A0A087Y2B7_POEFO Loading...

Dynein axonemal assembly factor 5

AlphaFold DB , UniProt , Accession A0A087Y2B7, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 840 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
1M49.9Very low73.5Confident225 Ų22579.5 Ų79.5100%1.10850%0.496SS*.  0-42.20-74.5-175.3-155.900112.5A4 G5M1-A4 PolarHBondContact O-N 3.45Å; M1-G5 PolarHBondContact O-N 3.39Å
2A57.4Low74.8Confident75 Ų7581.7 Ų81.762%0.6250%0.496SS*.Hα-helixtrans-56.8-49.6179.100000114.5A4 G5 D6A2-A4 VanDerWaalsContact C-N 3.31Å; A2-A4 PolarHBondContact O-N 3.01Å; A2-G5 WeakPolarHBondContact O-CA 3.48Å; A2-G5 PolarHBondContact O-N 2.94Å; A2-D6 PolarHBondContact O-N 3.22Å
3A61.2Low76Confident69 Ų6976.6 Ų76.657%0.5747%0.466SS*.Hα-helixtrans-60.5-32.5-178.100000115Q7A3-Q7 WeakPolarHBondContact O-CG 3.41Å; A3-Q7 PolarHBondContact O-N 3.02Å; A3-Q7 VanDerWaalsContact O-N 3.15Å
4A64.3Low77Confident67 Ų6773.9 Ų73.955%0.55445%0.447SS*.Hα-helixtrans-74.7-31.917600000112M1 A2 H8M1-A4 PolarHBondContact O-N 3.45Å; A2-A4 VanDerWaalsContact C-N 3.31Å; A2-A4 PolarHBondContact O-N 3.01Å; A4-H8 PolarHBondContact O-N 3.34Å
5G73.5Confident77.8Confident42 Ų4281.7 Ų81.743%0.43347%0.465SS..Hα-helixtrans-69.3-40.1172.200000112.1M1 A2 H8 A9M1-G5 PolarHBondContact O-N 3.39Å; A2-G5 WeakPolarHBondContact O-CA 3.48Å; A2-G5 PolarHBondContact O-N 2.94Å; G5-H8 PolarHBondContact O-N 3.29Å; G5-A9 PolarHBondContact O-N 3.15Å
6D79.4Confident78.4Confident47 Ų4779.2 Ų79.225%0.25146%0.463SS..Hα-helixtrans-65.3-41.5177.9-67.1-26.1000112A2 H8 A9 A10 V52A2-D6 PolarHBondContact O-N 3.22Å; D6-H8 PolarHBondContact O-N 3.48Å; D6-A9 PolarHBondContact O-N 3.12Å; D6-A10 VanDerWaalsContact O-CB 3.25Å; D6-A10 WeakPolarHBondContact O-CB 3.2Å; D6-A10 PolarHBondContact O-N 3.09Å; D6-V52 HydrophobicContact CB-CG2 4.11Å
7Q77.9Confident79.2Confident114 Ų11474.5 Ų74.553%0.53344%0.436SS..Hα-helixtrans-62.8-39.9174.8-78.4-178.4-10.900112.9A3 S11 E55A3-Q7 WeakPolarHBondContact O-CG 3.41Å; A3-Q7 PolarHBondContact O-N 3.02Å; A3-Q7 VanDerWaalsContact O-N 3.15Å; Q7-S11 WeakPolarHBondContact O-CB 3.46Å; Q7-S11 PolarHBondContact O-N 3.45Å; Q7-E55 HydrophobicContact CG-CG 4.34Å
8H82.8Confident79.8Confident126 Ų12673.6 Ų73.658%0.58343%0.434SS*.Hα-helixtrans-66.3-47.7177.6-171.361.1000111.4A4 G5 D6 A10 S11 E12A4-H8 PolarHBondContact O-N 3.34Å; G5-H8 PolarHBondContact O-N 3.29Å; D6-H8 PolarHBondContact O-N 3.48Å; H8-A10 VanDerWaalsContact C-N 3.33Å; H8-A10 PolarHBondContact O-N 3.44Å; H8-S11 WeakPolarHBondContact O-CB 3.4Å; H8-S11 PolarHBondContact O-N 2.9Å; H8-E12 PolarHBondContact O-N 3.03Å; H8-E12 VanDerWaalsContact O-N 3.09Å
9A85.8Confident80.4Confident34 Ų3480.1 Ų80.128%0.28145%0.45SS..Hα-helixtrans-62.2-38.8176.700000112.3G5 D6 E12 V13 V52G5-A9 PolarHBondContact O-N 3.15Å; D6-A9 PolarHBondContact O-N 3.12Å; A9-E12 PolarHBondContact O-N 3.33Å; A9-V13 WeakPolarHBondContact O-CG2 3.38Å; A9-V13 PolarHBondContact O-N 3.27Å; A9-V13 VanDerWaalsContact O-N 3.12Å; A9-V52 HydrophobicContact CB-CG1 4.27Å; A9-V52 HydrophobicContact CB-CG2 3.88Å
10A88.2Confident81Confident2 Ų278.3 Ų78.32%0.01744%0.438CS..Hα-helixtrans-63.5-41.3174.500000111.8D6 H8 E12 V13 L14 V52 E55 V56D6-A10 VanDerWaalsContact O-CB 3.25Å; D6-A10 WeakPolarHBondContact O-CB 3.2Å; D6-A10 PolarHBondContact O-N 3.09Å; H8-A10 VanDerWaalsContact C-N 3.33Å; H8-A10 PolarHBondContact O-N 3.44Å; A10-E12 VanDerWaalsContact C-N 3.33Å; A10-E12 PolarHBondContact O-N 3.3Å; A10-V13 PolarHBondContact O-N 3.01Å; A10-L14 WeakPolarHBondContact O-CB 3.22Å; A10-L14 VanDerWaalsContact O-CG 3.27Å; A10-L14 WeakPolarHBondContact O-CG 3.41Å; A10-L14 PolarHBondContact O-N 3.36Å; A10-V52 HydrophobicContact CB-CG1 4.07Å; A10-E55 HydrophobicContact CB-CB 3.51Å; A10-E55 HydrophobicContact CB-CG 4.39Å; A10-V56 HydrophobicContact CB-CG2 3.92Å
