CG2-CD2 4.41Å; K118-L122 HydrophobicContact CD-CD1 4.38Å; K118-L122 HydrophobicContact CG-CD1 3.93Å; K118-L122 WeakPolarHBondContact O-CB 3.32Å; K118-L122 VanDerWaalsContact O-CG 3.32Å; K118-L122 WeakPolarHBondContact O-CG 3.48Å; K118-L122 PolarHBondContact O-N 3.34Å; V119-L122 PolarHBondContact O-N 3.16Å; L122-M124 VanDerWaalsContact C-N 3.32Å; L122-M124 PolarHBondContact O-N 3.14Å; L122-K125 WeakPolarHBondContact O-CB 3.26Å; L122-K125 PolarHBondContact O-N 3.19Å; L122-G126 PolarHBondContact O-N 3.33Å; L122-E154 HydrophobicContact CD1-CB 4.17Å; L122-E154 HydrophobicContact CD1-CG 3.73Å; L122-E154 HydrophobicContact CD2-CB 4.46Å; L122-E154 HydrophobicContact CD2-CG 4.33Å; L122-A155 HydrophobicContact CB-CB 3.65Å; L122-I158 HydrophobicContact CD1-CD1 3.75Å
123K98.7Very high98.2Very high37 Ų3724.5 Ų24.516%0.16113%0.126CC..Hα-helixtrans-57.2-48.3170.7177.4-167.2168.9-67.20110.5V119 K125 G126 D127 Y152 G172 L173 N176V119-K123 WeakPolarHBondContact O-CB 3.19Å; V119-K123 PolarHBondContact O-N 3.48Å; K123-K125 VanDerWaalsContact C-N 3.33Å; K123-K125 PolarHBondContact O-N 3.41Å; K123-G126 PolarHBondContact O-N 2.83Å; K123-D127 IonicContact NZ-OD2 3.1Å; K123-D127 PolarHBondContact NZ-OD2 2.93Å; K123-D127 PolarHBondContact O-N 3.27Å; K123-Y152 HydrophobicContact CG-CE1 4.49Å; K123-G172 WeakPolarHBondContact CE-O 3.27Å; K123-L173 HydrophobicContact CB-CD1 4Å; K123-L173 HydrophobicContact CD-CB 4.11Å; K123-L173 HydrophobicContact CG-CB 4.29Å; K123-L173 HydrophobicContact CG-CD1 3.99Å; K123-N176 PolarHBondContact NZ-ND2 3.3Å
124M98.7Very high98.3Very high10 Ų1021.9 Ų21.95%0.04910%0.104CC..Hα-helixtrans-59.3-44.9176.9-167.9174.3178.700110.5V100 L104 F120 Y121 L122 G126 D127 Y128V100-M124 HydrophobicContact CG1-CE 3.76Å; L104-M124 HydrophobicContact CD1-CB 4.28Å; L104-M124 HydrophobicContact CD1-CG 4.13Å; L104-M124 HydrophobicContact CD2-CB 4.32Å; L104-M124 HydrophobicContact CD2-CG 4.42Å; L104-M124 HydrophobicContact CD2-SD 4.1Å; F120-M124 HydrophobicContact CE1-SD 4.42Å; F120-M124 WeakPolarHBondContact O-CB 3.46Å; F120-M124 PolarHBondContact O-N 2.7Å; Y121-M124 WeakPolarHBondContact O-CB 3.15Å; Y121-M124 PolarHBondContact O-N 3.38Å; L122-M124 VanDerWaalsContact C-N 3.32Å; L122-M124 PolarHBondContact O-N 3.14Å; M124-G126 VanDerWaalsContact C-N 3.34Å; M124-G126 PolarHBondContact O-N 3.47Å; M124-D127 WeakPolarHBondContact O-CA 3.49Å; M124-D127 WeakPolarHBondContact O-CB 3.24Å; M124-D127 PolarHBondContact O-N 3.38Å; M124-Y128 HydrophobicContact CE-CE2 3.68Å; M124-Y128 HydrophobicContact CG-CD2 3.86Å; M124-Y128 HydrophobicContact CG-CE2 3.63Å; M124-Y128 VanDerWaalsContact O-CD2 3.24Å; M124-Y128 WeakPolarHBondContact O-CD2 3.4Å; M124-Y128 PolarHBondContact O-N 3.48Å
125K98.9Very high98.3Very high42 Ų4219.8 Ų19.818%0.1839%0.093CC..Hα-helixtrans-55.7-46.7174.9-174.5172.8-179.2169.70112.1L101 L104 D105 I109 Y121 L122 K123 D127 Y128 Y129 A151L101-K125 HydrophobicContact CD2-CB 4.48Å; L101-K125 HydrophobicContact CD2-CG 3.76Å; L104-K125 HydrophobicContact CD1-CB 3.97Å; D105-K125 VanDerWaalsContact CG-NZ 3.25Å; D105-K125 WeakPolarHBondContact OD1-CE 3.36Å; D105-K125 IonicContact OD1-NZ 2.87Å; D105-K125 PolarHBondContact OD1-NZ 2.83Å; D105-K125 IonicContact OD2-NZ 2.73Å; D105-K125 PolarHBondContact OD2-NZ 2.84Å; D105-K125 VanDerWaalsContact OD2-NZ 3.08Å; I109-K125 HydrophobicContact CD1-CB 4.27Å; I109-K125 HydrophobicContact CD1-CD 3.7Å; Y121-K125 WeakPolarHBondContact O-CB 3.48Å; Y121-K125 PolarHBondContact O-N 2.75Å; L122-K125 WeakPolarHBondContact O-CB 3.26Å; L122-K125 PolarHBondContact O-N 3.19Å; K123-K125 VanDerWaalsContact C-N 3.33Å; K123-K125 PolarHBondContact O-N 3.41Å; K125-D127 VanDerWaalsContact C-N 3.34Å; K125-D127 PolarHBondContact O-N 3.5Å; K125-Y128 PolarHBondContact O-N 2.97Å; K125-Y129 HydrophobicContact CD-CE2 4.32Å; K125-Y129 HydrophobicContact CG-CD2 3.93Å; K125-Y129 HydrophobicContact CG-CE2 3.76Å; K125-Y129 VanDerWaalsContact O-CD2 3.31Å; K125-Y129 WeakPolarHBondContact O-CD2 3.45Å; K125-Y129 PolarHBondContact O-N 3.04Å; K125-Y129 VanDerWaalsContact O-N 3.1Å; K125-A151 HydrophobicContact CB-CB 4.05Å; K125-A151 HydrophobicContact CD-CB 4.18Å; K125-A151 HydrophobicContact CG-CB 3.9Å
126G98.8Very high98.2Very high0 Ų018.1 Ų18.10%09%0.085CC..Hα-helixtrans-58.5-44173.400000112.5L122 K123 M124 Y128 Y129 R130 S148L122-G126 PolarHBondContact O-N 3.33Å; K123-G126 PolarHBondContact O-N 2.83Å; M124-G126 VanDerWaalsContact C-N 3.34Å; M124-G126 PolarHBondContact O-N 3.47Å; G126-Y128 PolarHBondContact O-N 3.23Å; G126-Y129 PolarHBondContact O-N 3.32Å; G126-R130 WeakPolarHBondContact O-CB 3.36Å; G126-R130 PolarHBondContact O-N 3.06Å; G126-S148 PolarHBondContact O-OG 2.93Å
127D98.8Very high98Very high8 Ų820.2 Ų20.24%0.04310%0.102CC..Hα-helixtrans-58.9-46177.1-72.4-40.3000112.7K123 M124 K125 R130 Y131 Y152 N176K123-D127 IonicContact NZ-OD2 3.1Å; K123-D127 PolarHBondContact NZ-OD2 2.93Å; K123-D127 PolarHBondContact O-N 3.27Å; M124-D127 WeakPolarHBondContact O-CA 3.49Å; M124-D127 WeakPolarHBondContact O-CB 3.24Å; M124-D127 PolarHBondContact O-N 3.38Å; K125-D127 VanDerWaalsContact C-N 3.34Å; K125-D127 PolarHBondContact O-N 3.5Å; D127-R130 WeakPolarHBondContact O-CB 3.35Å; D127-R130 PolarHBondContact O-N 2.84Å; D127-R130 IonicContact OD1-CZ 2.88Å; D127-R130 IonicContact OD1-NE 2.78Å; D127-R130 IonicContact OD1-NH2 3.34Å; D127-R130 PolarHBondContact OD1-NH2 2.66Å; D127-Y131 HydrophobicContact CB-CE2 4.12Å; D127-Y131 WeakPolarHBondContact O-CD1 3.41Å; D127-Y131 WeakPolarHBondContact O-CD2 3.4Å; D127-Y131 PolarHBondContact O-N 3.35Å; D127-Y152 VanDerWaalsContact CA-OH 3.3Å; D127-Y152 WeakPolarHBondContact CA-OH 3.3Å; D127-Y152 PolarHBondContact N-OH 3.24Å; D127-Y152 PolarHBondContact OD1-OH 3.5Å; D127-N176 WeakPolarHBondContact OD1-CB 3.33Å; D127-N176 PolarHBondContact OD1-ND2 3.25Å; D127-N176 PolarHBondContact OD2-ND2 2.86Å
128Y98.8Very high97.7Very high6 Ų622.8 Ų22.82%0.02413%0.129CC..Hα-helixtrans-71.4-35.8-179.1-78.6-86.5000113Y51 K52 V55 C97 V100 M124 K125 G126 R130 Y131 L132Y51-Y128 WeakPolarHBondContact CB-OH 3.28Å; Y51-Y128 PolarHBondContact O-OH 2.79Å; K52-Y128 PolarHBondContact N-OH 2.85Å; V55-Y128 HydrophobicContact CB-CE1 4.05Å; V55-Y128 HydrophobicContact CG1-CE1 3.94Å; V55-Y128 HydrophobicContact CG2-CE1 4.2Å; C97-Y128 HydrophobicContact CB-CD1 4.06Å; V100-Y128 HydrophobicContact CB-CD1 3.97Å; V100-Y128 HydrophobicContact CB-CD2 4.25Å; V100-Y128 HydrophobicContact CB-CE1 3.98Å; V100-Y128 HydrophobicContact CB-CE2 4.33Å; V100-Y128 HydrophobicContact CB-CG 4.11Å; V100-Y128 HydrophobicContact CG1-CD1 4.12Å; V100-Y128 HydrophobicContact CG1-CD2 3.49Å; V100-Y128 VanDerWaalsContact CG1-CD2 3.49Å; V100-Y128 HydrophobicContact CG1-CE1 4.12Å; V100-Y128 HydrophobicContact CG1-CE2 3.55Å; V100-Y128 HydrophobicContact CG1-CG 3.83Å; V100-Y128 HydrophobicContact CG2-CD1 4.22Å; V100-Y128 HydrophobicContact CG2-CE1 3.73Å; V100-Y128 HydrophobicContact CG2-CE2 4.44Å; M124-Y128 HydrophobicContact CE-CE2 3.68Å; M124-Y128 HydrophobicContact CG-CD2 3.86Å; M124-Y128 HydrophobicContact CG-CE2 3.63Å; M124-Y128 VanDerWaalsContact O-CD2 3.24Å; M124-Y128 WeakPolarHBondContact O-CD2 3.4Å; M124-Y128 PolarHBondContact O-N 3.48Å; K125-Y128 PolarHBondContact O-N 2.97Å; G126-Y128 PolarHBondContact O-N 3.23Å; Y128-R130 VanDerWaalsContact C-N 3.34Å; Y128-Y131 HydrophobicContact CD1-CD2 4.01Å; Y128-Y131 HydrophobicContact CD1-CE2 4.45Å; Y128-Y131 HydrophobicContact CE1-CD2 4.27Å; Y128-Y131 HydrophobicContact CE1-CE2 4.43Å; Y128-Y131 HydrophobicContact CG-CD2 4.29Å; Y128-Y131 PolarHBondContact O-N 2.83Å; Y128-L132 WeakPolarHBondContact O-CG 3.48Å; Y128-L132 PolarHBondContact O-N 3.32Å
129Y98.8Very high97.5Very high25 Ų2526.8 Ų26.810%0.09815%0.153CC..Hα-helixtrans-66.6-36.4169.6-79.3-59.9000112.6L101 K125 G126 Y131 L132 A133 V144 D147L101-Y129 HydrophobicContact CD1-CD1 3.89Å; L101-Y129 HydrophobicContact CD1-CE1 3.54Å; L101-Y129 HydrophobicContact CD1-CE2 4.21Å; L101-Y129 HydrophobicContact CD1-CG 4.35Å; L101-Y129 HydrophobicContact CD2-CD2 3.75Å; L101-Y129 HydrophobicContact CD2-CE1 4.37Å; L101-Y129 HydrophobicContact CD2-CE2 3.51Å; L101-Y129 HydrophobicContact CD2-CG 4.26Å; L101-Y129 HydrophobicContact CG-CE2 4.47Å; K125-Y129 HydrophobicContact CD-CE2 4.32Å; K125-Y129 HydrophobicContact CG-CD2 3.93Å; K125-Y129 HydrophobicContact CG-CE2 3.76Å; K125-Y129 VanDerWaalsContact O-CD2 3.31Å; K125-Y129 WeakPolarHBondContact O-CD2 3.45Å; K125-Y129 PolarHBondContact O-N 3.04Å; K125-Y129 VanDerWaalsContact O-N 3.1Å; G126-Y129 PolarHBondContact O-N 3.32Å; Y129-Y131 VanDerWaalsContact C-N 3.34Å; Y129-Y131 PolarHBondContact O-N 2.58Å; Y129-L132 HydrophobicContact CD1-CD1 3.94Å; Y129-L132 HydrophobicContact CE1-CD1 4.33Å; Y129-L132 WeakPolarHBondContact O-CB 3.35Å; Y129-L132 PolarHBondContact O-N 3.04Å; Y129-A133 WeakPolarHBondContact O-CB 3.36Å; Y129-A133 PolarHBondContact O-N 3.02Å; Y129-V144 HydrophobicContact CD1-CB 4.18Å; Y129-V144 HydrophobicContact CD1-CG1 4.24Å; Y129-D147 HydrophobicContact CD1-CB 3.87Å; Y129-D147 HydrophobicContact CD2-CB 3.79Å; Y129-D147 HydrophobicContact CE1-CB 3.85Å; Y129-D147 HydrophobicContact CE2-CB 3.75Å; Y129-D147 HydrophobicContact CG-CB 3.86Å
130R98.6Very high97.2Very high13 Ų1329.7 Ų29.75%0.04918%0.177CC..Hα-helixtrans-60.9-41.6171.9170.3166.669.987.75.2112G126 D127 Y128 L132 A133 E134 Y152 F180 E183 I184G126-R130 WeakPolarHBondContact O-CB 3.36Å; G126-R130 PolarHBondContact O-N 3.06Å; D127-R130 WeakPolarHBondContact O-CB 3.35Å; D127-R130 PolarHBondContact O-N 2.84Å; D127-R130 IonicContact OD1-CZ 2.88Å; D127-R130 IonicContact OD1-NE 2.78Å; D127-R130 IonicContact OD1-NH2 3.34Å; D127-R130 PolarHBondContact OD1-NH2 2.66Å; Y128-R130 VanDerWaalsContact C-N 3.34Å; R130-L132 VanDerWaalsContact C-N 3.34Å; R130-A133 WeakPolarHBondContact O-CB 3.14Å; R130-A133 PolarHBondContact O-N 2.65Å; R130-E134 PolarHBondContact O-N 3.04Å; R130-Y152 HydrophobicContact CB-CE2 4.48Å; R130-Y152 PolarHBondContact NE-OH 3.23Å; R130-F180 HydrophobicContact CB-CD2 4.25Å; R130-F180 HydrophobicContact CG-CD2 4.33Å; R130-E183 IonicContact NH1-OE2 2.93Å; R130-I184 HydrophobicContact CG-CD1 4.29Å; R130-I184 HydrophobicContact CG-CG1 3.78Å
131Y98.5Very high97.1Very high20 Ų2032 Ų328%0.07819%0.185CC..Hα-helixtrans-65.6-37.9175.3-55.2-29.4000112.1V55 R59 D127 Y128 Y129 E134V55-Y131 HydrophobicContact CG1-CD2 3.93Å; V55-Y131 HydrophobicContact CG1-CE2 3.8Å; V55-Y131 HydrophobicContact CG2-CD2 3.97Å; R59-Y131 VanDerWaalsContact CZ-CD1 3.44Å; D127-Y131 HydrophobicContact CB-CE2 4.12Å; D127-Y131 WeakPolarHBondContact O-CD1 3.41Å; D127-Y131 WeakPolarHBondContact O-CD2 3.4Å; D127-Y131 PolarHBondContact O-N 3.35Å; Y128-Y131 HydrophobicContact CD1-CD2 4.01Å; Y128-Y131 HydrophobicContact CD1-CE2 4.45Å; Y128-Y131 HydrophobicContact CE1-CD2 4.27Å; Y128-Y131 HydrophobicContact CE1-CE2 4.43Å; Y128-Y131 HydrophobicContact CG-CD2 4.29Å; Y128-Y131 PolarHBondContact O-N 2.83Å; Y129-Y131 VanDerWaalsContact C-N 3.34Å; Y129-Y131 PolarHBondContact O-N 2.58Å; Y131-E134 WeakPolarHBondContact O-CB 3.38Å; Y131-E134 PolarHBondContact O-N 3.36Å
132L98.5Very high97Very high3 Ų336.4 Ų36.42%0.01621%0.209CC..Hα-helixtrans-62.8-42.9171-72.3171.1000111.5L93 R94 C97 Y98 L101 Y128 Y129 R130 E134 V135 A136 V144L93-L132 HydrophobicContact CD2-CD2 4.49Å; R94-L132 HydrophobicContact CB-CD2 4.16Å; R94-L132 HydrophobicContact CG-CD2 3.7Å; C97-L132 HydrophobicContact CB-CD1 3.97Å; C97-L132 HydrophobicContact CB-CD2 3.65Å; C97-L132 HydrophobicContact CB-CG 3.61Å; Y98-L132 HydrophobicContact CD1-CD1 4.33Å; Y98-L132 HydrophobicContact CE1-CD1 3.86Å; Y98-L132 HydrophobicContact CE2-CD1 4.34Å; Y98-L132 HydrophobicContact CE2-CD2 4.12Å; L101-L132 HydrophobicContact CD1-CD1 3.64Å; Y128-L132 WeakPolarHBondContact O-CG 3.48Å; Y128-L132 PolarHBondContact O-N 3.32Å; Y129-L132 HydrophobicContact CD1-CD1 3.94Å; Y129-L132 HydrophobicContact CE1-CD1 4.33Å; Y129-L132 WeakPolarHBondContact O-CB 3.35Å; Y129-L132 PolarHBondContact O-N 3.04Å; R130-L132 VanDerWaalsContact C-N 3.34Å; L132-E134 VanDerWaalsContact C-N 3.28Å; L132-E134 PolarHBondContact O-N 3.2Å; L132-V135 WeakPolarHBondContact O-CG2 3.39Å; L132-V135 PolarHBondContact O-N 2.92Å; L132-A136 WeakPolarHBondContact O-CB 3.18Å; L132-A136 PolarHBondContact O-N 3.06Å; L132-V144 HydrophobicContact CB-CB 4.21Å; L132-V144 HydrophobicContact CB-CG1 4.1Å; L132-V144 HydrophobicContact CB-CG2 4.39Å; L132-V144 HydrophobicContact CD1-CG1 4.36Å
133A98.1Very high96.9Very high0 Ų040.1 Ų40.10%023%0.232CC..Hα-helixtrans-59.8-39.2178.800000111.9Y129 R130 V135 A136 R141 V144 V145 I184Y129-A133 WeakPolarHBondContact O-CB 3.36Å; Y129-A133 PolarHBondContact O-N 3.02Å; R130-A133 WeakPolarHBondContact O-CB 3.14Å; R130-A133 PolarHBondContact O-N 2.65Å; A133-V135 PolarHBondContact O-N 3.46Å; A133-A136 PolarHBondContact O-N 3.23Å; A133-R141 PolarHBondContact O-NH1 3.47Å; A133-V144 HydrophobicContact CB-CG2 3.8Å; A133-V145 HydrophobicContact CB-CG2 3.79Å; A133-I184 HydrophobicContact CB-CD1 4.31Å; A133-I184 HydrophobicContact CB-CG2 3.84Å
134E96.2Very high96.8Very high35 Ų3538.7 Ų38.716%0.16423%0.226CC..Hα-helixtrans-54.5-36.3177.8-174.5173.8-169.800113R59 W62 R63 R130 Y131 L132R59-E134 IonicContact CZ-OE2 2.85Å; R59-E134 IonicContact NE-OE2 2.69Å; R59-E134 PolarHBondContact NE-OE2 3.48Å; R59-E134 IonicContact NH2-OE1 3.57Å; R59-E134 IonicContact NH2-OE2 3.47Å; R59-E134 PolarHBondContact NH2-OE2 2.95Å; W62-E134 HydrophobicContact CE3-CG 4.38Å; W62-E134 HydrophobicContact CH2-CG 4.07Å; W62-E134 WeakPolarHBondContact CH2-O 3.4Å; W62-E134 HydrophobicContact CZ3-CG 3.66Å; R63-E134 IonicContact CZ-OE1 3.66Å; R63-E134 IonicContact NE-OE1 3.08Å; R63-E134 PolarHBondContact NE-OE1 2.86Å; R63-E134 IonicContact NH2-OE1 3Å; R63-E134 PolarHBondContact NH2-OE1 3.28Å; R63-E134 IonicContact NH2-OE2 2.91Å; R63-E134 PolarHBondContact NH2-OE2 3.32Å; R130-E134 PolarHBondContact O-N 3.04Å; Y131-E134 WeakPolarHBondContact O-CB 3.38Å; Y131-E134 PolarHBondContact O-N 3.36Å; L132-E134 VanDerWaalsContact C-N 3.28Å; L132-E134 PolarHBondContact O-N 3.2Å
135V96.1Very high96.8Very high9 Ų939.1 Ų39.16%0.05523%0.229CC..Hα-helixtrans-104.7-13.7-177.8-540000114.1W62 E90 L93 L132 A133W62-V135 HydrophobicContact CD2-CG1 3.77Å; W62-V135 HydrophobicContact CE3-CG1 4.24Å; W62-V135 HydrophobicContact CG-CG1 4.11Å; W62-V135 HydrophobicContact CH2-CG1 4.41Å; W62-V135 HydrophobicContact CZ2-CB 4.38Å; W62-V135 HydrophobicContact CZ2-CG1 3.96Å; E90-V135 HydrophobicContact CG-CB 4.07Å; E90-V135 HydrophobicContact CG-CG1 4.35Å; L93-V135 HydrophobicContact CD1-CG1 3.99Å; L93-V135 HydrophobicContact CD2-CG1 4.41Å; L93-V135 HydrophobicContact CD2-CG2 3.93Å; L132-V135 WeakPolarHBondContact O-CG2 3.39Å; L132-V135 PolarHBondContact O-N 2.92Å; A133-V135 PolarHBondContact O-N 3.46Å
136A96Very high96.8Very high20 Ų2043.6 Ų43.617%0.16525%0.251CS..  trans-75.5146.5-178.600000111.8L132 A133 R141 V144L132-A136 WeakPolarHBondContact O-CB 3.18Å; L132-A136 PolarHBondContact O-N 3.06Å; A133-A136 PolarHBondContact O-N 3.23Å; A136-R141 HydrophobicContact CB-CB 3.98Å; A136-R141 HydrophobicContact CB-CG 4.44Å; A136-V144 HydrophobicContact CB-CG2 4Å
137T92.4Very high96.8Very high116 Ų11646.1 Ų46.171%0.71226%0.264SS*.  trans-128.9159.8177.356.60000110.6
138G92.9Very high96.8Very high56 Ų5645.8 Ų45.858%0.57726%0.262SS*.Hα-helixtrans59.3-147.1179.300000113.5A140 R141G138-A140 VanDerWaalsContact C-N 3.27Å; G138-A140 PolarHBondContact O-N 3.34Å; G138-R141 VanDerWaalsContact O-CB 3.29Å; G138-R141 WeakPolarHBondContact O-CB 3.5Å; G138-R141 PolarHBondContact O-N 3.39Å
139D92.8Very high96.8Very high133 Ų13349.6 Ų49.671%0.71128%0.279SS*.Hα-helixtrans-62.2-33.3-175.4-63.2-27.4000113.3R141 N142 T143D139-R141 PolarHBondContact O-N 3.08Å; D139-N142 WeakPolarHBondContact O-CB 3.39Å; D139-N142 PolarHBondContact O-N 3.21Å; D139-T143 PolarHBondContact O-N 3.28Å
140A92.8Very high96.8Very high62 Ų6255.2 Ų55.251%0.51230%0.304SS..Hα-helixtrans-59.3-32.2176.300000111.9G138 V144G138-A140 VanDerWaalsContact C-N 3.27Å; G138-A140 PolarHBondContact O-N 3.34Å; A140-V144 WeakPolarHBondContact O-CG2 3.37Å; A140-V144 PolarHBondContact O-N 3.26Å
141R96.6Very high96.8Very high73 Ų7354.8 Ų54.828%0.27530%0.303SS..Hα-helixtrans-64.2-45.3174.7-174.9-179.216690.8-1.6111.1A133 A136 G138 D139 T143 V144 V145 I184A133-R141 PolarHBondContact O-NH1 3.47Å; A136-R141 HydrophobicContact CB-CB 3.98Å; A136-R141 HydrophobicContact CB-CG 4.44Å; G138-R141 VanDerWaalsContact O-CB 3.29Å; G138-R141 WeakPolarHBondContact O-CB 3.5Å; G138-R141 PolarHBondContact O-N 3.39Å; D139-R141 PolarHBondContact O-N 3.08Å; R141-T143 VanDerWaalsContact C-N 3.32Å; R141-T143 PolarHBondContact O-N 3.39Å; R141-V144 VanDerWaalsContact O-CG2 3.25Å; R141-V144 WeakPolarHBondContact O-CG2 3.46Å; R141-V144 PolarHBondContact O-N 2.99Å; R141-V145 HydrophobicContact CG-CG2 4.01Å; R141-V145 WeakPolarHBondContact O-CB 3.32Å; R141-V145 WeakPolarHBondContact O-CG2 3.44Å; R141-V145 PolarHBondContact O-N 3.32Å; R141-I184 PolarHBondContact NH2-O 2.99Å; R141-I184 VanDerWaalsContact NH2-O 3.13Å
142N96.5Very high96.8Very high95 Ų9553.8 Ų53.851%0.50830%0.3SS..Hα-helixtrans-59.8-44.8-177.1-64.8-27.1000111.1D139 V145 E146D139-N142 WeakPolarHBondContact O-CB 3.39Å; D139-N142 PolarHBondContact O-N 3.21Å; N142-V145 PolarHBondContact O-N 3.37Å; N142-E146 WeakPolarHBondContact O-CG 3.41Å; N142-E146 PolarHBondContact O-N 2.91Å
143T96.8Very high96.8Very high79 Ų7956.9 Ų56.949%0.48531%0.314SS..Hα-helixtrans-59.9-51.2177.6-53.10000112.3D139 R141 V145 E146 D147D139-T143 PolarHBondContact O-N 3.28Å; R141-T143 VanDerWaalsContact C-N 3.32Å; R141-T143 PolarHBondContact O-N 3.39Å; T143-V145 VanDerWaalsContact C-N 3.28Å; T143-V145 PolarHBondContact O-N 3.25Å; T143-E146 PolarHBondContact O-N 2.96Å; T143-D147 PolarHBondContact O-N 3.28Å
144V97.8Very high96.8Very high7 Ų760.6 Ų60.64%0.04233%0.331CS..Hα-helixtrans-68.1-29-178.6-60.80000112.5Y129 L132 A133 A136 A140 R141 S148Y129-V144 HydrophobicContact CD1-CB 4.18Å; Y129-V144 HydrophobicContact CD1-CG1 4.24Å; L132-V144 HydrophobicContact CB-CB 4.21Å; L132-V144 HydrophobicContact CB-CG1 4.1Å; L132-V144 HydrophobicContact CB-CG2 4.39Å; L132-V144 HydrophobicContact CD1-CG1 4.36Å; A133-V144 HydrophobicContact CB-CG2 3.8Å; A136-V144 HydrophobicContact CB-CG2 4Å; A140-V144 WeakPolarHBondContact O-CG2 3.37Å; A140-V144 PolarHBondContact O-N 3.26Å; R141-V144 VanDerWaalsContact O-CG2 3.25Å; R141-V144 WeakPolarHBondContact O-CG2 3.46Å; R141-V144 PolarHBondContact O-N 2.99Å; V144-S148 VanDerWaalsContact O-CB 3.25Å; V144-S148 WeakPolarHBondContact O-CB 3.48Å; V144-S148 PolarHBondContact O-N 3.07Å
145V98.5Very high96.9Very high20 Ų2058.9 Ų58.912%0.12132%0.323CS..Hα-helixtrans-66.6-45173.5170.20000111A133 R141 N142 T143 S148 K149 F180 I184 I185A133-V145 HydrophobicContact CB-CG2 3.79Å; R141-V145 HydrophobicContact CG-CG2 4.01Å; R141-V145 WeakPolarHBondContact O-CB 3.32Å; R141-V145 WeakPolarHBondContact O-CG2 3.44Å; R141-V145 PolarHBondContact O-N 3.32Å; N142-V145 PolarHBondContact O-N 3.37Å; T143-V145 VanDerWaalsContact C-N 3.28Å; T143-V145 PolarHBondContact O-N 3.25Å; V145-S148 PolarHBondContact O-N 2.94Å; V145-K149 WeakPolarHBondContact O-CB 3.24Å; V145-K149 PolarHBondContact O-N 3.01Å; V145-F180 HydrophobicContact CG1-CE2 4.44Å; V145-F180 HydrophobicContact CG1-CZ 4.11Å; V145-I184 HydrophobicContact CG1-CG2 4.31Å; V145-I184 HydrophobicContact CG2-CG2 3.58Å; V145-I185 HydrophobicContact CG1-CD1 3.38Å
146E98.2Very high97Very high136 Ų13660.1 Ų60.164%0.63633%0.328SS*.Hα-helixtrans-63.5-44.8176.5-73.4-179.4171.600111.8N142 T143 K149 K150N142-E146 WeakPolarHBondContact O-CG 3.41Å; N142-E146 PolarHBondContact O-N 2.91Å; T143-E146 PolarHBondContact O-N 2.96Å; E146-K149 PolarHBondContact O-N 3.33Å; E146-K150 WeakPolarHBondContact O-CB 3.26Å; E146-K150 PolarHBondContact O-N 3.43Å
147D98.5Very high97.1Very high53 Ų5363.2 Ų63.228%0.28334%0.342SS..Hα-helixtrans-64.3-40.9177.7-76.3-34.5000112.3Y129 T143 K150 A151Y129-D147 HydrophobicContact CD1-CB 3.87Å; Y129-D147 HydrophobicContact CD2-CB 3.79Å; Y129-D147 HydrophobicContact CE1-CB 3.85Å; Y129-D147 HydrophobicContact CE2-CB 3.75Å; Y129-D147 HydrophobicContact CG-CB 3.86Å; T143-D147 PolarHBondContact O-N 3.28Å; D147-K150 PolarHBondContact O-N 2.98Å; D147-A151 WeakPolarHBondContact O-CB 3.37Å; D147-A151 PolarHBondContact O-N 3.11Å
148S98.7Very high97.4Very high0 Ų059.6 Ų59.60%032%0.317CS..Hα-helixtrans-57-52.4172.2176.30000111G126 V144 V145 K150 A151 Y152 F180G126-S148 PolarHBondContact O-OG 2.93Å; V144-S148 VanDerWaalsContact O-CB 3.25Å; V144-S148 WeakPolarHBondContact O-CB 3.48Å; V144-S148 PolarHBondContact O-N 3.07Å; V145-S148 PolarHBondContact O-N 2.94Å; S148-K150 VanDerWaalsContact C-N 3.32Å; S148-K150 PolarHBondContact O-N 3.46Å; S148-A151 PolarHBondContact O-N 2.96Å; S148-Y152 WeakPolarHBondContact O-CD2 3.22Å; S148-Y152 PolarHBondContact O-N 3.39Å; S148-Y152 WeakPolarHBondContact OG-CE2 3.46Å; S148-F180 WeakPolarHBondContact OG-CD2 3.44Å; S148-F180 WeakPolarHBondContact OG-CE2 3.3Å