11S88.2Confident81.4Confident73 Ų7376.1 Ų76.151%0.5143%0.425SS..Hα-helixtrans-61.4-39.5175.7-169.40000112.3Q7 H8 L14 R15Q7-S11 WeakPolarHBondContact O-CB 3.46Å; Q7-S11 PolarHBondContact O-N 3.45Å; H8-S11 WeakPolarHBondContact O-CB 3.4Å; H8-S11 PolarHBondContact O-N 2.9Å; S11-L14 PolarHBondContact O-N 3.43Å; S11-R15 WeakPolarHBondContact O-CB 3.27Å; S11-R15 PolarHBondContact O-N 3.27Å
12E89Confident83.2Confident106 Ų10670.7 Ų70.750%0.49540%0.401SS..Hα-helixtrans-64.3-43.1175.2-68-165144.700112.5H8 A9 A10 R15 G16H8-E12 PolarHBondContact O-N 3.03Å; H8-E12 VanDerWaalsContact O-N 3.09Å; A9-E12 PolarHBondContact O-N 3.33Å; A10-E12 VanDerWaalsContact C-N 3.33Å; A10-E12 PolarHBondContact O-N 3.3Å; E12-R15 PolarHBondContact O-N 2.99Å; E12-G16 PolarHBondContact O-N 3.03Å
13V90.4Very high84.9Confident16 Ų1667.9 Ų67.910%0.09738%0.376CS..Hα-helixtrans-62.9-46.9175.6174.70000110.5A9 A10 R15 G16 I17 T43 L48 V56A9-V13 WeakPolarHBondContact O-CG2 3.38Å; A9-V13 PolarHBondContact O-N 3.27Å; A9-V13 VanDerWaalsContact O-N 3.12Å; A10-V13 PolarHBondContact O-N 3.01Å; V13-R15 VanDerWaalsContact C-N 3.31Å; V13-R15 PolarHBondContact O-N 3.18Å; V13-G16 WeakPolarHBondContact O-CA 3.46Å; V13-G16 PolarHBondContact O-N 3.39Å; V13-I17 WeakPolarHBondContact O-CG1 3.41Å; V13-I17 PolarHBondContact O-N 3.03Å; V13-T43 HydrophobicContact CG1-CG2 4.2Å; V13-L48 HydrophobicContact CG1-CD1 4.13Å; V13-L48 HydrophobicContact CG2-CD1 3.92Å; V13-L48 HydrophobicContact CG2-CD2 4.29Å; V13-V56 HydrophobicContact CB-CG2 4.12Å; V13-V56 HydrophobicContact CG1-CG1 4.44Å; V13-V56 HydrophobicContact CG1-CG2 4Å
14L89.8Confident86.3Confident38 Ų3865.1 Ų65.120%0.19935%0.352CS..Hα-helixtrans-60.9-38.3177.8-72.7169.1000112.2A10 S11 G16 I17 S18 V56 L60A10-L14 WeakPolarHBondContact O-CB 3.22Å; A10-L14 VanDerWaalsContact O-CG 3.27Å; A10-L14 WeakPolarHBondContact O-CG 3.41Å; A10-L14 PolarHBondContact O-N 3.36Å; S11-L14 PolarHBondContact O-N 3.43Å; L14-G16 VanDerWaalsContact C-N 3.35Å; L14-I17 HydrophobicContact CD2-CD1 4.23Å; L14-I17 PolarHBondContact O-N 2.87Å; L14-S18 PolarHBondContact O-N 3.43Å; L14-V56 HydrophobicContact CD2-CG1 4.37Å; L14-V56 HydrophobicContact CG-CG2 4.42Å; L14-L60 HydrophobicContact CD2-CD2 4.47Å; L14-L60 HydrophobicContact CD2-CG 4.44Å
15R89.4Confident87.4Confident191 Ų19166.9 Ų66.972%0.72135%0.352SS*.Hα-helixtrans-64.1-40.5173.3-170.3-179.467.1174.8-3.3111.4S11 E12 V13 S18S11-R15 WeakPolarHBondContact O-CB 3.27Å; S11-R15 PolarHBondContact O-N 3.27Å; E12-R15 PolarHBondContact O-N 2.99Å; V13-R15 VanDerWaalsContact C-N 3.31Å; V13-R15 PolarHBondContact O-N 3.18Å; R15-S18 WeakPolarHBondContact O-CB 3.25Å; R15-S18 PolarHBondContact O-N 3.06Å
16G87.6Confident88.1Confident42 Ų4268.9 Ų68.943%0.43335%0.35SS..Hα-helixtrans-61.2-44176.200000113.1E12 V13 L14E12-G16 PolarHBondContact O-N 3.03Å; V13-G16 WeakPolarHBondContact O-CA 3.46Å; V13-G16 PolarHBondContact O-N 3.39Å; L14-G16 VanDerWaalsContact C-N 3.35Å
17I92.3Very high88.4Confident0 Ų074.4 Ų74.40%038%0.38CS..Hα-helixtrans-88.6-2.1-178.766.5-175.6000114.5V13 L14 R19 H20 L21 E42 T43 L60V13-I17 WeakPolarHBondContact O-CG1 3.41Å; V13-I17 PolarHBondContact O-N 3.03Å; L14-I17 HydrophobicContact CD2-CD1 4.23Å; L14-I17 PolarHBondContact O-N 2.87Å; I17-R19 VanDerWaalsContact C-N 3.27Å; I17-R19 PolarHBondContact O-N 3.39Å; I17-H20 WeakPolarHBondContact O-CA 3.41Å; I17-H20 WeakPolarHBondContact O-CB 3.1Å; I17-H20 PolarHBondContact O-N 2.99Å; I17-L21 HydrophobicContact CG1-CD1 4.36Å; I17-L21 PolarHBondContact O-N 3.46Å; I17-E42 HydrophobicContact CG2-CB 3.69Å; I17-E42 HydrophobicContact CG2-CG 4.43Å; I17-E42 WeakPolarHBondContact CG2-OE2 3.47Å; I17-T43 HydrophobicContact CD1-CG2 3.92Å; I17-L60 HydrophobicContact CD1-CD1 3.8Å; I17-L60 HydrophobicContact CD1-CD2 3.78Å; I17-L60 HydrophobicContact CD1-CG 4.21Å
18S89.9Confident89Confident58 Ų5873 Ų7341%0.40638%0.376SS..Hα-helixtrans-54.8-40-176.2178.80000113.1L14 R15 L21 N22L14-S18 PolarHBondContact O-N 3.43Å; R15-S18 WeakPolarHBondContact O-CB 3.25Å; R15-S18 PolarHBondContact O-N 3.06Å; S18-L21 WeakPolarHBondContact O-CB 3.19Å; S18-L21 PolarHBondContact O-N 2.86Å; S18-N22 PolarHBondContact O-N 3.01Å; S18-N22 PolarHBondContact O-ND2 3.47Å