149K98.7Very high97.7Very high86 Ų8656.9 Ų56.937%0.37429%0.29SS..Hα-helixtrans-60.3-43.2-179.7-173.6-179.1176.7-171.60111.5V145 E146 Y152 Q153 F180V145-K149 WeakPolarHBondContact O-CB 3.24Å; V145-K149 PolarHBondContact O-N 3.01Å; E146-K149 PolarHBondContact O-N 3.33Å; K149-Y152 PolarHBondContact O-N 2.91Å; K149-Q153 VanDerWaalsContact O-CB 3.3Å; K149-Q153 WeakPolarHBondContact O-CB 3.25Å; K149-Q153 PolarHBondContact O-N 3.08Å; K149-F180 HydrophobicContact CB-CE1 3.81Å; K149-F180 HydrophobicContact CB-CZ 3.82Å; K149-F180 HydrophobicContact CG-CE1 4.16Å
150K98.7Very high97.9Very high143 Ų14356.3 Ų56.362%0.62228%0.281SS*.Hα-helixtrans-61.1-47.8178.7-177.3-178.8177.6-178.50111.3E146 D147 S148 Q153 E154E146-K150 WeakPolarHBondContact O-CB 3.26Å; E146-K150 PolarHBondContact O-N 3.43Å; D147-K150 PolarHBondContact O-N 2.98Å; S148-K150 VanDerWaalsContact C-N 3.32Å; S148-K150 PolarHBondContact O-N 3.46Å; K150-Q153 PolarHBondContact O-N 2.84Å; K150-E154 WeakPolarHBondContact O-CB 3.32Å; K150-E154 PolarHBondContact O-N 3.04Å
151A98.8Very high98.1Very high4 Ų458.3 Ų58.33%0.03329%0.287CS..Hα-helixtrans-63.2-43.9179.500000112.2K125 D147 S148 A155K125-A151 HydrophobicContact CB-CB 4.05Å; K125-A151 HydrophobicContact CD-CB 4.18Å; K125-A151 HydrophobicContact CG-CB 3.9Å; D147-A151 WeakPolarHBondContact O-CB 3.37Å; D147-A151 PolarHBondContact O-N 3.11Å; S148-A151 PolarHBondContact O-N 2.96Å; A151-A155 WeakPolarHBondContact O-CB 3.41Å; A151-A155 PolarHBondContact O-N 2.87Å
152Y98.8Very high98.1Very high0 Ų061.6 Ų61.60%030%0.303CS..Hα-helixtrans-64.6-41.8175.1-75.3-54.1000112.7K123 D127 R130 S148 K149 A155 F156 L173 N176 F177 F180K123-Y152 HydrophobicContact CG-CE1 4.49Å; D127-Y152 VanDerWaalsContact CA-OH 3.3Å; D127-Y152 WeakPolarHBondContact CA-OH 3.3Å; D127-Y152 PolarHBondContact N-OH 3.24Å; D127-Y152 PolarHBondContact OD1-OH 3.5Å; R130-Y152 HydrophobicContact CB-CE2 4.48Å; R130-Y152 PolarHBondContact NE-OH 3.23Å; S148-Y152 WeakPolarHBondContact O-CD2 3.22Å; S148-Y152 PolarHBondContact O-N 3.39Å; S148-Y152 WeakPolarHBondContact OG-CE2 3.46Å; K149-Y152 PolarHBondContact O-N 2.91Å; Y152-A155 PolarHBondContact O-N 3.1Å; Y152-F156 VanDerWaalsContact O-CB 3.28Å; Y152-F156 WeakPolarHBondContact O-CB 3.45Å; Y152-F156 PolarHBondContact O-N 2.72Å; Y152-L173 HydrophobicContact CD1-CD1 3.69Å; Y152-L173 HydrophobicContact CE1-CD1 4.41Å; Y152-N176 HydrophobicContact CE1-CB 4.13Å; Y152-F177 VanDerWaalsContact CB-CD2 3.44Å; Y152-F177 VanDerWaalsContact CB-CE2 3.47Å; Y152-F177 HydrophobicContact CD1-CB 4.08Å; Y152-F177 HydrophobicContact CD1-CD2 4.45Å; Y152-F177 HydrophobicContact CD1-CG 4.32Å; Y152-F177 AromaticContact CD2-CD2 3.66Å; Y152-F177 HydrophobicContact CD2-CD2 3.66Å; Y152-F177 HydrophobicContact CD2-CE2 4.05Å; Y152-F177 HydrophobicContact CD2-CG 4.33Å; Y152-F177 HydrophobicContact CE2-CD2 4.47Å; Y152-F177 HydrophobicContact CG-CB 4.11Å; Y152-F177 AromaticContact CG-CD2 3.63Å; Y152-F177 HydrophobicContact CG-CD2 3.63Å; Y152-F177 HydrophobicContact CG-CE2 4.07Å; Y152-F177 AromaticContact CG-CG 3.88Å; Y152-F177 HydrophobicContact CG-CG 3.88Å; Y152-F180 HydrophobicContact CD2-CB 4.2Å; Y152-F180 HydrophobicContact CD2-CD1 4.28Å; Y152-F180 HydrophobicContact CD2-CG 4.08Å; Y152-F180 HydrophobicContact CE2-CB 3.72Å; Y152-F180 HydrophobicContact CE2-CD2 4.14Å; Y152-F180 AromaticContact CE2-CG 3.89Å; Y152-F180 HydrophobicContact CE2-CG 3.89Å
153Q98.6Very high98.1Very high68 Ų6857.8 Ų57.832%0.31828%0.283SS..Hα-helixtrans-64.3-45178.8-171.663.455.500111.4K149 K150 A155 F156 D157K149-Q153 VanDerWaalsContact O-CB 3.3Å; K149-Q153 WeakPolarHBondContact O-CB 3.25Å; K149-Q153 PolarHBondContact O-N 3.08Å; K150-Q153 PolarHBondContact O-N 2.84Å; Q153-A155 VanDerWaalsContact C-N 3.33Å; Q153-A155 PolarHBondContact O-N 3.33Å; Q153-F156 PolarHBondContact O-N 2.86Å; Q153-F156 VanDerWaalsContact O-N 3.08Å; Q153-D157 PolarHBondContact NE2-OD1 2.96Å; Q153-D157 VanDerWaalsContact O-CG 3.23Å; Q153-D157 PolarHBondContact O-N 3.36Å
154E98.5Very high98.1Very high77 Ų7759.1 Ų59.136%0.3628%0.283SS..Hα-helixtrans-59.9-43.7176-169.4-174.7155.400111.2L122 K150 F156 I158L122-E154 HydrophobicContact CD1-CB 4.17Å; L122-E154 HydrophobicContact CD1-CG 3.73Å; L122-E154 HydrophobicContact CD2-CB 4.46Å; L122-E154 HydrophobicContact CD2-CG 4.33Å; K150-E154 WeakPolarHBondContact O-CB 3.32Å; K150-E154 PolarHBondContact O-N 3.04Å; E154-F156 VanDerWaalsContact C-N 3.3Å; E154-F156 PolarHBondContact O-N 2.87Å; E154-I158 HydrophobicContact CG-CD1 4.42Å; E154-I158 WeakPolarHBondContact O-CG1 3.24Å; E154-I158 PolarHBondContact O-N 3.03Å
155A98.8Very high98.1Very high0 Ų059.5 Ų59.50%029%0.286CS..Hα-helixtrans-60.3-41.817400000111.6V119 L122 A151 Y152 Q153 A159 L173V119-A155 HydrophobicContact CG1-CB 4.33Å; L122-A155 HydrophobicContact CB-CB 3.65Å; A151-A155 WeakPolarHBondContact O-CB 3.41Å; A151-A155 PolarHBondContact O-N 2.87Å; Y152-A155 PolarHBondContact O-N 3.1Å; Q153-A155 VanDerWaalsContact C-N 3.33Å; Q153-A155 PolarHBondContact O-N 3.33Å; A155-A159 VanDerWaalsContact O-CB 3.26Å; A155-A159 WeakPolarHBondContact O-CB 3.49Å; A155-A159 PolarHBondContact O-N 3.37Å; A155-L173 VanDerWaalsContact C-CD2 3.48Å; A155-L173 HydrophobicContact CB-CD1 3.78Å; A155-L173 HydrophobicContact CB-CD2 3.65Å; A155-L173 HydrophobicContact CB-CG 4.39Å
156F98.4Very high98Very high34 Ų3458.6 Ų58.615%0.14928%0.28CS..Hα-helixtrans-69.8-40.9-175.1-167.4-95.4000111.8Y152 Q153 E154 I158 A159 K160 L173 F177 L194Y152-F156 VanDerWaalsContact O-CB 3.28Å; Y152-F156 WeakPolarHBondContact O-CB 3.45Å; Y152-F156 PolarHBondContact O-N 2.72Å; Q153-F156 PolarHBondContact O-N 2.86Å; Q153-F156 VanDerWaalsContact O-N 3.08Å; E154-F156 VanDerWaalsContact C-N 3.3Å; E154-F156 PolarHBondContact O-N 2.87Å; F156-I158 VanDerWaalsContact C-N 3.35Å; F156-I158 PolarHBondContact O-N 2.92Å; F156-A159 PolarHBondContact O-N 3.16Å; F156-K160 HydrophobicContact CE1-CD 4.41Å; F156-K160 VanDerWaalsContact O-CB 3.25Å; F156-K160 WeakPolarHBondContact O-CB 3.44Å; F156-K160 PolarHBondContact O-N 2.86Å; F156-L173 HydrophobicContact CB-CD2 4.11Å; F156-L173 HydrophobicContact CD2-CD2 4.24Å; F156-F177 HydrophobicContact CB-CE1 4.42Å; F156-F177 HydrophobicContact CD2-CD1 4.43Å; F156-L194 HydrophobicContact CD2-CD1 4.39Å; F156-L194 HydrophobicContact CE2-CD1 3.56Å; F156-L194 HydrophobicContact CZ-CD1 3.65Å
157D98.3Very high97.9Very high86 Ų8653.8 Ų53.846%0.4626%0.258SS..Hα-helixtrans-63.9-40.3178-65.6-20.5000111.6Q153 T161Q153-D157 PolarHBondContact NE2-OD1 2.96Å; Q153-D157 VanDerWaalsContact O-CG 3.23Å; Q153-D157 PolarHBondContact O-N 3.36Å; D157-T161 PolarHBondContact O-OG1 2.91Å; D157-T161 VanDerWaalsContact O-OG1 3.11Å
158I98.5Very high97.8Very high39 Ų3952.3 Ų52.320%0.225%0.251CS..Hα-helixtrans-68-49.3174.2-61.2166.7000110.2P115 K118 V119 L122 E154 F156 K160 T161 K162P115-I158 HydrophobicContact CB-CG2 4.16Å; K118-I158 HydrophobicContact CG-CD1 3.82Å; V119-I158 HydrophobicContact CG2-CB 3.8Å; V119-I158 HydrophobicContact CG2-CG2 3.55Å; L122-I158 HydrophobicContact CD1-CD1 3.75Å; E154-I158 HydrophobicContact CG-CD1 4.42Å; E154-I158 WeakPolarHBondContact O-CG1 3.24Å; E154-I158 PolarHBondContact O-N 3.03Å; F156-I158 VanDerWaalsContact C-N 3.35Å; F156-I158 PolarHBondContact O-N 2.92Å; I158-K160 VanDerWaalsContact C-N 3.32Å; I158-K160 PolarHBondContact O-N 2.68Å; I158-T161 PolarHBondContact O-N 3.3Å; I158-T161 PolarHBondContact O-OG1 3.49Å; I158-T161 VanDerWaalsContact O-OG1 3.14Å; I158-K162 HydrophobicContact CG2-CB 4.42Å; I158-K162 HydrophobicContact CG2-CG 4.17Å; I158-K162 WeakPolarHBondContact O-CB 3.28Å; I158-K162 PolarHBondContact O-N 3.44Å
159A98.4Very high97.7Very high0 Ų053.2 Ų53.20%026%0.256CS..Hα-helixtrans-61-41.1-17700000112.2V119 A155 F156 T161 M163 R170 L173V119-A159 HydrophobicContact CG1-CB 4Å; V119-A159 HydrophobicContact CG2-CB 4.1Å; A155-A159 VanDerWaalsContact O-CB 3.26Å; A155-A159 WeakPolarHBondContact O-CB 3.49Å; A155-A159 PolarHBondContact O-N 3.37Å; F156-A159 PolarHBondContact O-N 3.16Å; A159-T161 PolarHBondContact O-N 3.13Å; A159-M163 HydrophobicContact CB-SD 3.92Å; A159-M163 WeakPolarHBondContact O-CB 3.31Å; A159-M163 PolarHBondContact O-N 3.14Å; A159-R170 HydrophobicContact CB-CB 4.31Å; A159-R170 HydrophobicContact CB-CG 4.07Å; A159-L173 HydrophobicContact CB-CD2 4.02Å
160K97.1Very high97.7Very high121 Ų12150.7 Ų50.753%0.52624%0.244SC..Hα-helixtrans-60.9-31.8179.1-173.6174.5-178.2178.20112.8F156 I158F156-K160 HydrophobicContact CE1-CD 4.41Å; F156-K160 VanDerWaalsContact O-CB 3.25Å; F156-K160 WeakPolarHBondContact O-CB 3.44Å; F156-K160 PolarHBondContact O-N 2.86Å; I158-K160 VanDerWaalsContact C-N 3.32Å; I158-K160 PolarHBondContact O-N 2.68Å
161T96.4Very high97.7Very high103 Ų10343.9 Ų43.963%0.63221%0.214SC*.Hα-helixtrans-100.2-22.4-175.757.80000114D157 I158 A159D157-T161 PolarHBondContact O-OG1 2.91Å; D157-T161 VanDerWaalsContact O-OG1 3.11Å; I158-T161 PolarHBondContact O-N 3.3Å; I158-T161 PolarHBondContact O-OG1 3.49Å; I158-T161 VanDerWaalsContact O-OG1 3.14Å; A159-T161 PolarHBondContact O-N 3.13Å
162K97.7Very high97.7Very high143 Ų14344.1 Ų44.162%0.62222%0.217SC*.Hα-helixtrans-117.4-7-171.5-59.3-57.1-173.1-1760114.9P115 I158P115-K162 HydrophobicContact CB-CB 3.67Å; P115-K162 HydrophobicContact CB-CG 4.11Å; P115-K162 HydrophobicContact CG-CB 3.99Å; P115-K162 HydrophobicContact CG-CG 4.11Å; I158-K162 HydrophobicContact CG2-CB 4.42Å; I158-K162 HydrophobicContact CG2-CG 4.17Å; I158-K162 WeakPolarHBondContact O-CB 3.28Å; I158-K162 PolarHBondContact O-N 3.44Å
163M96.5Very high97.7Very high15 Ų1544.1 Ų44.17%0.07422%0.217CC..SBendtrans-133.9140.6-173.1-52.5177.37000110.7E116 V119 A159 H167 I169 R170E116-M163 HydrophobicContact CG-CE 4.06Å; V119-M163 HydrophobicContact CB-SD 3.96Å; V119-M163 HydrophobicContact CG1-SD 4Å; V119-M163 HydrophobicContact CG2-SD 3.79Å; A159-M163 HydrophobicContact CB-SD 3.92Å; A159-M163 WeakPolarHBondContact O-CB 3.31Å; A159-M163 PolarHBondContact O-N 3.14Å; M163-H167 HydrophobicContact CB-CB 4.34Å; M163-H167 HydrophobicContact CE-CB 4.18Å; M163-H167 WeakPolarHBondContact CE-CE1 3.39Å; M163-H167 VanDerWaalsContact CE-CG 3.41Å; M163-H167 WeakPolarHBondContact CE-ND1 3.45Å; M163-I169 HydrophobicContact CE-CB 3.75Å; M163-I169 HydrophobicContact CE-CG2 4Å; M163-R170 HydrophobicContact CB-CB 4.34Å; M163-R170 HydrophobicContact CE-CB 4.44Å; M163-R170 PolarHBondContact O-NH1 3.09Å
164Q96Very high97.7Very high107 Ų10741 Ų4150%0.520%0.203SC..  trans-62.2146.2173.9-72.3177.3-29.700110.9T166 H167 R170Q164-T166 PolarHBondContact O-N 2.96Å; Q164-H167 WeakPolarHBondContact O-CB 3.2Å; Q164-H167 PolarHBondContact O-N 3.47Å; Q164-R170 WeakPolarHBondContact O-CD 3.43Å