19R90.9Very high89.4Confident196 Ų19673.7 Ų73.774%0.7438%0.377SS*.Hα-helixtrans-62.6-43.9174.6-178.2-179.3174.1178.20.1111.7I17 L21 N22 C23I17-R19 VanDerWaalsContact C-N 3.27Å; I17-R19 PolarHBondContact O-N 3.39Å; R19-L21 VanDerWaalsContact C-N 3.34Å; R19-N22 PolarHBondContact O-N 2.99Å; R19-C23 PolarHBondContact O-N 3.06Å; R19-C23 VanDerWaalsContact O-N 3.13Å; R19-C23 PolarHBondContact O-SG 3.13Å; R19-C23 VanDerWaalsContact O-SG 3.37Å
20H91.4Very high89.6Confident44 Ų4474.2 Ų74.220%0.20438%0.382CS..Hα-helixtrans-65.7-38179.3-61.4-56.6000111.6I17 N22 C23 L24 A35 I39I17-H20 WeakPolarHBondContact O-CA 3.41Å; I17-H20 WeakPolarHBondContact O-CB 3.1Å; I17-H20 PolarHBondContact O-N 2.99Å; H20-N22 VanDerWaalsContact C-N 3.34Å; H20-N22 PolarHBondContact O-N 2.82Å; H20-C23 WeakPolarHBondContact O-CB 3.39Å; H20-C23 PolarHBondContact O-N 3.2Å; H20-L24 PolarHBondContact O-N 3.39Å; H20-A35 HydrophobicContact CB-CB 4.27Å; H20-A35 WeakPolarHBondContact O-CB 3.46Å; H20-I39 HydrophobicContact CB-CD1 4.16Å; H20-I39 HydrophobicContact CB-CG1 3.8Å
21L89.3Confident89.8Confident34 Ų3475.3 Ų75.318%0.17839%0.388CS..Hα-helixtrans-58.2-44173.3-80.2172.3000112.5I17 S18 R19 C23 L24 I39 L60 P63I17-L21 HydrophobicContact CG1-CD1 4.36Å; I17-L21 PolarHBondContact O-N 3.46Å; S18-L21 WeakPolarHBondContact O-CB 3.19Å; S18-L21 PolarHBondContact O-N 2.86Å; R19-L21 VanDerWaalsContact C-N 3.34Å; L21-C23 VanDerWaalsContact C-N 3.32Å; L21-C23 PolarHBondContact O-N 3.43Å; L21-L24 HydrophobicContact CD2-CD1 4.04Å; L21-L24 WeakPolarHBondContact O-CB 3.46Å; L21-L24 PolarHBondContact O-N 3.35Å; L21-I39 HydrophobicContact CD2-CD1 4.23Å; L21-L60 HydrophobicContact CD1-CD2 3.78Å; L21-L60 HydrophobicContact CD2-CD2 3.35Å; L21-L60 HydrophobicContact CG-CD2 3.9Å; L21-P63 HydrophobicContact CD2-CB 3.95Å; L21-P63 HydrophobicContact CD2-CG 4.16Å
22N89.3Confident90Very high111 Ų11173 Ų7359%0.59437%0.368SS*.Hα-helixtrans-63.7-40.4176.8-67.2-23.5000111.5S18 R19 H20 L24 N25S18-N22 PolarHBondContact O-N 3.01Å; S18-N22 PolarHBondContact O-ND2 3.47Å; R19-N22 PolarHBondContact O-N 2.99Å; H20-N22 VanDerWaalsContact C-N 3.34Å; H20-N22 PolarHBondContact O-N 2.82Å; N22-L24 PolarHBondContact O-N 2.82Å; N22-L24 VanDerWaalsContact O-N 3.14Å; N22-N25 PolarHBondContact O-N 2.99Å; N22-N25 VanDerWaalsContact O-N 3.16Å
23C91.9Very high90.2Very high16 Ų1671.5 Ų71.511%0.10836%0.36CS..Hα-helixtrans-62.9-16.4177.5-72.40000114.1R19 H20 L21 N25 E26 T31 R32 A35R19-C23 PolarHBondContact O-N 3.06Å; R19-C23 VanDerWaalsContact O-N 3.13Å; R19-C23 PolarHBondContact O-SG 3.13Å; R19-C23 VanDerWaalsContact O-SG 3.37Å; H20-C23 WeakPolarHBondContact O-CB 3.39Å; H20-C23 PolarHBondContact O-N 3.2Å; L21-C23 VanDerWaalsContact C-N 3.32Å; L21-C23 PolarHBondContact O-N 3.43Å; C23-N25 PolarHBondContact O-N 3.49Å; C23-E26 PolarHBondContact O-N 3.33Å; C23-E26 PolarHBondContact SG-OE1 2.93Å; C23-E26 VanDerWaalsContact SG-OE1 3.35Å; C23-T31 HydrophobicContact CB-CG2 3.96Å; C23-R32 WeakPolarHBondContact O-CG 3.47Å; C23-A35 HydrophobicContact CB-CB 3.73Å
24L90.3Very high90.4Very high11 Ų1177.6 Ų77.66%0.05838%0.381CS..THydrogen-bonded Turntrans-67.2-19.6174.7-62.2-179.8000113.3H20 L21 N22 R32 A35 L36 I39 P63H20-L24 PolarHBondContact O-N 3.39Å; L21-L24 HydrophobicContact CD2-CD1 4.04Å; L21-L24 WeakPolarHBondContact O-CB 3.46Å; L21-L24 PolarHBondContact O-N 3.35Å; N22-L24 PolarHBondContact O-N 2.82Å; N22-L24 VanDerWaalsContact O-N 3.14Å; L24-R32 WeakPolarHBondContact O-CD 3.16Å; L24-A35 HydrophobicContact CD2-CB 3.93Å; L24-L36 HydrophobicContact CD2-CD2 3.6Å; L24-L36 HydrophobicContact CD2-CG 3.59Å; L24-I39 HydrophobicContact CD1-CD1 3.83Å; L24-I39 HydrophobicContact CD2-CD1 4.15Å; L24-I39 HydrophobicContact CG-CD1 4.15Å; L24-P63 HydrophobicContact CD1-CB 4.29Å
25N87.5Confident90.6Very high104 Ų10475.9 Ų75.956%0.55637%0.373SS*.THydrogen-bonded Turntrans-99.83.4179-64.5-67.7000113.7N22 C23 K66N22-N25 PolarHBondContact O-N 2.99Å; N22-N25 VanDerWaalsContact O-N 3.16Å; C23-N25 PolarHBondContact O-N 3.49Å; N25-K66 PolarHBondContact OD1-NZ 2.72Å