165P97.2Very high97.7Very high15 Ų1538.2 Ų38.210%0.09719%0.19CC..THydrogen-bonded Turntrans-51.7-34.1175.3-28.136.4000114.5H167 L171 D201 E205P165-H167 VanDerWaalsContact C-N 3.3Å; P165-H167 PolarHBondContact O-N 3.41Å; P165-L171 WeakPolarHBondContact O-CG 3.32Å; P165-D201 HydrophobicContact CB-CB 3.88Å; P165-D201 WeakPolarHBondContact CB-O 3.46Å; P165-D201 HydrophobicContact CG-CB 4.32Å; P165-E205 VanDerWaalsContact CD-OE2 3.31Å; P165-E205 WeakPolarHBondContact CD-OE2 3.16Å; P165-E205 WeakPolarHBondContact CG-OE1 3.21Å
166T96.4Very high97.7Very high0 Ų039.7 Ų39.70%020%0.198CC..THydrogen-bonded Turntrans-78.5-7.7179.253.20000114Q164 L171 A202 E205 S217Q164-T166 PolarHBondContact O-N 2.96Å; T166-L171 WeakPolarHBondContact O-CD1 3.06Å; T166-A202 HydrophobicContact CG2-CB 4.38Å; T166-A202 WeakPolarHBondContact CG2-O 3.42Å; T166-E205 HydrophobicContact CG2-CB 3.97Å; T166-E205 WeakPolarHBondContact CG2-O 3.2Å; T166-S217 WeakPolarHBondContact O-CB 3.28Å; T166-S217 PolarHBondContact O-OG 3.49Å
167H96.3Very high97.7Very high36 Ų3638.2 Ų38.217%0.16719%0.192CC..  trans-65.5128.9-175.4-171.9-58.5000111.5E116 M163 Q164 P165 I169 R170 L171E116-H167 IonicContact OE1-NE2 3.41Å; E116-H167 PolarHBondContact OE1-NE2 2.85Å; M163-H167 HydrophobicContact CB-CB 4.34Å; M163-H167 HydrophobicContact CE-CB 4.18Å; M163-H167 WeakPolarHBondContact CE-CE1 3.39Å; M163-H167 VanDerWaalsContact CE-CG 3.41Å; M163-H167 WeakPolarHBondContact CE-ND1 3.45Å; Q164-H167 WeakPolarHBondContact O-CB 3.2Å; Q164-H167 PolarHBondContact O-N 3.47Å; P165-H167 VanDerWaalsContact C-N 3.3Å; P165-H167 PolarHBondContact O-N 3.41Å; H167-I169 PolarHBondContact ND1-N 2.86Å; H167-I169 VanDerWaalsContact ND1-N 3.13Å; H167-I169 PolarHBondContact O-N 2.97Å; H167-R170 HydrophobicContact CB-CB 4.28Å; H167-R170 PolarHBondContact O-N 3.29Å; H167-L171 PolarHBondContact O-N 2.9Å
168P96.8Very high97.7Very high21 Ų2134.1 Ų34.114%0.13617%0.17CC..Hα-helixtrans-53-44.7-175.4-26.128.2000114.7R170 L171 G172 D216 S217 I220P168-R170 PolarHBondContact O-N 3.41Å; P168-L171 PolarHBondContact O-N 3.4Å; P168-G172 PolarHBondContact O-N 3.02Å; P168-D216 HydrophobicContact CB-CB 4.15Å; P168-D216 HydrophobicContact CG-CB 4.1Å; P168-S217 WeakPolarHBondContact CD-OG 3.42Å; P168-S217 WeakPolarHBondContact CG-OG 3.48Å; P168-I220 HydrophobicContact CB-CD1 4.14Å; P168-I220 VanDerWaalsContact O-CD1 3.31Å; P168-I220 WeakPolarHBondContact O-CD1 3.46Å
169I97.8Very high97.7Very high20 Ų2033.1 Ų33.110%0.10317%0.166CC..Hα-helixtrans-62.2-40.3176.9-62.3173.2000112.4E116 V119 F120 M163 H167 G172 L173E116-I169 HydrophobicContact CB-CD1 4.18Å; V119-I169 HydrophobicContact CB-CG2 4.25Å; V119-I169 HydrophobicContact CG1-CG2 3.73Å; F120-I169 HydrophobicContact CB-CD1 4.4Å; F120-I169 HydrophobicContact CB-CG2 4.42Å; F120-I169 HydrophobicContact CD2-CD1 4.05Å; F120-I169 HydrophobicContact CD2-CG1 4.22Å; M163-I169 HydrophobicContact CE-CB 3.75Å; M163-I169 HydrophobicContact CE-CG2 4Å; H167-I169 PolarHBondContact ND1-N 2.86Å; H167-I169 VanDerWaalsContact ND1-N 3.13Å; H167-I169 PolarHBondContact O-N 2.97Å; I169-G172 PolarHBondContact O-N 3.34Å; I169-L173 WeakPolarHBondContact O-CB 2.93Å; I169-L173 PolarHBondContact O-N 2.85Å
170R98.1Very high97.7Very high32 Ų3233.1 Ų33.112%0.12117%0.166CC..Hα-helixtrans-67.7-44.7178.1175.9174.7169.3-179.5-9.4110.8A159 M163 Q164 H167 P168 L173 A174 D201A159-R170 HydrophobicContact CB-CB 4.31Å; A159-R170 HydrophobicContact CB-CG 4.07Å; M163-R170 HydrophobicContact CB-CB 4.34Å; M163-R170 HydrophobicContact CE-CB 4.44Å; M163-R170 PolarHBondContact O-NH1 3.09Å; Q164-R170 WeakPolarHBondContact O-CD 3.43Å; H167-R170 HydrophobicContact CB-CB 4.28Å; H167-R170 PolarHBondContact O-N 3.29Å; P168-R170 PolarHBondContact O-N 3.41Å; R170-L173 WeakPolarHBondContact O-CB 3.41Å; R170-L173 PolarHBondContact O-N 3.26Å; R170-A174 PolarHBondContact O-N 3.46Å; R170-D201 IonicContact NH2-OD2 2.69Å
171L98.5Very high97.8Very high1 Ų128.4 Ų28.41%0.00515%0.145CC..Hα-helixtrans-60.4-46173.8-74.1170000111.6P165 T166 H167 P168 L173 A174 L175 A202 I220 M221 L224P165-L171 WeakPolarHBondContact O-CG 3.32Å; T166-L171 WeakPolarHBondContact O-CD1 3.06Å; H167-L171 PolarHBondContact O-N 2.9Å; P168-L171 PolarHBondContact O-N 3.4Å; L171-L173 VanDerWaalsContact C-N 3.28Å; L171-L173 PolarHBondContact O-N 2.99Å; L171-A174 PolarHBondContact O-N 2.97Å; L171-A174 VanDerWaalsContact O-N 3.15Å; L171-L175 PolarHBondContact O-N 3.04Å; L171-A202 HydrophobicContact CD2-CB 3.73Å; L171-I220 HydrophobicContact CB-CB 4.16Å; L171-I220 HydrophobicContact CB-CD1 4.46Å; L171-I220 HydrophobicContact CB-CG2 3.62Å; L171-M221 HydrophobicContact CD1-CG 3.87Å; L171-M221 HydrophobicContact CD1-SD 4.32Å; L171-M221 HydrophobicContact CD2-CG 4.03Å; L171-L224 HydrophobicContact CD2-CD1 3.98Å
172G98.4Very high97.9Very high9 Ų925.9 Ų25.99%0.09312%0.124CC..Hα-helixtrans-64.3-33.2178.400000112.6K123 P168 I169 N176K123-G172 WeakPolarHBondContact CE-O 3.27Å; P168-G172 PolarHBondContact O-N 3.02Å; I169-G172 PolarHBondContact O-N 3.34Å; G172-N176 PolarHBondContact O-N 3.04Å; G172-N176 VanDerWaalsContact O-N 3.09Å
173L98.8Very high97.8Very high0 Ų024 Ų240%012%0.117CC..Hα-helixtrans-63.9-49170.6169.563.9000111.1V119 K123 Y152 A155 F156 A159 I169 R170 L171 L175 N176 F177V119-L173 HydrophobicContact CG1-CD2 4.03Å; K123-L173 HydrophobicContact CB-CD1 4Å; K123-L173 HydrophobicContact CD-CB 4.11Å; K123-L173 HydrophobicContact CG-CB 4.29Å; K123-L173 HydrophobicContact CG-CD1 3.99Å; Y152-L173 HydrophobicContact CD1-CD1 3.69Å; Y152-L173 HydrophobicContact CE1-CD1 4.41Å; A155-L173 VanDerWaalsContact C-CD2 3.48Å; A155-L173 HydrophobicContact CB-CD1 3.78Å; A155-L173 HydrophobicContact CB-CD2 3.65Å; A155-L173 HydrophobicContact CB-CG 4.39Å; F156-L173 HydrophobicContact CB-CD2 4.11Å; F156-L173 HydrophobicContact CD2-CD2 4.24Å; A159-L173 HydrophobicContact CB-CD2 4.02Å; I169-L173 WeakPolarHBondContact O-CB 2.93Å; I169-L173 PolarHBondContact O-N 2.85Å; R170-L173 WeakPolarHBondContact O-CB 3.41Å; R170-L173 PolarHBondContact O-N 3.26Å; L171-L173 VanDerWaalsContact C-N 3.28Å; L171-L173 PolarHBondContact O-N 2.99Å; L173-L175 VanDerWaalsContact C-N 3.31Å; L173-L175 PolarHBondContact O-N 3.32Å; L173-N176 PolarHBondContact O-N 3Å; L173-F177 VanDerWaalsContact O-CB 3.24Å; L173-F177 WeakPolarHBondContact O-CB 3.26Å; L173-F177 PolarHBondContact O-N 2.88Å
174A98.7Very high97.9Very high2 Ų224.1 Ų24.12%0.01712%0.118CC..Hα-helixtrans-60.7-40.7178.500000112.1R170 L171 S178 A198R170-A174 PolarHBondContact O-N 3.46Å; L171-A174 PolarHBondContact O-N 2.97Å; L171-A174 VanDerWaalsContact O-N 3.15Å; A174-S178 VanDerWaalsContact O-CB 3.31Å; A174-S178 WeakPolarHBondContact O-CB 3.31Å; A174-S178 PolarHBondContact O-N 3.17Å; A174-S178 PolarHBondContact O-OG 3.04Å; A174-S178 VanDerWaalsContact O-OG 3.1Å; A174-A198 HydrophobicContact CB-CB 3.39Å
175L98.7Very high97.9Very high19 Ų1921.6 Ų21.610%0.09911%0.107CC..Hα-helixtrans-59-50.7174.7177.664.9000111.6L171 L173 S178 V179 I220 L223 L224 N227L171-L175 PolarHBondContact O-N 3.04Å; L173-L175 VanDerWaalsContact C-N 3.31Å; L173-L175 PolarHBondContact O-N 3.32Å; L175-S178 PolarHBondContact O-OG 3.46Å; L175-V179 VanDerWaalsContact O-CG2 3.28Å; L175-V179 WeakPolarHBondContact O-CG2 3.32Å; L175-V179 PolarHBondContact O-N 3.45Å; L175-V179 VanDerWaalsContact O-N 3.16Å; L175-I220 HydrophobicContact CB-CG2 4.3Å; L175-I220 HydrophobicContact CD2-CG2 4.18Å; L175-L223 HydrophobicContact CD1-CB 4.14Å; L175-L223 HydrophobicContact CD2-CB 3.95Å; L175-L223 HydrophobicContact CD2-CD1 3.93Å; L175-L224 HydrophobicContact CB-CD2 3.91Å; L175-L224 HydrophobicContact CB-CG 4.25Å; L175-L224 HydrophobicContact CD1-CD2 3.96Å; L175-L224 HydrophobicContact CD1-CG 4.2Å; L175-N227 VanDerWaalsContact CD1-ND2 3.28Å; L175-N227 WeakPolarHBondContact CD1-ND2 3.5Å
176N98.6Very high97.9Very high30 Ų3027.2 Ų27.216%0.1614%0.137CC..Hα-helixtrans-73-34.4-176.3-75.717.4000112.5K123 D127 Y152 G172 L173 V179 F180K123-N176 PolarHBondContact NZ-ND2 3.3Å; D127-N176 WeakPolarHBondContact OD1-CB 3.33Å; D127-N176 PolarHBondContact OD1-ND2 3.25Å; D127-N176 PolarHBondContact OD2-ND2 2.86Å; Y152-N176 HydrophobicContact CE1-CB 4.13Å; G172-N176 PolarHBondContact O-N 3.04Å; G172-N176 VanDerWaalsContact O-N 3.09Å; L173-N176 PolarHBondContact O-N 3Å; N176-V179 PolarHBondContact O-N 2.85Å; N176-F180 PolarHBondContact O-N 3.39Å
177F98.8Very high97.9Very high3 Ų328.4 Ų28.41%0.01315%0.145CC..Hα-helixtrans-73.6-32.2178.3-166.5-168.2000111.8Y152 F156 L173 F180 Y181 L194Y152-F177 VanDerWaalsContact CB-CD2 3.44Å; Y152-F177 VanDerWaalsContact CB-CE2 3.47Å; Y152-F177 HydrophobicContact CD1-CB 4.08Å; Y152-F177 HydrophobicContact CD1-CD2 4.45Å; Y152-F177 HydrophobicContact CD1-CG 4.32Å; Y152-F177 AromaticContact CD2-CD2 3.66Å; Y152-F177 HydrophobicContact CD2-CD2 3.66Å; Y152-F177 HydrophobicContact CD2-CE2 4.05Å; Y152-F177 HydrophobicContact CD2-CG 4.33Å; Y152-F177 HydrophobicContact CE2-CD2 4.47Å; Y152-F177 HydrophobicContact CG-CB 4.11Å; Y152-F177 AromaticContact CG-CD2 3.63Å; Y152-F177 HydrophobicContact CG-CD2 3.63Å; Y152-F177 HydrophobicContact CG-CE2 4.07Å; Y152-F177 AromaticContact CG-CG 3.88Å; Y152-F177 HydrophobicContact CG-CG 3.88Å; F156-F177 HydrophobicContact CB-CE1 4.42Å; F156-F177 HydrophobicContact CD2-CD1 4.43Å; L173-F177 VanDerWaalsContact O-CB 3.24Å; L173-F177 WeakPolarHBondContact O-CB 3.26Å; L173-F177 PolarHBondContact O-N 2.88Å; F177-F180 HydrophobicContact CD2-CB 4.25Å; F177-F180 AromaticContact CD2-CD1 3.74Å; F177-F180 HydrophobicContact CD2-CD1 3.74Å; F177-F180 HydrophobicContact CD2-CG 4.37Å; F177-F180 AromaticContact CE2-CD1 3.69Å; F177-F180 HydrophobicContact CE2-CD1 3.69Å; F177-F180 HydrophobicContact CE2-CE1 4.09Å; F177-F180 WeakPolarHBondContact O-CB 3.37Å; F177-F180 PolarHBondContact O-N 3.44Å; F177-Y181 HydrophobicContact CD1-CE2 4.19Å; F177-Y181 AromaticContact CD2-CD2 3.94Å; F177-Y181 HydrophobicContact CD2-CD2 3.94Å; F177-Y181 AromaticContact CD2-CE2 3.6Å; F177-Y181 HydrophobicContact CD2-CE2 3.6Å; F177-Y181 AromaticContact CE1-CE2 3.96Å; F177-Y181 HydrophobicContact CE1-CE2 3.96Å; F177-Y181 HydrophobicContact CE2-CD2 4.05Å; F177-Y181 HydrophobicContact CE2-CE1 4.41Å; F177-Y181 AromaticContact CE2-CE2 3.32Å; F177-Y181 HydrophobicContact CE2-CE2 3.32Å; F177-Y181 AromaticContact CE2-CZ 3.54Å; F177-Y181 HydrophobicContact CG-CD2 4.41Å; F177-Y181 HydrophobicContact CG-CE2 4.04Å; F177-Y181 AromaticContact CZ-CE2 3.54Å; F177-Y181 HydrophobicContact CZ-CE2 3.54Å; F177-Y181 AromaticContact CZ-CZ 3.64Å; F177-Y181 VanDerWaalsContact CZ-OH 3.24Å; F177-Y181 WeakPolarHBondContact CZ-OH 3.12Å; F177-Y181 WeakPolarHBondContact O-CD2 3.36Å; F177-Y181 PolarHBondContact O-N 2.93Å; F177-L194 HydrophobicContact CB-CD2 3.81Å; F177-L194 HydrophobicContact CD1-CD2 3.77Å; F177-L194 HydrophobicContact CG-CD2 3.8Å