26E89.3Confident90.9Very high84 Ų8466.8 Ų66.839%0.39334%0.338SS..SBendtrans-75.6149.8178.8-74.5-174.5-15200112.8C23 N28 T31 R32C23-E26 PolarHBondContact O-N 3.33Å; C23-E26 PolarHBondContact SG-OE1 2.93Å; C23-E26 VanDerWaalsContact SG-OE1 3.35Å; E26-N28 VanDerWaalsContact C-N 3.26Å; E26-N28 PolarHBondContact O-N 3.38Å; E26-T31 VanDerWaalsContact OE2-CG2 3.3Å; E26-T31 WeakPolarHBondContact OE2-CG2 3.22Å; E26-R32 WeakPolarHBondContact O-CD 3.47Å; E26-R32 WeakPolarHBondContact O-CG 3.47Å; E26-R32 PolarHBondContact O-NH1 3.15Å
27D84.9Confident91.2Very high163 Ų16368.8 Ų68.887%0.87234%0.336SS*.SBendtrans-65-27.9179.6-63.8-39.3000113.4K29 R32D27-K29 PolarHBondContact O-N 3.19Å; D27-R32 PolarHBondContact O-NH1 3.26Å
28N91.4Very high91.3Very high85 Ų8570.4 Ų70.446%0.45535%0.348SS..  trans-77113.4-176.2-172.3-26.2000112.5E26 A30 T31 R32E26-N28 VanDerWaalsContact C-N 3.26Å; E26-N28 PolarHBondContact O-N 3.38Å; N28-A30 VanDerWaalsContact C-N 3.26Å; N28-A30 PolarHBondContact O-N 3.27Å; N28-A30 WeakPolarHBondContact OD1-CB 3.3Å; N28-A30 PolarHBondContact OD1-N 3.24Å; N28-T31 PolarHBondContact O-N 3.19Å; N28-R32 PolarHBondContact O-N 3Å; N28-R32 VanDerWaalsContact O-N 3.13Å
29K90.1Very high91.5Very high140 Ų14067.7 Ų67.761%0.60933%0.328SS*.Hα-helixtrans-53-37.917768.8-179.3-177.8-177.80114.2D27 T31 K33 T72D27-K29 PolarHBondContact O-N 3.19Å; K29-T31 VanDerWaalsContact C-N 3.33Å; K29-K33 WeakPolarHBondContact O-CB 3.49Å; K29-K33 PolarHBondContact O-N 3.24Å; K29-T72 HydrophobicContact CB-CG2 4.49Å; K29-T72 WeakPolarHBondContact CB-OG1 3.5Å
30A90.8Very high91.7Very high45 Ų4561.9 Ų61.937%0.37231%0.307SS..Hα-helixtrans-73.5-27.6-178.500000111.9N28 R34N28-A30 VanDerWaalsContact C-N 3.26Å; N28-A30 PolarHBondContact O-N 3.27Å; N28-A30 WeakPolarHBondContact OD1-CB 3.3Å; N28-A30 PolarHBondContact OD1-N 3.24Å; A30-R34 WeakPolarHBondContact O-CB 3.17Å; A30-R34 WeakPolarHBondContact O-CG 3.17Å; A30-R34 PolarHBondContact O-N 2.64Å; A30-R34 PolarHBondContact O-NE 3.1Å
31T91.4Very high91.8Very high24 Ų2467.2 Ų67.215%0.14733%0.329CS..Hα-helixtrans-73.7-47.3173.5-47.80000110.6C23 E26 N28 K29 K33 R34 A35C23-T31 HydrophobicContact CB-CG2 3.96Å; E26-T31 VanDerWaalsContact OE2-CG2 3.3Å; E26-T31 WeakPolarHBondContact OE2-CG2 3.22Å; N28-T31 PolarHBondContact O-N 3.19Å; K29-T31 VanDerWaalsContact C-N 3.33Å; T31-K33 PolarHBondContact O-N 3.28Å; T31-R34 PolarHBondContact O-N 3.48Å; T31-A35 WeakPolarHBondContact O-CB 3.39Å; T31-A35 PolarHBondContact O-N 2.93Å
32R93.8Very high92Very high24 Ų2468.6 Ų68.69%0.09134%0.335CS..Hα-helixtrans-58.4-45.4176.7-62.6-161.6-57.7-834.3112.5C23 L24 E26 D27 N28 A35 L36 D70 T72C23-R32 WeakPolarHBondContact O-CG 3.47Å; L24-R32 WeakPolarHBondContact O-CD 3.16Å; E26-R32 WeakPolarHBondContact O-CD 3.47Å; E26-R32 WeakPolarHBondContact O-CG 3.47Å; E26-R32 PolarHBondContact O-NH1 3.15Å; D27-R32 PolarHBondContact O-NH1 3.26Å; N28-R32 PolarHBondContact O-N 3Å; N28-R32 VanDerWaalsContact O-N 3.13Å; R32-A35 WeakPolarHBondContact O-CB 3.36Å; R32-A35 PolarHBondContact O-N 2.92Å; R32-L36 PolarHBondContact O-N 3.2Å; R32-D70 WeakPolarHBondContact CD-OD2 3.36Å; R32-D70 IonicContact CZ-OD1 3.6Å; R32-D70 IonicContact CZ-OD2 3.84Å; R32-D70 IonicContact NE-OD1 3.64Å; R32-D70 IonicContact NE-OD2 2.72Å; R32-D70 PolarHBondContact NE-OD2 3.19Å; R32-D70 IonicContact NH2-OD1 2.71Å; R32-D70 PolarHBondContact NH2-OD1 3.31Å; R32-D70 IonicContact NH2-OD2 3.68Å; R32-D70 PolarHBondContact NH2-OD2 3.37Å; R32-T72 PolarHBondContact NH2-OG1 3.13Å
33K92.5Very high92.1Very high76 Ų7663.3 Ų63.333%0.3331%0.307SS..Hα-helixtrans-58-52.5176.3179.4-177.7167.6-179.30112.2K29 T31 A35 L36 E37 K74K29-K33 WeakPolarHBondContact O-CB 3.49Å; K29-K33 PolarHBondContact O-N 3.24Å; T31-K33 PolarHBondContact O-N 3.28Å; K33-A35 PolarHBondContact O-N 2.9Å; K33-L36 PolarHBondContact O-N 3.33Å; K33-E37 WeakPolarHBondContact CE-OE1 3.44Å; K33-E37 IonicContact NZ-OE1 3.75Å; K33-E37 PolarHBondContact O-N 3.49Å; K33-K74 HydrophobicContact CD-CG 3.95Å; K33-K74 HydrophobicContact CG-CG 4.41Å
34R93.7Very high92Very high144 Ų14463.4 Ų63.454%0.54331%0.307SS..Hα-helixtrans-61.8-34.1179.1-78.1179.8-71.3150.1-2.1112.1A30 T31 S38A30-R34 WeakPolarHBondContact O-CB 3.17Å; A30-R34 WeakPolarHBondContact O-CG 3.17Å; A30-R34 PolarHBondContact O-N 2.64Å; A30-R34 PolarHBondContact O-NE 3.1Å; T31-R34 PolarHBondContact O-N 3.48Å; R34-S38 WeakPolarHBondContact O-CB 3.48Å; R34-S38 PolarHBondContact O-N 3.18Å; R34-S38 PolarHBondContact O-OG 2.92Å
35A94.8Very high92Very high2 Ų267.6 Ų67.62%0.01733%0.329CS..Hα-helixtrans-64.2-46.617500000111.8H20 C23 L24 T31 R32 K33 S38 I39H20-A35 HydrophobicContact CB-CB 4.27Å; H20-A35 WeakPolarHBondContact O-CB 3.46Å; C23-A35 HydrophobicContact CB-CB 3.73Å; L24-A35 HydrophobicContact CD2-CB 3.93Å; T31-A35 WeakPolarHBondContact O-CB 3.39Å; T31-A35 PolarHBondContact O-N 2.93Å; R32-A35 WeakPolarHBondContact O-CB 3.36Å; R32-A35 PolarHBondContact O-N 2.92Å; K33-A35 PolarHBondContact O-N 2.9Å; A35-S38 PolarHBondContact O-N 3.46Å; A35-I39 VanDerWaalsContact O-CG1 3.28Å; A35-I39 WeakPolarHBondContact O-CG1 3.41Å; A35-I39 PolarHBondContact O-N 3.29Å
36L95.5Very high92.1Very high0 Ų068.6 Ų68.60%033%0.328CS..Hα-helixtrans-61-44.7175-71.6168.1000112.3L24 R32 K33 S38 I39 R40 L64 C75 T78 I82L24-L36 HydrophobicContact CD2-CD2 3.6Å; L24-L36 HydrophobicContact CD2-CG 3.59Å; R32-L36 PolarHBondContact O-N 3.2Å; K33-L36 PolarHBondContact O-N 3.33Å; L36-S38 VanDerWaalsContact C-N 3.29Å; L36-S38 PolarHBondContact O-N 3.37Å; L36-I39 PolarHBondContact O-N 3.11Å; L36-R40 WeakPolarHBondContact O-CB 3.34Å; L36-R40 PolarHBondContact O-N 3.14Å; L36-L64 HydrophobicContact CD2-CD2 3.94Å; L36-C75 HydrophobicContact CD1-CB 3.7Å; L36-C75 WeakPolarHBondContact CD1-O 3.42Å; L36-T78 HydrophobicContact CB-CG2 3.84Å; L36-I82 HydrophobicContact CB-CD1 4.32Å; L36-I82 HydrophobicContact CD2-CD1 4.13Å; L36-I82 WeakPolarHBondContact O-CD1 3.45Å
37E94.2Very high91.9Very high83 Ų8367.9 Ų67.939%0.38834%0.344SS..Hα-helixtrans-60.8-39.3176.2-71.5171170.900112K33 K41K33-E37 WeakPolarHBondContact CE-OE1 3.44Å; K33-E37 IonicContact NZ-OE1 3.75Å; K33-E37 PolarHBondContact O-N 3.49Å; E37-K41 WeakPolarHBondContact O-CB 3.31Å; E37-K41 PolarHBondContact O-N 3.4Å
38S94.4Very high92.2Very high35 Ų3561.8 Ų61.825%0.24531%0.311CS..Hα-helixtrans-69.6-42.8177-55.30000111.6R34 A35 L36 R40 K41 E42R34-S38 WeakPolarHBondContact O-CB 3.48Å; R34-S38 PolarHBondContact O-N 3.18Å; R34-S38 PolarHBondContact O-OG 2.92Å; A35-S38 PolarHBondContact O-N 3.46Å; L36-S38 VanDerWaalsContact C-N 3.29Å; L36-S38 PolarHBondContact O-N 3.37Å; S38-R40 VanDerWaalsContact C-N 3.34Å; S38-R40 PolarHBondContact O-N 3.16Å; S38-K41 PolarHBondContact O-N 3.49Å; S38-E42 WeakPolarHBondContact O-CB 3.24Å; S38-E42 WeakPolarHBondContact O-CG 3.3Å; S38-E42 PolarHBondContact O-N 2.97Å
39I94.7Very high92.2Very high0 Ų061.5 Ų61.50%031%0.314CS..Hα-helixtrans-58.2-48.1174.4-71.1164.5000110H20 L21 L24 A35 L36 K41 E42 T43 L60H20-I39 HydrophobicContact CB-CD1 4.16Å; H20-I39 HydrophobicContact CB-CG1 3.8Å; L21-I39 HydrophobicContact CD2-CD1 4.23Å; L24-I39 HydrophobicContact CD1-CD1 3.83Å; L24-I39 HydrophobicContact CD2-CD1 4.15Å; L24-I39 HydrophobicContact CG-CD1 4.15Å; A35-I39 VanDerWaalsContact O-CG1 3.28Å; A35-I39 WeakPolarHBondContact O-CG1 3.41Å; A35-I39 PolarHBondContact O-N 3.29Å; L36-I39 PolarHBondContact O-N 3.11Å; I39-K41 VanDerWaalsContact C-N 3.34Å; I39-K41 PolarHBondContact O-N 3.29Å; I39-E42 PolarHBondContact O-N 2.99Å; I39-T43 WeakPolarHBondContact O-CB 3.36Å; I39-T43 WeakPolarHBondContact O-CG2 3.36Å; I39-T43 PolarHBondContact O-N 3.49Å; I39-T43 VanDerWaalsContact O-N 3.1Å; I39-T43 PolarHBondContact O-OG1 3.03Å; I39-L60 HydrophobicContact CG2-CD1 4Å