178S98.6Very high97.9Very high0 Ų028.4 Ų28.40%015%0.148CC..Hα-helixtrans-67.2-4217266.10000111.3A174 L175 F180 Y181 Y182 A191 W231A174-S178 VanDerWaalsContact O-CB 3.31Å; A174-S178 WeakPolarHBondContact O-CB 3.31Å; A174-S178 PolarHBondContact O-N 3.17Å; A174-S178 PolarHBondContact O-OG 3.04Å; A174-S178 VanDerWaalsContact O-OG 3.1Å; L175-S178 PolarHBondContact O-OG 3.46Å; S178-F180 VanDerWaalsContact C-N 3.3Å; S178-F180 PolarHBondContact O-N 3.4Å; S178-Y181 PolarHBondContact O-N 3.47Å; S178-Y181 VanDerWaalsContact O-N 3.11Å; S178-Y182 PolarHBondContact O-N 3.34Å; S178-A191 WeakPolarHBondContact CB-O 3.35Å; S178-A191 VanDerWaalsContact O-CB 3.25Å; S178-A191 WeakPolarHBondContact O-CB 3.46Å; S178-W231 WeakPolarHBondContact OG-CH2 3Å
179V98.3Very high97.9Very high19 Ų1931.2 Ų31.212%0.11517%0.173CC..Hα-helixtrans-58.7-40.81721730000111.4L175 N176 Y182 E183 W231L175-V179 VanDerWaalsContact O-CG2 3.28Å; L175-V179 WeakPolarHBondContact O-CG2 3.32Å; L175-V179 PolarHBondContact O-N 3.45Å; L175-V179 VanDerWaalsContact O-N 3.16Å; N176-V179 PolarHBondContact O-N 2.85Å; V179-Y182 PolarHBondContact O-N 3.1Å; V179-E183 HydrophobicContact CG1-CG 3.99Å; V179-E183 VanDerWaalsContact CG1-OE2 3.31Å; V179-E183 WeakPolarHBondContact CG1-OE2 3.26Å; V179-E183 WeakPolarHBondContact O-CB 3.34Å; V179-E183 PolarHBondContact O-N 2.82Å; V179-W231 HydrophobicContact CG2-CH2 3.98Å; V179-W231 HydrophobicContact CG2-CZ2 3.98Å
180F98.7Very high97.9Very high0 Ų036.9 Ų36.90%019%0.193CC..Hα-helixtrans-58.5-47.2172.7170.8-102.5000112.4R130 V145 S148 K149 Y152 N176 F177 S178 Y182 I184 I185R130-F180 HydrophobicContact CB-CD2 4.25Å; R130-F180 HydrophobicContact CG-CD2 4.33Å; V145-F180 HydrophobicContact CG1-CE2 4.44Å; V145-F180 HydrophobicContact CG1-CZ 4.11Å; S148-F180 WeakPolarHBondContact OG-CD2 3.44Å; S148-F180 WeakPolarHBondContact OG-CE2 3.3Å; K149-F180 HydrophobicContact CB-CE1 3.81Å; K149-F180 HydrophobicContact CB-CZ 3.82Å; K149-F180 HydrophobicContact CG-CE1 4.16Å; Y152-F180 HydrophobicContact CD2-CB 4.2Å; Y152-F180 HydrophobicContact CD2-CD1 4.28Å; Y152-F180 HydrophobicContact CD2-CG 4.08Å; Y152-F180 HydrophobicContact CE2-CB 3.72Å; Y152-F180 HydrophobicContact CE2-CD2 4.14Å; Y152-F180 AromaticContact CE2-CG 3.89Å; Y152-F180 HydrophobicContact CE2-CG 3.89Å; N176-F180 PolarHBondContact O-N 3.39Å; F177-F180 HydrophobicContact CD2-CB 4.25Å; F177-F180 AromaticContact CD2-CD1 3.74Å; F177-F180 HydrophobicContact CD2-CD1 3.74Å; F177-F180 HydrophobicContact CD2-CG 4.37Å; F177-F180 AromaticContact CE2-CD1 3.69Å; F177-F180 HydrophobicContact CE2-CD1 3.69Å; F177-F180 HydrophobicContact CE2-CE1 4.09Å; F177-F180 WeakPolarHBondContact O-CB 3.37Å; F177-F180 PolarHBondContact O-N 3.44Å; S178-F180 VanDerWaalsContact C-N 3.3Å; S178-F180 PolarHBondContact O-N 3.4Å; F180-Y182 VanDerWaalsContact C-N 3.26Å; F180-Y182 PolarHBondContact O-N 2.65Å; F180-I184 HydrophobicContact CD2-CB 3.76Å; F180-I184 HydrophobicContact CD2-CG1 3.92Å; F180-I184 HydrophobicContact CD2-CG2 4.07Å; F180-I184 HydrophobicContact CE2-CB 3.88Å; F180-I184 HydrophobicContact CE2-CG1 4.38Å; F180-I184 HydrophobicContact CE2-CG2 3.68Å; F180-I184 WeakPolarHBondContact O-CB 3.05Å; F180-I184 PolarHBondContact O-N 2.73Å; F180-I185 HydrophobicContact CD1-CG1 3.93Å; F180-I185 HydrophobicContact CE1-CD1 3.77Å; F180-I185 HydrophobicContact CE1-CG1 3.34Å; F180-I185 HydrophobicContact CE2-CD1 4.35Å; F180-I185 HydrophobicContact CE2-CG1 4.28Å; F180-I185 HydrophobicContact CZ-CD1 3.54Å; F180-I185 HydrophobicContact CZ-CG1 3.56Å; F180-I185 PolarHBondContact O-N 3.39Å; F180-I185 VanDerWaalsContact O-N 3.15Å
181Y98.5Very high97.9Very high22 Ų2235.3 Ų35.39%0.08619%0.188CC..Hα-helixtrans-62.1-36.9177.8-80.8-60.6000112.3F177 S178 I185 N186 S187 R190 L194F177-Y181 HydrophobicContact CD1-CE2 4.19Å; F177-Y181 AromaticContact CD2-CD2 3.94Å; F177-Y181 HydrophobicContact CD2-CD2 3.94Å; F177-Y181 AromaticContact CD2-CE2 3.6Å; F177-Y181 HydrophobicContact CD2-CE2 3.6Å; F177-Y181 AromaticContact CE1-CE2 3.96Å; F177-Y181 HydrophobicContact CE1-CE2 3.96Å; F177-Y181 HydrophobicContact CE2-CD2 4.05Å; F177-Y181 HydrophobicContact CE2-CE1 4.41Å; F177-Y181 AromaticContact CE2-CE2 3.32Å; F177-Y181 HydrophobicContact CE2-CE2 3.32Å; F177-Y181 AromaticContact CE2-CZ 3.54Å; F177-Y181 HydrophobicContact CG-CD2 4.41Å; F177-Y181 HydrophobicContact CG-CE2 4.04Å; F177-Y181 AromaticContact CZ-CE2 3.54Å; F177-Y181 HydrophobicContact CZ-CE2 3.54Å; F177-Y181 AromaticContact CZ-CZ 3.64Å; F177-Y181 VanDerWaalsContact CZ-OH 3.24Å; F177-Y181 WeakPolarHBondContact CZ-OH 3.12Å; F177-Y181 WeakPolarHBondContact O-CD2 3.36Å; F177-Y181 PolarHBondContact O-N 2.93Å; S178-Y181 PolarHBondContact O-N 3.47Å; S178-Y181 VanDerWaalsContact O-N 3.11Å; Y181-I185 HydrophobicContact CD1-CB 4.21Å; Y181-I185 HydrophobicContact CD1-CG1 4.14Å; Y181-I185 HydrophobicContact CD1-CG2 4.24Å; Y181-N186 PolarHBondContact O-N 2.93Å; Y181-S187 PolarHBondContact O-N 3.2Å; Y181-R190 HydrophobicContact CD1-CB 4.17Å; Y181-R190 HydrophobicContact CG-CB 4.18Å; Y181-L194 HydrophobicContact CD2-CD2 3.98Å; Y181-L194 HydrophobicContact CE2-CD2 4.03Å
182Y98.1Very high97.8Very high50 Ų5036.2 Ų36.220%0.19619%0.193CC..Hα-helixtrans-71.4-63.6178.2-166.1-98.6000111.5S178 V179 F180 N186 P188 A191 W231 D234S178-Y182 PolarHBondContact O-N 3.34Å; V179-Y182 PolarHBondContact O-N 3.1Å; F180-Y182 VanDerWaalsContact C-N 3.26Å; F180-Y182 PolarHBondContact O-N 2.65Å; Y182-N186 WeakPolarHBondContact O-CA 3.25Å; Y182-N186 PolarHBondContact O-N 2.87Å; Y182-P188 HydrophobicContact CD2-CB 4.09Å; Y182-P188 HydrophobicContact CD2-CG 4.21Å; Y182-P188 HydrophobicContact CE2-CB 3.94Å; Y182-P188 HydrophobicContact CE2-CG 3.97Å; Y182-A191 HydrophobicContact CD2-CB 4.29Å; Y182-W231 AromaticContact CD1-CD1 3.81Å; Y182-W231 AromaticContact CD1-CE2 3.92Å; Y182-W231 HydrophobicContact CD1-CZ2 4.44Å; Y182-W231 AromaticContact CD1-NE1 3.39Å; Y182-W231 HydrophobicContact CD2-CB 4.09Å; Y182-W231 AromaticContact CD2-CD1 3.57Å; Y182-W231 AromaticContact CD2-CD2 3.71Å; Y182-W231 HydrophobicContact CD2-CD2 3.71Å; Y182-W231 AromaticContact CD2-CE2 3.85Å; Y182-W231 HydrophobicContact CD2-CE3 4.42Å; Y182-W231 AromaticContact CD2-CG 3.53Å; Y182-W231 HydrophobicContact CD2-CG 3.53Å; Y182-W231 AromaticContact CD2-NE1 3.75Å; Y182-W231 AromaticContact CE1-CD1 3.48Å; Y182-W231 VanDerWaalsContact CE1-CD1 3.48Å; Y182-W231 HydrophobicContact CE1-CG 4.38Å; Y182-W231 AromaticContact CE1-NE1 3.46Å; Y182-W231 HydrophobicContact CE2-CB 3.68Å; Y182-W231 AromaticContact CE2-CD1 3.26Å; Y182-W231 HydrophobicContact CE2-CD2 4.1Å; Y182-W231 AromaticContact CE2-CG 3.4Å; Y182-W231 HydrophobicContact CE2-CG 3.4Å; Y182-W231 AromaticContact CE2-NE1 3.85Å; Y182-W231 AromaticContact CG-CD1 3.85Å; Y182-W231 AromaticContact CG-CD2 3.99Å; Y182-W231 HydrophobicContact CG-CD2 3.99Å; Y182-W231 AromaticContact CG-CE2 3.62Å; Y182-W231 HydrophobicContact CG-CG 4.12Å; Y182-W231 HydrophobicContact CG-CZ2 4.1Å; Y182-W231 AromaticContact CG-NE1 3.53Å; Y182-W231 AromaticContact CZ-CD1 3.2Å; Y182-W231 AromaticContact CZ-CG 3.85Å; Y182-W231 AromaticContact CZ-NE1 3.7Å; Y182-D234 PolarHBondContact OH-OD2 3.08Å
183E96.3Very high97.8Very high103 Ų10341.8 Ų41.848%0.48122%0.217SC..Hα-helixtrans-78.5-31.4-167.6-63.2-179.7167.400113.7R130 V179R130-E183 IonicContact NH1-OE2 2.93Å; V179-E183 HydrophobicContact CG1-CG 3.99Å; V179-E183 VanDerWaalsContact CG1-OE2 3.31Å; V179-E183 WeakPolarHBondContact CG1-OE2 3.26Å; V179-E183 WeakPolarHBondContact O-CB 3.34Å; V179-E183 PolarHBondContact O-N 2.82Å
184I97.7Very high97.8Very high17 Ų1742.5 Ų42.59%0.08722%0.221CC..THydrogen-bonded Turntrans-106.2-46.6-170.8-56.2-54.1000112.5R130 A133 R141 V145 F180 N186R130-I184 HydrophobicContact CG-CD1 4.29Å; R130-I184 HydrophobicContact CG-CG1 3.78Å; A133-I184 HydrophobicContact CB-CD1 4.31Å; A133-I184 HydrophobicContact CB-CG2 3.84Å; R141-I184 PolarHBondContact NH2-O 2.99Å; R141-I184 VanDerWaalsContact NH2-O 3.13Å; V145-I184 HydrophobicContact CG1-CG2 4.31Å; V145-I184 HydrophobicContact CG2-CG2 3.58Å; F180-I184 HydrophobicContact CD2-CB 3.76Å; F180-I184 HydrophobicContact CD2-CG1 3.92Å; F180-I184 HydrophobicContact CD2-CG2 4.07Å; F180-I184 HydrophobicContact CE2-CB 3.88Å; F180-I184 HydrophobicContact CE2-CG1 4.38Å; F180-I184 HydrophobicContact CE2-CG2 3.68Å; F180-I184 WeakPolarHBondContact O-CB 3.05Å; F180-I184 PolarHBondContact O-N 2.73Å; I184-N186 VanDerWaalsContact C-N 3.33Å
185I97.6Very high97.7Very high54 Ų5442.4 Ų42.428%0.27722%0.22SC..THydrogen-bonded Turntrans-82.8-15.7179.3-59.1-62.8000111.6V145 F180 Y181 S187V145-I185 HydrophobicContact CG1-CD1 3.38Å; F180-I185 HydrophobicContact CD1-CG1 3.93Å; F180-I185 HydrophobicContact CE1-CD1 3.77Å; F180-I185 HydrophobicContact CE1-CG1 3.34Å; F180-I185 HydrophobicContact CE2-CD1 4.35Å; F180-I185 HydrophobicContact CE2-CG1 4.28Å; F180-I185 HydrophobicContact CZ-CD1 3.54Å; F180-I185 HydrophobicContact CZ-CG1 3.56Å; F180-I185 PolarHBondContact O-N 3.39Å; F180-I185 VanDerWaalsContact O-N 3.15Å; Y181-I185 HydrophobicContact CD1-CB 4.21Å; Y181-I185 HydrophobicContact CD1-CG1 4.14Å; Y181-I185 HydrophobicContact CD1-CG2 4.24Å; I185-S187 VanDerWaalsContact C-N 3.32Å; I185-S187 PolarHBondContact O-N 3.46Å
186N96Very high97.7Very high133 Ų13347.3 Ų47.371%0.71124%0.24SC*.  trans53.848.7-174.8-165.437.1000112.1Y181 Y182 I184 P188Y181-N186 PolarHBondContact O-N 2.93Å; Y182-N186 WeakPolarHBondContact O-CA 3.25Å; Y182-N186 PolarHBondContact O-N 2.87Å; I184-N186 VanDerWaalsContact C-N 3.33Å; N186-P188 VanDerWaalsContact C-CD 3.49Å
187S97.2Very high97.7Very high25 Ų2548.9 Ų48.918%0.17525%0.247CC..  trans-126.772.9-179.4172.70000110.9Y181 I185 A189 R190 A191Y181-S187 PolarHBondContact O-N 3.2Å; I185-S187 VanDerWaalsContact C-N 3.32Å; I185-S187 PolarHBondContact O-N 3.46Å; S187-A189 VanDerWaalsContact C-N 3.29Å; S187-A189 PolarHBondContact O-N 3.47Å; S187-R190 PolarHBondContact O-N 3.33Å; S187-R190 VanDerWaalsContact OG-CB 3.31Å; S187-R190 WeakPolarHBondContact OG-CB 3.44Å; S187-R190 WeakPolarHBondContact OG-CD 3.4Å; S187-R190 VanDerWaalsContact OG-CG 3.28Å; S187-R190 WeakPolarHBondContact OG-CG 3.34Å; S187-A191 PolarHBondContact O-N 3.29Å; S187-A191 VanDerWaalsContact O-N 3.09Å