40R94.5Very high92.3Very high75 Ų7557.8 Ų57.828%0.28331%0.306SS..Hα-helixtrans-58.3-45.6176.7-167.1174.6174.8-167.5-5.3111.8L36 S38 E42 T43 V44 N45 I82 E85L36-R40 WeakPolarHBondContact O-CB 3.34Å; L36-R40 PolarHBondContact O-N 3.14Å; S38-R40 VanDerWaalsContact C-N 3.34Å; S38-R40 PolarHBondContact O-N 3.16Å; R40-E42 PolarHBondContact O-N 3.21Å; R40-T43 PolarHBondContact O-N 2.81Å; R40-V44 HydrophobicContact CG-CG2 3.82Å; R40-N45 WeakPolarHBondContact O-CB 3.45Å; R40-N45 PolarHBondContact O-N 2.91Å; R40-N45 VanDerWaalsContact O-N 3.15Å; R40-I82 HydrophobicContact CB-CD1 3.95Å; R40-I82 HydrophobicContact CB-CG1 3.68Å; R40-I82 HydrophobicContact CG-CG1 3.78Å; R40-E85 IonicContact CZ-OE1 2.54Å; R40-E85 IonicContact CZ-OE2 3.87Å; R40-E85 IonicContact NE-OE1 3.56Å; R40-E85 PolarHBondContact NE-OE1 3.17Å; R40-E85 IonicContact NE-OE2 2.79Å; R40-E85 PolarHBondContact NE-OE2 3.46Å; R40-E85 IonicContact NH2-OE1 3.6Å; R40-E85 PolarHBondContact NH2-OE1 2.93Å; R40-E85 IonicContact NH2-OE2 2.7Å
41K93.8Very high92.3Very high155 Ų15556.6 Ų56.667%0.67430%0.298SS*.Hα-helixtrans-61.7-42.4179.2-172.8179.5177.7-176.90112.7E37 S38 I39E37-K41 WeakPolarHBondContact O-CB 3.31Å; E37-K41 PolarHBondContact O-N 3.4Å; S38-K41 PolarHBondContact O-N 3.49Å; I39-K41 VanDerWaalsContact C-N 3.34Å; I39-K41 PolarHBondContact O-N 3.29Å
42E92.8Very high92.3Very high64 Ų6455.7 Ų55.730%0.29929%0.292SS..Hα-helixtrans-85.3-8.5-174.8-67.9-165.1176.700114.4I17 S38 I39 R40 K46I17-E42 HydrophobicContact CG2-CB 3.69Å; I17-E42 HydrophobicContact CG2-CG 4.43Å; I17-E42 WeakPolarHBondContact CG2-OE2 3.47Å; S38-E42 WeakPolarHBondContact O-CB 3.24Å; S38-E42 WeakPolarHBondContact O-CG 3.3Å; S38-E42 PolarHBondContact O-N 2.97Å; I39-E42 PolarHBondContact O-N 2.99Å; R40-E42 PolarHBondContact O-N 3.21Å; E42-K46 WeakPolarHBondContact O-CD 3.43Å
43T92.8Very high92.3Very high0 Ų054.9 Ų54.90%029%0.29CS..THydrogen-bonded Turntrans-114.3-98.3-178.759.60000111.5V13 I17 I39 R40 N45 K46 V56 L60 F86V13-T43 HydrophobicContact CG1-CG2 4.2Å; I17-T43 HydrophobicContact CD1-CG2 3.92Å; I39-T43 WeakPolarHBondContact O-CB 3.36Å; I39-T43 WeakPolarHBondContact O-CG2 3.36Å; I39-T43 PolarHBondContact O-N 3.49Å; I39-T43 VanDerWaalsContact O-N 3.1Å; I39-T43 PolarHBondContact O-OG1 3.03Å; R40-T43 PolarHBondContact O-N 2.81Å; T43-N45 VanDerWaalsContact C-N 3.28Å; T43-N45 PolarHBondContact O-N 3.2Å; T43-K46 WeakPolarHBondContact O-CB 3.45Å; T43-K46 PolarHBondContact O-N 3.15Å; T43-V56 HydrophobicContact CG2-CG1 3.83Å; T43-L60 HydrophobicContact CG2-CD1 4.04Å; T43-F86 HydrophobicContact CG2-CZ 4.15Å
44V88.1Confident92.5Very high18 Ų1851.8 Ų51.811%0.10928%0.276CS..G310 helixtrans-58.3-33.6-175.1-75.20000113.4R40 E85 F86R40-V44 HydrophobicContact CG-CG2 3.82Å; V44-E85 HydrophobicContact CB-CB 3.93Å; V44-E85 HydrophobicContact CG1-CB 3.9Å; V44-E85 HydrophobicContact CG2-CB 3.99Å; V44-E85 WeakPolarHBondContact CG2-OE2 3.15Å; V44-F86 HydrophobicContact CG1-CB 4.43Å; V44-F86 HydrophobicContact CG1-CD1 3.6Å; V44-F86 HydrophobicContact CG1-CD2 3.89Å; V44-F86 HydrophobicContact CG1-CE1 3.73Å; V44-F86 HydrophobicContact CG1-CE2 4Å; V44-F86 HydrophobicContact CG1-CG 3.69Å; V44-F86 HydrophobicContact CG1-CZ 3.93Å
45N91.1Very high92.5Very high99 Ų9948.5 Ų48.553%0.52927%0.267SS..G310 helixtrans-83.8-8177.6-69.7-6.4000114.4R40 T43 G47R40-N45 WeakPolarHBondContact O-CB 3.45Å; R40-N45 PolarHBondContact O-N 2.91Å; R40-N45 VanDerWaalsContact O-N 3.15Å; T43-N45 VanDerWaalsContact C-N 3.28Å; T43-N45 PolarHBondContact O-N 3.2Å; N45-G47 VanDerWaalsContact C-N 3.32Å
46K89.6Confident92.4Very high124 Ų12448.4 Ų48.454%0.53927%0.266SS..G310 helixtrans-85.3-6.3-175.9-165.1173.1179.3-178.80113E42 T43 L48E42-K46 WeakPolarHBondContact O-CD 3.43Å; T43-K46 WeakPolarHBondContact O-CB 3.45Å; T43-K46 PolarHBondContact O-N 3.15Å; K46-L48 HydrophobicContact CB-CG 4.19Å; K46-L48 HydrophobicContact CD-CD2 4.24Å; K46-L48 HydrophobicContact CG-CD2 4.33Å
47G84.4Confident92.4Very high70 Ų7048.5 Ų48.572%0.72227%0.266SS*.THydrogen-bonded Turntrans69.536.7-18000000113N45N45-G47 VanDerWaalsContact C-N 3.32Å
48L91.1Very high92.4Very high35 Ų3547.3 Ų47.318%0.18327%0.268CS..  trans-70.4152.9179.7-61.2173000111.4V13 K46 L53V13-L48 HydrophobicContact CG1-CD1 4.13Å; V13-L48 HydrophobicContact CG2-CD1 3.92Å; V13-L48 HydrophobicContact CG2-CD2 4.29Å; K46-L48 HydrophobicContact CB-CG 4.19Å; K46-L48 HydrophobicContact CD-CD2 4.24Å; K46-L48 HydrophobicContact CG-CD2 4.33Å; L48-L53 HydrophobicContact CB-CD2 3.93Å; L48-L53 HydrophobicContact CB-CG 3.96Å; L48-L53 HydrophobicContact CD1-CD2 4Å; L48-L53 HydrophobicContact CG-CD2 4.48Å
49P92.2Very high92.3Very high78 Ų7848.7 Ų48.751%0.50628%0.277SS..  trans-57.3144.1172.1-22.332.9000112G51 V52 L53P49-G51 VanDerWaalsContact C-N 3.3Å; P49-G51 PolarHBondContact O-N 3.06Å; P49-V52 HydrophobicContact CB-CG2 4.15Å; P49-V52 HydrophobicContact CG-CG2 4.21Å; P49-V52 WeakPolarHBondContact O-CB 3.26Å; P49-V52 PolarHBondContact O-N 3.21Å; P49-L53 PolarHBondContact O-N 3.13Å
50S91.9Very high92.2Very high63 Ų6348.7 Ų48.744%0.44128%0.277SS..Hα-helixtrans-60.5-35.3-175.256.90000113.6L53 Q54 C89 P91S50-L53 PolarHBondContact O-N 3.24Å; S50-Q54 PolarHBondContact O-N 3.13Å; S50-C89 WeakPolarHBondContact CB-O 3.36Å; S50-P91 WeakPolarHBondContact O-CD 3.35Å
51G91.2Very high92.2Very high20 Ų2045.4 Ų45.421%0.20627%0.265CS..Hα-helixtrans-62.9-40173.200000113.2P49 Q54P49-G51 VanDerWaalsContact C-N 3.3Å; P49-G51 PolarHBondContact O-N 3.06Å; G51-Q54 WeakPolarHBondContact O-CB 3.45Å; G51-Q54 PolarHBondContact O-N 3.16Å
52V92.1Very high92.3Very high4 Ų443.6 Ų43.62%0.02426%0.257CS..Hα-helixtrans-66.6-41.5174.1178.80000110.7D6 A9 A10 P49 Q54 E55 V56D6-V52 HydrophobicContact CB-CG2 4.11Å; A9-V52 HydrophobicContact CB-CG1 4.27Å; A9-V52 HydrophobicContact CB-CG2 3.88Å; A10-V52 HydrophobicContact CB-CG1 4.07Å; P49-V52 HydrophobicContact CB-CG2 4.15Å; P49-V52 HydrophobicContact CG-CG2 4.21Å; P49-V52 WeakPolarHBondContact O-CB 3.26Å; P49-V52 PolarHBondContact O-N 3.21Å; V52-Q54 VanDerWaalsContact C-N 3.28Å; V52-Q54 PolarHBondContact O-N 3.11Å; V52-E55 PolarHBondContact O-N 3.07Å; V52-V56 HydrophobicContact CG1-CG2 4.32Å; V52-V56 VanDerWaalsContact O-CG2 3.3Å; V52-V56 WeakPolarHBondContact O-CG2 3.34Å; V52-V56 PolarHBondContact O-N 3.16Å
53L94.2Very high92.3Very high8 Ų842.8 Ų42.84%0.04226%0.258CS..Hα-helixtrans-62-33.6176.5-70.7173.8000112.5L48 P49 S50 F57 F86 C89 V90L48-L53 HydrophobicContact CB-CD2 3.93Å; L48-L53 HydrophobicContact CB-CG 3.96Å; L48-L53 HydrophobicContact CD1-CD2 4Å; L48-L53 HydrophobicContact CG-CD2 4.48Å; P49-L53 PolarHBondContact O-N 3.13Å; S50-L53 PolarHBondContact O-N 3.24Å; L53-F57 WeakPolarHBondContact O-CB 3.18Å; L53-F57 PolarHBondContact O-N 3.36Å; L53-F86 HydrophobicContact CD2-CD1 4.42Å; L53-F86 HydrophobicContact CD2-CE1 3.85Å; L53-C89 HydrophobicContact CD1-CB 3.79Å; L53-V90 HydrophobicContact CB-CG1 4.03Å
54Q94.8Very high92.4Very high10 Ų1042.8 Ų42.85%0.04726%0.258CS..Hα-helixtrans-58.4-54.6174.2-17471.137.200111.1S50 G51 V52 V56 F57 S58 P91 K92 E95S50-Q54 PolarHBondContact O-N 3.13Å; G51-Q54 WeakPolarHBondContact O-CB 3.45Å; G51-Q54 PolarHBondContact O-N 3.16Å; V52-Q54 VanDerWaalsContact C-N 3.28Å; V52-Q54 PolarHBondContact O-N 3.11Å; Q54-V56 VanDerWaalsContact C-N 3.33Å; Q54-V56 PolarHBondContact O-N 2.96Å; Q54-F57 PolarHBondContact O-N 3.15Å; Q54-S58 PolarHBondContact O-N 3.45Å; Q54-S58 PolarHBondContact O-OG 3Å; Q54-S58 VanDerWaalsContact O-OG 3.13Å; Q54-P91 HydrophobicContact CB-CG 4.22Å; Q54-K92 PolarHBondContact NE2-O 3.41Å; Q54-K92 PolarHBondContact OE1-O 3.47Å; Q54-E95 PolarHBondContact NE2-OE2 3.3Å
55E93.7Very high92.8Very high75 Ų7542.4 Ų42.435%0.3526%0.255SS..Hα-helixtrans-64.2-39.3-177.1-64.4-62.5150.200111.9Q7 A10 V52 S59Q7-E55 HydrophobicContact CG-CG 4.34Å; A10-E55 HydrophobicContact CB-CB 3.51Å; A10-E55 HydrophobicContact CB-CG 4.39Å; V52-E55 PolarHBondContact O-N 3.07Å; E55-S59 PolarHBondContact O-N 3.08Å; E55-S59 PolarHBondContact O-OG 2.9Å