188P96.6Very high97.7Very high37 Ų3749.5 Ų49.524%0.2425%0.253CS..Hα-helixtrans-52.8-42.5-178.3-27.635.6000113.7Y182 N186 R190 A191 C192Y182-P188 HydrophobicContact CD2-CB 4.09Å; Y182-P188 HydrophobicContact CD2-CG 4.21Å; Y182-P188 HydrophobicContact CE2-CB 3.94Å; Y182-P188 HydrophobicContact CE2-CG 3.97Å; N186-P188 VanDerWaalsContact C-CD 3.49Å; P188-R190 VanDerWaalsContact C-N 3.32Å; P188-R190 PolarHBondContact O-N 2.9Å; P188-A191 WeakPolarHBondContact O-CB 3.39Å; P188-A191 PolarHBondContact O-N 2.99Å; P188-A191 VanDerWaalsContact O-N 3.11Å; P188-C192 WeakPolarHBondContact O-CB 3.49Å; P188-C192 PolarHBondContact O-N 3.11Å; P188-C192 PolarHBondContact O-SG 3.48Å; P188-C192 VanDerWaalsContact O-SG 3.39Å
189A96Very high97.6Very high80 Ų8051.5 Ų51.566%0.66126%0.261SS*.Hα-helixtrans-57.2-42.2178.600000113S187 H193S187-A189 VanDerWaalsContact C-N 3.29Å; S187-A189 PolarHBondContact O-N 3.47Å; A189-H193 VanDerWaalsContact O-CB 3.26Å; A189-H193 WeakPolarHBondContact O-CB 3.5Å; A189-H193 PolarHBondContact O-N 3.43Å
190R97Very high97.6Very high138 Ų13854.2 Ų54.252%0.52128%0.275SS..Hα-helixtrans-71.8-38.6176.1-70.1-176174.4169.50.7112.2Y181 S187 P188 H193 L194Y181-R190 HydrophobicContact CD1-CB 4.17Å; Y181-R190 HydrophobicContact CG-CB 4.18Å; S187-R190 PolarHBondContact O-N 3.33Å; S187-R190 VanDerWaalsContact OG-CB 3.31Å; S187-R190 WeakPolarHBondContact OG-CB 3.44Å; S187-R190 WeakPolarHBondContact OG-CD 3.4Å; S187-R190 VanDerWaalsContact OG-CG 3.28Å; S187-R190 WeakPolarHBondContact OG-CG 3.34Å; P188-R190 VanDerWaalsContact C-N 3.32Å; P188-R190 PolarHBondContact O-N 2.9Å; R190-H193 PolarHBondContact O-N 2.87Å; R190-L194 WeakPolarHBondContact O-CB 3.28Å; R190-L194 PolarHBondContact O-N 3.04Å
191A98Very high97.6Very high0 Ų056.8 Ų56.80%029%0.289CS..Hα-helixtrans-59.7-50.7176.100000110.9S178 Y182 S187 P188 L194 A195 W231S178-A191 WeakPolarHBondContact CB-O 3.35Å; S178-A191 VanDerWaalsContact O-CB 3.25Å; S178-A191 WeakPolarHBondContact O-CB 3.46Å; Y182-A191 HydrophobicContact CD2-CB 4.29Å; S187-A191 PolarHBondContact O-N 3.29Å; S187-A191 VanDerWaalsContact O-N 3.09Å; P188-A191 WeakPolarHBondContact O-CB 3.39Å; P188-A191 PolarHBondContact O-N 2.99Å; P188-A191 VanDerWaalsContact O-N 3.11Å; A191-L194 PolarHBondContact O-N 2.86Å; A191-A195 WeakPolarHBondContact O-CB 3.43Å; A191-A195 PolarHBondContact O-N 3.46Å; A191-W231 HydrophobicContact CB-CE3 4.09Å; A191-W231 HydrophobicContact CB-CZ3 3.98Å
192C97.9Very high97.5Very high19 Ų1955.8 Ų55.813%0.12829%0.285CS..Hα-helixtrans-63.3-43.7177.6-67.40000111.9P188 L194 A195 K196 L228P188-C192 WeakPolarHBondContact O-CB 3.49Å; P188-C192 PolarHBondContact O-N 3.11Å; P188-C192 PolarHBondContact O-SG 3.48Å; P188-C192 VanDerWaalsContact O-SG 3.39Å; C192-L194 PolarHBondContact O-N 3.43Å; C192-A195 PolarHBondContact O-N 3.27Å; C192-K196 WeakPolarHBondContact O-CB 3.47Å; C192-K196 PolarHBondContact O-N 3.37Å; C192-L228 HydrophobicContact CB-CD2 4.09Å; C192-L228 WeakPolarHBondContact O-CD2 3.22Å
193H97.7Very high97.4Very high126 Ų12657.3 Ų57.358%0.58330%0.296SS*.Hα-helixtrans-58.7-48.1176.9179.369.9000111.9A189 R190 Q197A189-H193 VanDerWaalsContact O-CB 3.26Å; A189-H193 WeakPolarHBondContact O-CB 3.5Å; A189-H193 PolarHBondContact O-N 3.43Å; R190-H193 PolarHBondContact O-N 2.87Å; H193-Q197 VanDerWaalsContact O-CB 3.3Å; H193-Q197 WeakPolarHBondContact O-CB 3.28Å; H193-Q197 PolarHBondContact O-N 3.33Å
194L98.2Very high97.4Very high16 Ų1656.5 Ų56.58%0.08431%0.307CS..Hα-helixtrans-64.4-46.9179.9-178.165.6000112.2F156 F177 Y181 R190 A191 C192 A198F156-L194 HydrophobicContact CD2-CD1 4.39Å; F156-L194 HydrophobicContact CE2-CD1 3.56Å; F156-L194 HydrophobicContact CZ-CD1 3.65Å; F177-L194 HydrophobicContact CB-CD2 3.81Å; F177-L194 HydrophobicContact CD1-CD2 3.77Å; F177-L194 HydrophobicContact CG-CD2 3.8Å; Y181-L194 HydrophobicContact CD2-CD2 3.98Å; Y181-L194 HydrophobicContact CE2-CD2 4.03Å; R190-L194 WeakPolarHBondContact O-CB 3.28Å; R190-L194 PolarHBondContact O-N 3.04Å; A191-L194 PolarHBondContact O-N 2.86Å; C192-L194 PolarHBondContact O-N 3.43Å; L194-A198 WeakPolarHBondContact O-CB 3.37Å; L194-A198 PolarHBondContact O-N 3.49Å
195A98.2Very high97.3Very high0 Ų059.3 Ų59.30%032%0.319CS..Hα-helixtrans-65.2-42.3-179.700000111.7A191 C192 A198 F199 L224 L228 W231A191-A195 WeakPolarHBondContact O-CB 3.43Å; A191-A195 PolarHBondContact O-N 3.46Å; C192-A195 PolarHBondContact O-N 3.27Å; A195-A198 PolarHBondContact O-N 3.48Å; A195-F199 WeakPolarHBondContact O-CB 3.31Å; A195-F199 PolarHBondContact O-N 2.95Å; A195-L224 HydrophobicContact CB-CD2 3.87Å; A195-L228 HydrophobicContact CB-CD1 4.36Å; A195-L228 HydrophobicContact CB-CD2 3.82Å; A195-L228 HydrophobicContact CB-CG 3.92Å; A195-W231 HydrophobicContact CB-CZ3 4.29Å
196K97.9Very high97Very high121 Ų12158.5 Ų58.553%0.52632%0.316SS..Hα-helixtrans-64.5-47.9177.4-179.7171.5178173.20111.3C192 A198 F199 D200 L228C192-K196 WeakPolarHBondContact O-CB 3.47Å; C192-K196 PolarHBondContact O-N 3.37Å; K196-A198 VanDerWaalsContact C-N 3.33Å; K196-A198 PolarHBondContact O-N 3.46Å; K196-F199 PolarHBondContact O-N 3.03Å; K196-D200 WeakPolarHBondContact CE-OD2 3.25Å; K196-D200 WeakPolarHBondContact CG-OD2 3.28Å; K196-D200 WeakPolarHBondContact O-CB 3.47Å; K196-D200 VanDerWaalsContact O-CG 3.26Å; K196-D200 PolarHBondContact O-N 3.02Å; K196-L228 HydrophobicContact CB-CD1 4.11Å; K196-L228 HydrophobicContact CB-CD2 4.03Å
197Q98.3Very high96.8Very high64 Ų6460.2 Ų60.230%0.29932%0.324SS..Hα-helixtrans-58.7-45.8177.6-177.2-179-15.700111.4H193 F199 D200 D201H193-Q197 VanDerWaalsContact O-CB 3.3Å; H193-Q197 WeakPolarHBondContact O-CB 3.28Å; H193-Q197 PolarHBondContact O-N 3.33Å; Q197-F199 VanDerWaalsContact C-N 3.32Å; Q197-F199 PolarHBondContact O-N 3.38Å; Q197-D200 PolarHBondContact O-N 3.47Å; Q197-D201 VanDerWaalsContact O-CB 3.28Å; Q197-D201 WeakPolarHBondContact O-CB 3.43Å; Q197-D201 PolarHBondContact O-N 2.9Å
198A98.2Very high96.3Very high16 Ų1663 Ų6313%0.13234%0.341CS..Hα-helixtrans-63.8-37.7178.800000112.8A174 L194 A195 K196 A202 L224A174-A198 HydrophobicContact CB-CB 3.39Å; L194-A198 WeakPolarHBondContact O-CB 3.37Å; L194-A198 PolarHBondContact O-N 3.49Å; A195-A198 PolarHBondContact O-N 3.48Å; K196-A198 VanDerWaalsContact C-N 3.33Å; K196-A198 PolarHBondContact O-N 3.46Å; A198-A202 VanDerWaalsContact O-CB 3.28Å; A198-A202 WeakPolarHBondContact O-CB 3.36Å; A198-A202 PolarHBondContact O-N 3.15Å; A198-L224 HydrophobicContact CB-CD1 4.3Å
199F97.9Very high95.8Very high41 Ų4162.4 Ų62.418%0.1834%0.335CS..Hα-helixtrans-66.2-49.7175.3-175.2-90.9000111.4A195 K196 Q197 A202 I203 M221 L224 R225A195-F199 WeakPolarHBondContact O-CB 3.31Å; A195-F199 PolarHBondContact O-N 2.95Å; K196-F199 PolarHBondContact O-N 3.03Å; Q197-F199 VanDerWaalsContact C-N 3.32Å; Q197-F199 PolarHBondContact O-N 3.38Å; F199-A202 PolarHBondContact O-N 3.31Å; F199-I203 HydrophobicContact CD1-CG1 3.88Å; F199-I203 HydrophobicContact CE1-CD1 4.06Å; F199-I203 HydrophobicContact CE1-CG1 3.53Å; F199-I203 HydrophobicContact CE2-CG1 4.46Å; F199-I203 HydrophobicContact CG-CG1 4.48Å; F199-I203 HydrophobicContact CZ-CD1 3.91Å; F199-I203 HydrophobicContact CZ-CG1 3.85Å; F199-I203 WeakPolarHBondContact O-CB 3.35Å; F199-I203 VanDerWaalsContact O-CG1 3.3Å; F199-I203 WeakPolarHBondContact O-CG1 3.41Å; F199-I203 PolarHBondContact O-N 2.81Å; F199-M221 HydrophobicContact CD2-CB 4.12Å; F199-M221 WeakPolarHBondContact CD2-O 3.33Å; F199-M221 HydrophobicContact CE2-CB 4.08Å; F199-M221 WeakPolarHBondContact CE2-O 3.37Å; F199-L224 HydrophobicContact CD2-CB 4.48Å; F199-R225 HydrophobicContact CD2-CB 4.35Å; F199-R225 HydrophobicContact CE2-CB 3.96Å; F199-R225 HydrophobicContact CZ-CB 4.48Å
200D97.9Very high95.4Very high77 Ų7762.8 Ų62.841%0.41233%0.326SS..Hα-helixtrans-63.9-44.9-178.6-67.6-15.5000111.3K196 Q197 A202 I203 A204K196-D200 WeakPolarHBondContact CE-OD2 3.25Å; K196-D200 WeakPolarHBondContact CG-OD2 3.28Å; K196-D200 WeakPolarHBondContact O-CB 3.47Å; K196-D200 VanDerWaalsContact O-CG 3.26Å; K196-D200 PolarHBondContact O-N 3.02Å; Q197-D200 PolarHBondContact O-N 3.47Å; D200-A202 VanDerWaalsContact C-N 3.3Å; D200-A202 PolarHBondContact O-N 3.44Å; D200-I203 PolarHBondContact O-N 3.21Å; D200-A204 PolarHBondContact O-N 3.02Å
201D97.5Very high94.9Very high54 Ų5465 Ų6529%0.28934%0.342SS..Hα-helixtrans-59.8-40.1176.1-70.9-9.7000111.1P165 R170 Q197P165-D201 HydrophobicContact CB-CB 3.88Å; P165-D201 WeakPolarHBondContact CB-O 3.46Å; P165-D201 HydrophobicContact CG-CB 4.32Å; R170-D201 IonicContact NH2-OD2 2.69Å; Q197-D201 VanDerWaalsContact O-CB 3.28Å; Q197-D201 WeakPolarHBondContact O-CB 3.43Å; Q197-D201 PolarHBondContact O-N 2.9Å
202A96.9Very high94.4Very high0 Ų072 Ų720%038%0.38CS..Hα-helixtrans-76.6-35.3179.900000113.2T166 L171 A198 F199 D200 A204 E205 L206 M221T166-A202 HydrophobicContact CG2-CB 4.38Å; T166-A202 WeakPolarHBondContact CG2-O 3.42Å; L171-A202 HydrophobicContact CD2-CB 3.73Å; A198-A202 VanDerWaalsContact O-CB 3.28Å; A198-A202 WeakPolarHBondContact O-CB 3.36Å; A198-A202 PolarHBondContact O-N 3.15Å; F199-A202 PolarHBondContact O-N 3.31Å; D200-A202 VanDerWaalsContact C-N 3.3Å; D200-A202 PolarHBondContact O-N 3.44Å; A202-A204 VanDerWaalsContact C-N 3.31Å; A202-E205 CarbonylContact O-C 3.57Å; A202-E205 PolarHBondContact O-N 3.43Å; A202-L206 WeakPolarHBondContact O-CA 3.37Å; A202-L206 PolarHBondContact O-N 3.33Å; A202-M221 HydrophobicContact CB-CE 3.83Å; A202-M221 HydrophobicContact CB-CG 4.35Å; A202-M221 HydrophobicContact CB-SD 3.97Å
203I96.3Very high94Very high83 Ų8372.6 Ų72.643%0.42638%0.384SS..Hα-helixtrans-61.3-42.2172.6-74.4-70.2000110.6F199 D200 E205 L206 M221F199-I203 HydrophobicContact CD1-CG1 3.88Å; F199-I203 HydrophobicContact CE1-CD1 4.06Å; F199-I203 HydrophobicContact CE1-CG1 3.53Å; F199-I203 HydrophobicContact CE2-CG1 4.46Å; F199-I203 HydrophobicContact CG-CG1 4.48Å; F199-I203 HydrophobicContact CZ-CD1 3.91Å; F199-I203 HydrophobicContact CZ-CG1 3.85Å; F199-I203 WeakPolarHBondContact O-CB 3.35Å; F199-I203 VanDerWaalsContact O-CG1 3.3Å; F199-I203 WeakPolarHBondContact O-CG1 3.41Å; F199-I203 PolarHBondContact O-N 2.81Å; D200-I203 PolarHBondContact O-N 3.21Å; I203-E205 PolarHBondContact O-N 2.93Å; I203-L206 HydrophobicContact CD1-CD2 4.43Å; I203-L206 PolarHBondContact O-N 2.96Å; I203-M221 HydrophobicContact CB-CE 4.44Å; I203-M221 HydrophobicContact CD1-CE 3.43Å; I203-M221 VanDerWaalsContact CD1-CE 3.43Å; I203-M221 HydrophobicContact CG1-CE 3.6Å
204A96.4Very high93.7Very high86 Ų8672.2 Ų72.271%0.71138%0.379SS*.Hα-helixtrans-62.5-25.2-179.700000113.6D200 A202D200-A204 PolarHBondContact O-N 3.02Å; A202-A204 VanDerWaalsContact C-N 3.31Å
205E95.3Very high93.5Very high75 Ų7579.2 Ų79.235%0.3541%0.408SS..THydrogen-bonded Turntrans-114.110.3-179.2-67.4-171.2-150.500113.2P165 T166 A202 I203 D207 T208P165-E205 VanDerWaalsContact CD-OE2 3.31Å; P165-E205 WeakPolarHBondContact CD-OE2 3.16Å; P165-E205 WeakPolarHBondContact CG-OE1 3.21Å; T166-E205 HydrophobicContact CG2-CB 3.97Å; T166-E205 WeakPolarHBondContact CG2-O 3.2Å; A202-E205 CarbonylContact O-C 3.57Å; A202-E205 PolarHBondContact O-N 3.43Å; I203-E205 PolarHBondContact O-N 2.93Å; E205-D207 VanDerWaalsContact C-N 3.25Å; E205-D207 PolarHBondContact O-N 2.92Å; E205-T208 WeakPolarHBondContact O-CB 3.47Å; E205-T208 PolarHBondContact O-N 2.74Å; E205-T208 PolarHBondContact O-OG1 2.79Å
206L92Very high93.3Very high38 Ų3883.5 Ų83.520%0.19943%0.431CS..G310 helixtrans-59.9-35.6-172.4-171.763.2000112.7A202 I203 T208 L209 T218 M221A202-L206 WeakPolarHBondContact O-CA 3.37Å; A202-L206 PolarHBondContact O-N 3.33Å; I203-L206 HydrophobicContact CD1-CD2 4.43Å; I203-L206 PolarHBondContact O-N 2.96Å; L206-T208 PolarHBondContact O-N 2.86Å; L206-T208 VanDerWaalsContact O-N 3.13Å; L206-L209 HydrophobicContact CD1-CD2 4.01Å; L206-L209 WeakPolarHBondContact O-CB 3.39Å; L206-L209 PolarHBondContact O-N 2.86Å; L206-L209 VanDerWaalsContact O-N 3.12Å; L206-T218 HydrophobicContact CD1-CG2 4.28Å; L206-M221 HydrophobicContact CD1-CE 4.31Å; L206-M221 HydrophobicContact CD1-SD 4Å
207D90.5Very high93.2Very high168 Ų16877.7 Ų77.790%0.89841%0.406SS*.G310 helixtrans-64.8-14.8178.6-65.8-25.1000113.5E205E205-D207 VanDerWaalsContact C-N 3.25Å; E205-D207 PolarHBondContact O-N 2.92Å
208T87.2Confident93.1Very high84 Ų8476.7 Ų76.752%0.51540%0.404SS..G310 helixtrans-88.8-6.9178.472.20000113.4E205 L206E205-T208 WeakPolarHBondContact O-CB 3.47Å; E205-T208 PolarHBondContact O-N 2.74Å; E205-T208 PolarHBondContact O-OG1 2.79Å; L206-T208 PolarHBondContact O-N 2.86Å; L206-T208 VanDerWaalsContact O-N 3.13Å
209L87.6Confident93.1Very high24 Ų2480.9 Ų80.913%0.12642%0.424CS..  trans-74.5132.6-171.6-168.856.6000111.5L206 Y214L206-L209 HydrophobicContact CD1-CD2 4.01Å; L206-L209 WeakPolarHBondContact O-CB 3.39Å; L206-L209 PolarHBondContact O-N 2.86Å; L206-L209 VanDerWaalsContact O-N 3.12Å; L209-Y214 HydrophobicContact CB-CD2 4.49Å; L209-Y214 HydrophobicContact CD2-CD2 4.01Å; L209-Y214 HydrophobicContact CG-CD2 4.4Å
210N87Confident93.1Very high88 Ų8880.3 Ų80.347%0.47142%0.422SS..  trans-73.2157.2174.763.142.5000112.2D212 S213 Y214N210-D212 VanDerWaalsContact C-N 3.27Å; N210-D212 PolarHBondContact O-N 3.31Å; N210-D212 PolarHBondContact OD1-N 3.39Å; N210-S213 PolarHBondContact O-N 2.85Å; N210-S213 VanDerWaalsContact OD1-CB 3.22Å; N210-S213 WeakPolarHBondContact OD1-CB 3.28Å; N210-S213 PolarHBondContact OD1-N 3.27Å; N210-S213 PolarHBondContact OD1-OG 3.18Å; N210-Y214 WeakPolarHBondContact O-CB 3.21Å; N210-Y214 PolarHBondContact O-N 3.42Å; N210-Y214 VanDerWaalsContact O-N 3.08Å
211E86.1Confident93.1Very high184 Ų18477 Ų7786%0.8640%0.404SS*.Hα-helixtrans-58.5-37.8-178.7-67.8-175.1173.600112.6S213 Y214E211-S213 VanDerWaalsContact C-N 3.34Å; E211-S213 PolarHBondContact O-N 3.13Å; E211-Y214 PolarHBondContact O-N 3.13Å
212D86.7Confident93.1Very high149 Ų14977.3 Ų77.380%0.79740%0.404SS*.Hα-helixtrans-63.1-36.7-177.6-66.4-27.8000112.9N210N210-D212 VanDerWaalsContact C-N 3.27Å; N210-D212 PolarHBondContact O-N 3.31Å; N210-D212 PolarHBondContact OD1-N 3.39Å
213S89.9Confident93.2Very high30 Ų3081 Ų8121%0.2142%0.423CS..Hα-helixtrans-97-9.9-178.6-55.30000113.1N210 E211 K215 D216 S217N210-S213 PolarHBondContact O-N 2.85Å; N210-S213 VanDerWaalsContact OD1-CB 3.22Å; N210-S213 WeakPolarHBondContact OD1-CB 3.28Å; N210-S213 PolarHBondContact OD1-N 3.27Å; N210-S213 PolarHBondContact OD1-OG 3.18Å; E211-S213 VanDerWaalsContact C-N 3.34Å; E211-S213 PolarHBondContact O-N 3.13Å; S213-K215 PolarHBondContact O-N 3.18Å; S213-D216 PolarHBondContact O-N 2.86Å; S213-S217 WeakPolarHBondContact O-CB 3.3Å; S213-S217 PolarHBondContact O-N 3.41Å; S213-S217 PolarHBondContact O-OG 3.14Å
214Y91.3Very high93.3Very high119 Ų11977 Ų7747%0.46740%0.403SS..Hα-helixtrans-57.5-49.6-172.7-172-91.9000112.2L209 N210 E211 T218L209-Y214 HydrophobicContact CB-CD2 4.49Å; L209-Y214 HydrophobicContact CD2-CD2 4.01Å; L209-Y214 HydrophobicContact CG-CD2 4.4Å; N210-Y214 WeakPolarHBondContact O-CB 3.21Å; N210-Y214 PolarHBondContact O-N 3.42Å; N210-Y214 VanDerWaalsContact O-N 3.08Å; E211-Y214 PolarHBondContact O-N 3.13Å; Y214-T218 HydrophobicContact CD1-CG2 4.23Å; Y214-T218 HydrophobicContact CD2-CG2 4.49Å; Y214-T218 HydrophobicContact CE1-CG2 3.92Å; Y214-T218 HydrophobicContact CE2-CG2 4.2Å; Y214-T218 WeakPolarHBondContact O-CB 3.41Å; Y214-T218 VanDerWaalsContact O-CG2 3.29Å; Y214-T218 WeakPolarHBondContact O-CG2 3.39Å; Y214-T218 PolarHBondContact O-N 3.42Å; Y214-T218 PolarHBondContact O-OG1 2.93Å
215K93.9Very high93.3Very high162 Ų16278.5 Ų78.570%0.70439%0.39SS*.Hα-helixtrans-63-46.2-177.9-176-179175.2-174.70112.4S213 T218 L219S213-K215 PolarHBondContact O-N 3.18Å; K215-T218 PolarHBondContact O-OG1 2.71Å; K215-L219 WeakPolarHBondContact O-CB 3.35Å; K215-L219 PolarHBondContact O-N 3.48Å; K215-L219 VanDerWaalsContact O-N 3.12Å
216D94.7Very high93.4Very high90 Ų9078.2 Ų78.248%0.48139%0.391SS..Hα-helixtrans-69.7-42.4-177.2-72.5-12.4000111.4P168 S213 L219 I220P168-D216 HydrophobicContact CB-CB 4.15Å; P168-D216 HydrophobicContact CG-CB 4.1Å; S213-D216 PolarHBondContact O-N 2.86Å; D216-L219 PolarHBondContact O-N 3.12Å; D216-I220 WeakPolarHBondContact O-CD1 3.27Å; D216-I220 VanDerWaalsContact O-CG1 3.25Å; D216-I220 WeakPolarHBondContact O-CG1 3.36Å; D216-I220 PolarHBondContact O-N 3.11Å; D216-I220 VanDerWaalsContact O-N 3.1Å
217S96.3Very high93.7Very high0 Ų078.1 Ų78.10%039%0.391CS..Hα-helixtrans-66.2-47.1-179.3-49.20000111.4T166 P168 S213 L219 I220 M221T166-S217 WeakPolarHBondContact O-CB 3.28Å; T166-S217 PolarHBondContact O-OG 3.49Å; P168-S217 WeakPolarHBondContact CD-OG 3.42Å; P168-S217 WeakPolarHBondContact CG-OG 3.48Å; S213-S217 WeakPolarHBondContact O-CB 3.3Å; S213-S217 PolarHBondContact O-N 3.41Å; S213-S217 PolarHBondContact O-OG 3.14Å; S217-L219 VanDerWaalsContact C-N 3.33Å; S217-L219 PolarHBondContact O-N 3.1Å; S217-I220 PolarHBondContact O-N 2.91Å; S217-I220 VanDerWaalsContact O-N 3.13Å; S217-M221 VanDerWaalsContact O-CG 3.27Å; S217-M221 WeakPolarHBondContact O-CG 3.36Å; S217-M221 PolarHBondContact O-N 3.27Å
218T96.4Very high93.9Very high42 Ų4271.4 Ų71.426%0.25836%0.355SS..Hα-helixtrans-64.2-37179.352.30000112.2L206 Y214 K215 I220 M221 Q222L206-T218 HydrophobicContact CD1-CG2 4.28Å; Y214-T218 HydrophobicContact CD1-CG2 4.23Å; Y214-T218 HydrophobicContact CD2-CG2 4.49Å; Y214-T218 HydrophobicContact CE1-CG2 3.92Å; Y214-T218 HydrophobicContact CE2-CG2 4.2Å; Y214-T218 WeakPolarHBondContact O-CB 3.41Å; Y214-T218 VanDerWaalsContact O-CG2 3.29Å; Y214-T218 WeakPolarHBondContact O-CG2 3.39Å; Y214-T218 PolarHBondContact O-N 3.42Å; Y214-T218 PolarHBondContact O-OG1 2.93Å; K215-T218 PolarHBondContact O-OG1 2.71Å; T218-I220 PolarHBondContact O-N 3.14Å; T218-M221 PolarHBondContact O-N 3.02Å; T218-Q222 WeakPolarHBondContact O-CB 3.22Å; T218-Q222 PolarHBondContact O-N 2.77Å
219L97.3Very high94.3Very high104 Ų10471.5 Ų71.555%0.54536%0.355SS..Hα-helixtrans-61.1-42.8172.2179.162.3000111.8K215 D216 S217 Q222 L223K215-L219 WeakPolarHBondContact O-CB 3.35Å; K215-L219 PolarHBondContact O-N 3.48Å; K215-L219 VanDerWaalsContact O-N 3.12Å; D216-L219 PolarHBondContact O-N 3.12Å; S217-L219 VanDerWaalsContact C-N 3.33Å; S217-L219 PolarHBondContact O-N 3.1Å; L219-Q222 WeakPolarHBondContact O-CB 3.29Å; L219-Q222 PolarHBondContact O-N 3.43Å; L219-L223 WeakPolarHBondContact O-CG 3.31Å; L219-L223 PolarHBondContact O-N 3.2Å; L219-L223 VanDerWaalsContact O-N 3.14Å
220I98Very high94.7Very high29 Ų2974.8 Ų74.815%0.14937%0.373CS..Hα-helixtrans-70.5-39.6178.7-61.6163.7000111.3P168 L171 L175 D216 S217 T218 Q222 L223 L224P168-I220 HydrophobicContact CB-CD1 4.14Å; P168-I220 VanDerWaalsContact O-CD1 3.31Å; P168-I220 WeakPolarHBondContact O-CD1 3.46Å; L171-I220 HydrophobicContact CB-CB 4.16Å; L171-I220 HydrophobicContact CB-CD1 4.46Å; L171-I220 HydrophobicContact CB-CG2 3.62Å; L175-I220 HydrophobicContact CB-CG2 4.3Å; L175-I220 HydrophobicContact CD2-CG2 4.18Å; D216-I220 WeakPolarHBondContact O-CD1 3.27Å; D216-I220 VanDerWaalsContact O-CG1 3.25Å; D216-I220 WeakPolarHBondContact O-CG1 3.36Å; D216-I220 PolarHBondContact O-N 3.11Å; D216-I220 VanDerWaalsContact O-N 3.1Å; S217-I220 PolarHBondContact O-N 2.91Å; S217-I220 VanDerWaalsContact O-N 3.13Å; T218-I220 PolarHBondContact O-N 3.14Å; I220-Q222 VanDerWaalsContact C-N 3.27Å; I220-Q222 PolarHBondContact O-N 3.17Å; I220-L223 WeakPolarHBondContact O-CB 3.38Å; I220-L223 PolarHBondContact O-N 3.36Å; I220-L224 PolarHBondContact O-N 3.4Å
221M97.9Very high95Very high7 Ų770.9 Ų70.93%0.03435%0.351CS..Hα-helixtrans-60.6-38.9174.3-69.6169.872.900111.6L171 F199 A202 I203 L206 S217 T218 L224 R225L171-M221 HydrophobicContact CD1-CG 3.87Å; L171-M221 HydrophobicContact CD1-SD 4.32Å; L171-M221 HydrophobicContact CD2-CG 4.03Å; F199-M221 HydrophobicContact CD2-CB 4.12Å; F199-M221 WeakPolarHBondContact CD2-O 3.33Å; F199-M221 HydrophobicContact CE2-CB 4.08Å; F199-M221 WeakPolarHBondContact CE2-O 3.37Å; A202-M221 HydrophobicContact CB-CE 3.83Å; A202-M221 HydrophobicContact CB-CG 4.35Å; A202-M221 HydrophobicContact CB-SD 3.97Å; I203-M221 HydrophobicContact CB-CE 4.44Å; I203-M221 HydrophobicContact CD1-CE 3.43Å; I203-M221 VanDerWaalsContact CD1-CE 3.43Å; I203-M221 HydrophobicContact CG1-CE 3.6Å; L206-M221 HydrophobicContact CD1-CE 4.31Å; L206-M221 HydrophobicContact CD1-SD 4Å; S217-M221 VanDerWaalsContact O-CG 3.27Å; S217-M221 WeakPolarHBondContact O-CG 3.36Å; S217-M221 PolarHBondContact O-N 3.27Å; T218-M221 PolarHBondContact O-N 3.02Å; M221-L224 WeakPolarHBondContact O-CB 3.49Å; M221-L224 PolarHBondContact O-N 2.84Å; M221-R225 PolarHBondContact O-N 3.17Å
222Q98Very high95.2Very high62 Ų6265 Ų6529%0.2933%0.328SS..Hα-helixtrans-59.9-47.4173.1177.855.142.600111.3T218 L219 I220 L224 R225 D226T218-Q222 WeakPolarHBondContact O-CB 3.22Å; T218-Q222 PolarHBondContact O-N 2.77Å; L219-Q222 WeakPolarHBondContact O-CB 3.29Å; L219-Q222 PolarHBondContact O-N 3.43Å; I220-Q222 VanDerWaalsContact C-N 3.27Å; I220-Q222 PolarHBondContact O-N 3.17Å; Q222-L224 VanDerWaalsContact C-N 3.35Å; Q222-L224 PolarHBondContact O-N 3.45Å; Q222-R225 WeakPolarHBondContact O-CB 3.48Å; Q222-R225 PolarHBondContact O-N 2.97Å; Q222-D226 PolarHBondContact NE2-OD1 3.26Å; Q222-D226 PolarHBondContact NE2-OD2 3.41Å; Q222-D226 PolarHBondContact O-N 2.86Å
223L98.3Very high95.2Very high77 Ų7760.9 Ų60.940%0.40331%0.311SS..Hα-helixtrans-62.2-38.7176.3-66.1172.1000112.9L175 L219 I220 D226 N227L175-L223 HydrophobicContact CD1-CB 4.14Å; L175-L223 HydrophobicContact CD2-CB 3.95Å; L175-L223 HydrophobicContact CD2-CD1 3.93Å; L219-L223 WeakPolarHBondContact O-CG 3.31Å; L219-L223 PolarHBondContact O-N 3.2Å; L219-L223 VanDerWaalsContact O-N 3.14Å; I220-L223 WeakPolarHBondContact O-CB 3.38Å; I220-L223 PolarHBondContact O-N 3.36Å; L223-D226 PolarHBondContact O-N 3.4Å; L223-N227 PolarHBondContact O-N 2.88Å
224L98.3Very high94.7Very high0 Ų062.9 Ų62.90%032%0.319CS..Hα-helixtrans-60.4-45.5174.1-78.4167.9000111.4L171 L175 A195 A198 F199 I220 M221 Q222 N227 L228L171-L224 HydrophobicContact CD2-CD1 3.98Å; L175-L224 HydrophobicContact CB-CD2 3.91Å; L175-L224 HydrophobicContact CB-CG 4.25Å; L175-L224 HydrophobicContact CD1-CD2 3.96Å; L175-L224 HydrophobicContact CD1-CG 4.2Å; A195-L224 HydrophobicContact CB-CD2 3.87Å; A198-L224 HydrophobicContact CB-CD1 4.3Å; F199-L224 HydrophobicContact CD2-CB 4.48Å; I220-L224 PolarHBondContact O-N 3.4Å; M221-L224 WeakPolarHBondContact O-CB 3.49Å; M221-L224 PolarHBondContact O-N 2.84Å; Q222-L224 VanDerWaalsContact C-N 3.35Å; Q222-L224 PolarHBondContact O-N 3.45Å; L224-N227 PolarHBondContact O-N 2.91Å; L224-L228 WeakPolarHBondContact O-CG 3.49Å; L224-L228 PolarHBondContact O-N 3Å
225R97.5Very high93.7Very high116 Ų11659.9 Ų59.944%0.43831%0.313SS..Hα-helixtrans-63.5-41.5177.6-170.5-172.674.4-165.74.1112.2F199 M221 Q222 L228 T229F199-R225 HydrophobicContact CD2-CB 4.35Å; F199-R225 HydrophobicContact CE2-CB 3.96Å; F199-R225 HydrophobicContact CZ-CB 4.48Å; M221-R225 PolarHBondContact O-N 3.17Å; Q222-R225 WeakPolarHBondContact O-CB 3.48Å; Q222-R225 PolarHBondContact O-N 2.97Å; R225-L228 WeakPolarHBondContact O-CB 3.38Å; R225-L228 PolarHBondContact O-N 2.99Å; R225-T229 PolarHBondContact O-N 3.41Å; R225-T229 PolarHBondContact O-OG1 3.18Å
226D97.7Very high92.2Very high70 Ų7058.8 Ų58.837%0.37431%0.311SS..Hα-helixtrans-65.9-42.1-179.8-64.7-16.1000110.9Q222 L223 T229 L230Q222-D226 PolarHBondContact NE2-OD1 3.26Å; Q222-D226 PolarHBondContact NE2-OD2 3.41Å; Q222-D226 PolarHBondContact O-N 2.86Å; L223-D226 PolarHBondContact O-N 3.4Å; D226-T229 PolarHBondContact O-N 2.88Å; D226-L230 PolarHBondContact O-N 3.3Å
227N96.5Very high90.3Very high36 Ų3657 Ų5719%0.19331%0.314CS..Hα-helixtrans-61.5-44.2172.6-78.6-0.6000112.6L175 L223 L224 T229 L230 W231L175-N227 VanDerWaalsContact CD1-ND2 3.28Å; L175-N227 WeakPolarHBondContact CD1-ND2 3.5Å; L223-N227 PolarHBondContact O-N 2.88Å; L224-N227 PolarHBondContact O-N 2.91Å; N227-T229 VanDerWaalsContact C-N 3.26Å; N227-T229 PolarHBondContact O-N 2.7Å; N227-L230 PolarHBondContact O-N 3.42Å; N227-W231 HydrophobicContact CB-CD2 4.21Å; N227-W231 HydrophobicContact CB-CE3 4.09Å; N227-W231 HydrophobicContact CB-CH2 3.68Å; N227-W231 HydrophobicContact CB-CZ2 3.79Å; N227-W231 HydrophobicContact CB-CZ3 3.83Å; N227-W231 WeakPolarHBondContact O-CB 3.49Å; N227-W231 VanDerWaalsContact O-CD2 3.24Å; N227-W231 PolarHBondContact O-N 2.71Å
228L96.4Very high88.1Confident26 Ų2664.3 Ų64.314%0.13635%0.353CS..Hα-helixtrans-58.4-41.1175.7-76.5168.1000111.9C192 A195 K196 L224 R225 T232C192-L228 HydrophobicContact CB-CD2 4.09Å; C192-L228 WeakPolarHBondContact O-CD2 3.22Å; A195-L228 HydrophobicContact CB-CD1 4.36Å; A195-L228 HydrophobicContact CB-CD2 3.82Å; A195-L228 HydrophobicContact CB-CG 3.92Å; K196-L228 HydrophobicContact CB-CD1 4.11Å; K196-L228 HydrophobicContact CB-CD2 4.03Å; L224-L228 WeakPolarHBondContact O-CG 3.49Å; L224-L228 PolarHBondContact O-N 3Å; R225-L228 WeakPolarHBondContact O-CB 3.38Å; R225-L228 PolarHBondContact O-N 2.99Å; L228-T232 WeakPolarHBondContact O-CB 3.47Å; L228-T232 WeakPolarHBondContact O-CG2 3.21Å; L228-T232 PolarHBondContact O-N 3.04Å; L228-T232 PolarHBondContact O-OG1 3.41Å
229T95.6Very high85.6Confident86 Ų8669.8 Ų69.853%0.52838%0.375SS..Hα-helixtrans-64-48.3179-55.80000110.3R225 D226 N227 T232 S233R225-T229 PolarHBondContact O-N 3.41Å; R225-T229 PolarHBondContact O-OG1 3.18Å; D226-T229 PolarHBondContact O-N 2.88Å; N227-T229 VanDerWaalsContact C-N 3.26Å; N227-T229 PolarHBondContact O-N 2.7Å; T229-T232 PolarHBondContact O-OG1 3.36Å; T229-S233 PolarHBondContact O-N 3.38Å; T229-S233 VanDerWaalsContact O-N 3.16Å; T229-S233 PolarHBondContact O-OG 3.32Å
230L94.4Very high82.9Confident93 Ų9368.1 Ų68.149%0.48738%0.377SS..Hα-helixtrans-60.2-48.9178.3-17966.3000112.5D226 N227 T232 S233 D234D226-L230 PolarHBondContact O-N 3.3Å; N227-L230 PolarHBondContact O-N 3.42Å; L230-T232 PolarHBondContact O-N 3.38Å; L230-S233 PolarHBondContact O-N 3.18Å; L230-S233 PolarHBondContact O-OG 2.99Å; L230-D234 VanDerWaalsContact O-CG 3.32Å; L230-D234 PolarHBondContact O-N 3.22Å; L230-D234 VanDerWaalsContact O-N 3.14Å
231W94.8Very high79.8Confident7 Ų775.7 Ų75.73%0.02741%0.412CS..Hα-helixtrans-74.1-30.6-174.3-58.5-25.6000112.9S178 V179 Y182 A191 A195 N227 D234 T235S178-W231 WeakPolarHBondContact OG-CH2 3Å; V179-W231 HydrophobicContact CG2-CH2 3.98Å; V179-W231 HydrophobicContact CG2-CZ2 3.98Å; Y182-W231 AromaticContact CD1-CD1 3.81Å; Y182-W231 AromaticContact CD1-CE2 3.92Å; Y182-W231 HydrophobicContact CD1-CZ2 4.44Å; Y182-W231 AromaticContact CD1-NE1 3.39Å; Y182-W231 HydrophobicContact CD2-CB 4.09Å; Y182-W231 AromaticContact CD2-CD1 3.57Å; Y182-W231 AromaticContact CD2-CD2 3.71Å; Y182-W231 HydrophobicContact CD2-CD2 3.71Å; Y182-W231 AromaticContact CD2-CE2 3.85Å; Y182-W231 HydrophobicContact CD2-CE3 4.42Å; Y182-W231 AromaticContact CD2-CG 3.53Å; Y182-W231 HydrophobicContact CD2-CG 3.53Å; Y182-W231 AromaticContact CD2-NE1 3.75Å; Y182-W231 AromaticContact CE1-CD1 3.48Å; Y182-W231 VanDerWaalsContact CE1-CD1 3.48Å; Y182-W231 HydrophobicContact CE1-CG 4.38Å; Y182-W231 AromaticContact CE1-NE1 3.46Å; Y182-W231 HydrophobicContact CE2-CB 3.68Å; Y182-W231 AromaticContact CE2-CD1 3.26Å; Y182-W231 HydrophobicContact CE2-CD2 4.1Å; Y182-W231 AromaticContact CE2-CG 3.4Å; Y182-W231 HydrophobicContact CE2-CG 3.4Å; Y182-W231 AromaticContact CE2-NE1 3.85Å; Y182-W231 AromaticContact CG-CD1 3.85Å; Y182-W231 AromaticContact CG-CD2 3.99Å; Y182-W231 HydrophobicContact CG-CD2 3.99Å; Y182-W231 AromaticContact CG-CE2 3.62Å; Y182-W231 HydrophobicContact CG-CG 4.12Å; Y182-W231 HydrophobicContact CG-CZ2 4.1Å; Y182-W231 AromaticContact CG-NE1 3.53Å; Y182-W231 AromaticContact CZ-CD1 3.2Å; Y182-W231 AromaticContact CZ-CG 3.85Å; Y182-W231 AromaticContact CZ-NE1 3.7Å; A191-W231 HydrophobicContact CB-CE3 4.09Å; A191-W231 HydrophobicContact CB-CZ3 3.98Å; A195-W231 HydrophobicContact CB-CZ3 4.29Å; N227-W231 HydrophobicContact CB-CD2 4.21Å; N227-W231 HydrophobicContact CB-CE3 4.09Å; N227-W231 HydrophobicContact CB-CH2 3.68Å; N227-W231 HydrophobicContact CB-CZ2 3.79Å; N227-W231 HydrophobicContact CB-CZ3 3.83Å; N227-W231 WeakPolarHBondContact O-CB 3.49Å; N227-W231 VanDerWaalsContact O-CD2 3.24Å; N227-W231 PolarHBondContact O-N 2.71Å; W231-D234 PolarHBondContact O-N 3.03Å; W231-T235 PolarHBondContact O-N 3.34Å; W231-T235 PolarHBondContact O-OG1 3.12Å
232T90.2Very high76.9Confident61 Ų6181 Ų8137%0.37445%0.447SS..Hα-helixtrans-72.8-33.117553.50000112.3L228 T229 L230 T235 Q236L228-T232 WeakPolarHBondContact O-CB 3.47Å; L228-T232 WeakPolarHBondContact O-CG2 3.21Å; L228-T232 PolarHBondContact O-N 3.04Å; L228-T232 PolarHBondContact O-OG1 3.41Å; T229-T232 PolarHBondContact O-OG1 3.36Å; L230-T232 PolarHBondContact O-N 3.38Å; T232-T235 PolarHBondContact O-N 3.49Å; T232-Q236 WeakPolarHBondContact O-CG 3.41Å; T232-Q236 PolarHBondContact O-N 2.65Å
233S86Confident74Confident61 Ų6186.5 Ų86.543%0.42747%0.472SS..Hα-helixtrans-66.6-39.6170.952.70000112.5T229 L230 T235 Q236 G237T229-S233 PolarHBondContact O-N 3.38Å; T229-S233 VanDerWaalsContact O-N 3.16Å; T229-S233 PolarHBondContact O-OG 3.32Å; L230-S233 PolarHBondContact O-N 3.18Å; L230-S233 PolarHBondContact O-OG 2.99Å; S233-T235 VanDerWaalsContact C-N 3.29Å; S233-T235 PolarHBondContact O-N 3.29Å; S233-Q236 PolarHBondContact O-N 3.13Å; S233-G237 PolarHBondContact O-N 2.99Å; S233-G237 VanDerWaalsContact O-N 3.15Å
234D78.3Confident71.1Confident72 Ų7291.7 Ų91.739%0.38549%0.494SS..Hα-helixtrans-63-38.3178.2-69.4-4.8000111Y182 L230 W231 G237Y182-D234 PolarHBondContact OH-OD2 3.08Å; L230-D234 VanDerWaalsContact O-CG 3.32Å; L230-D234 PolarHBondContact O-N 3.22Å; L230-D234 VanDerWaalsContact O-N 3.14Å; W231-D234 PolarHBondContact O-N 3.03Å; D234-G237 PolarHBondContact O-N 3.29Å
235T71Confident68.2Low56 Ų5695.7 Ų95.734%0.34454%0.536SS..Hα-helixtrans-72.9-32-179.8-32.70000112.8W231 T232 S233W231-T235 PolarHBondContact O-N 3.34Å; W231-T235 PolarHBondContact O-OG1 3.12Å; T232-T235 PolarHBondContact O-N 3.49Å; S233-T235 VanDerWaalsContact C-N 3.29Å; S233-T235 PolarHBondContact O-N 3.29Å
236Q61.7Low65.4Low140 Ų14093.6 Ų93.665%0.65455%0.551SS**Hα-helixtrans-76.3-26.5177.2-71.8177.620.200112.7T232 S233T232-Q236 WeakPolarHBondContact O-CG 3.41Å; T232-Q236 PolarHBondContact O-N 2.65Å; S233-Q236 PolarHBondContact O-N 3.13Å
237G55Low62.8Low53 Ų5398.1 Ų98.155%0.54657%0.574SS.*Hα-helixtrans-67.7-34174.600000113.4S233 D234S233-G237 PolarHBondContact O-N 2.99Å; S233-G237 VanDerWaalsContact O-N 3.15Å; D234-G237 PolarHBondContact O-N 3.29Å
238D50.6Low60.7Low153 Ų153108.2 Ų108.282%0.81863%0.628SS**Hα-helixtrans-80.3-19.6179.1-76.7-17.4000113.6
239E44.3Very low58.9Low156 Ų156112.3 Ų112.373%0.72965%0.653SS**SBendtrans-90.3-5.7178-71.4-174.2173.800113.7E241E239-E241 PolarHBondContact O-N 3.21Å
240A39.5Very low56.9Low70 Ų70113.7 Ų113.758%0.57966%0.66SS**  trans-101.964.6-178.100000112.6
241E32.9Very low54.9Low188 Ų188114.8 Ų114.888%0.87967%0.669SS**  trans-170.285.9146.6-108174.1-150.800112.4E239E239-E241 PolarHBondContact O-N 3.21Å
242P38.4Very low52.5Low119 Ų119121.2 Ų121.277%0.77371%0.707SS**  trans-83.6123.6148-018.6000109
243Q36.5Very low50.2Low176 Ų176124.9 Ų124.982%0.82273%0.728SS**  trans-36137.6175.3-83.4168.1-23.300117
244E37Very low47.8Very low186 Ų186129.2 Ų129.287%0.86975%0.748SS**  trans37.6106132.1-61-171.4166.100118.7
245G38.5Very low45.6Very low84 Ų84133.3 Ų133.387%0.86677%0.774SS**  trans-123.1124.3133.500000106.3
246G38Very low43.6Very low73 Ų73139.2 Ų139.275%0.75381%0.807SS**  cis118.98129.900000106
247D42.5Very low42.1Very low164 Ų164139.2 Ų139.288%0.87782%0.82SS**  trans-136.3101.6171.7-89.3-24.2000108.1
248N52.4Low41Very low248 Ų248147 Ų147100%1.32685%0.845SS**  trans-156.10153-105.3-1.9000109.3

Retrieved 248 of 248 residues in 615.8 ms (Link to these results)

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