56V93.9Very high92.9Very high0 Ų044.3 Ų44.30%026%0.259CS..Hα-helixtrans-64.1-46.6173.9172.80000110.6A10 V13 L14 T43 V52 Q54 S58 S59 L60 F86A10-V56 HydrophobicContact CB-CG2 3.92Å; V13-V56 HydrophobicContact CB-CG2 4.12Å; V13-V56 HydrophobicContact CG1-CG1 4.44Å; V13-V56 HydrophobicContact CG1-CG2 4Å; L14-V56 HydrophobicContact CD2-CG1 4.37Å; L14-V56 HydrophobicContact CG-CG2 4.42Å; T43-V56 HydrophobicContact CG2-CG1 3.83Å; V52-V56 HydrophobicContact CG1-CG2 4.32Å; V52-V56 VanDerWaalsContact O-CG2 3.3Å; V52-V56 WeakPolarHBondContact O-CG2 3.34Å; V52-V56 PolarHBondContact O-N 3.16Å; Q54-V56 VanDerWaalsContact C-N 3.33Å; Q54-V56 PolarHBondContact O-N 2.96Å; V56-S58 PolarHBondContact O-N 2.65Å; V56-S59 PolarHBondContact O-N 3.02Å; V56-L60 HydrophobicContact CG1-CD1 3.58Å; V56-L60 HydrophobicContact CG1-CG 4.13Å; V56-L60 WeakPolarHBondContact O-CB 3.45Å; V56-L60 VanDerWaalsContact O-CG 3.3Å; V56-L60 WeakPolarHBondContact O-CG 3.24Å; V56-L60 PolarHBondContact O-N 3.2Å; V56-F86 HydrophobicContact CG1-CE1 4.3Å; V56-F86 HydrophobicContact CG1-CZ 4.15Å
57F95.4Very high93.1Very high2 Ų238.8 Ų38.81%0.00924%0.236CC..Hα-helixtrans-62.9-43.6-179.2-176.2-137.3000112L53 Q54 S59 L60 L61 I83 F86 I87 V90 A96L53-F57 WeakPolarHBondContact O-CB 3.18Å; L53-F57 PolarHBondContact O-N 3.36Å; Q54-F57 PolarHBondContact O-N 3.15Å; F57-S59 PolarHBondContact O-N 2.94Å; F57-L60 CarbonylContact O-C 3.59Å; F57-L60 PolarHBondContact O-N 3.28Å; F57-L61 HydrophobicContact CE2-CB 4.45Å; F57-L61 HydrophobicContact CE2-CD1 3.85Å; F57-L61 HydrophobicContact CZ-CD1 3.8Å; F57-L61 WeakPolarHBondContact O-CB 3.31Å; F57-L61 PolarHBondContact O-N 2.86Å; F57-I83 HydrophobicContact CZ-CG2 4.35Å; F57-F86 HydrophobicContact CB-CB 4.35Å; F57-F86 HydrophobicContact CB-CD1 3.64Å; F57-F86 HydrophobicContact CB-CE1 4.01Å; F57-F86 HydrophobicContact CB-CG 4.01Å; F57-F86 HydrophobicContact CD1-CB 4.1Å; F57-F86 HydrophobicContact CD2-CB 3.47Å; F57-F86 VanDerWaalsContact CD2-CB 3.47Å; F57-F86 AromaticContact CD2-CD1 3.99Å; F57-F86 HydrophobicContact CD2-CD1 3.99Å; F57-F86 AromaticContact CD2-CD2 3.61Å; F57-F86 HydrophobicContact CD2-CD2 3.61Å; F57-F86 HydrophobicContact CD2-CE2 4.3Å; F57-F86 AromaticContact CD2-CG 3.43Å; F57-F86 HydrophobicContact CD2-CG 3.43Å; F57-F86 VanDerWaalsContact CD2-CG 3.43Å; F57-F86 HydrophobicContact CE1-CB 4.21Å; F57-F86 HydrophobicContact CE2-CB 3.63Å; F57-F86 HydrophobicContact CE2-CD2 4.07Å; F57-F86 HydrophobicContact CE2-CG 4.01Å; F57-F86 HydrophobicContact CG-CB 3.72Å; F57-F86 AromaticContact CG-CD1 3.95Å; F57-F86 HydrophobicContact CG-CD1 3.95Å; F57-F86 HydrophobicContact CG-CD2 4.39Å; F57-F86 AromaticContact CG-CG 3.8Å; F57-F86 HydrophobicContact CG-CG 3.8Å; F57-F86 HydrophobicContact CZ-CB 4Å; F57-I87 HydrophobicContact CE1-CD1 3.71Å; F57-I87 HydrophobicContact CE1-CG1 4.31Å; F57-I87 HydrophobicContact CZ-CD1 3.92Å; F57-I87 HydrophobicContact CZ-CG1 4.16Å; F57-V90 HydrophobicContact CB-CG1 4.2Å; F57-V90 HydrophobicContact CD1-CG1 4.26Å; F57-V90 HydrophobicContact CD1-CG2 4.38Å; F57-A96 HydrophobicContact CE1-CB 3.59Å; F57-A96 HydrophobicContact CZ-CB 4.03Å
58S93.4Very high93.5Very high59 Ų5935.8 Ų35.841%0.41320%0.203SC..Hα-helixtrans-55.5-36176-67.10000112.7Q54 V56Q54-S58 PolarHBondContact O-N 3.45Å; Q54-S58 PolarHBondContact O-OG 3Å; Q54-S58 VanDerWaalsContact O-OG 3.13Å; V56-S58 PolarHBondContact O-N 2.65Å
59S91.8Very high93.5Very high64 Ų6438.1 Ų38.145%0.44822%0.222SC..Hα-helixtrans-79.9-31.9176.9-60.20000113.2E55 V56 F57E55-S59 PolarHBondContact O-N 3.08Å; E55-S59 PolarHBondContact O-OG 2.9Å; V56-S59 PolarHBondContact O-N 3.02Å; F57-S59 PolarHBondContact O-N 2.94Å
60L94.1Very high93.6Very high0 Ų035 Ų350%020%0.201CC..Hα-helixtrans-87.1-20.9-177.5-70.1-176.8000114.4L14 I17 L21 I39 T43 V56 F57 K62 P63 L64 F86L14-L60 HydrophobicContact CD2-CD2 4.47Å; L14-L60 HydrophobicContact CD2-CG 4.44Å; I17-L60 HydrophobicContact CD1-CD1 3.8Å; I17-L60 HydrophobicContact CD1-CD2 3.78Å; I17-L60 HydrophobicContact CD1-CG 4.21Å; L21-L60 HydrophobicContact CD1-CD2 3.78Å; L21-L60 HydrophobicContact CD2-CD2 3.35Å; L21-L60 HydrophobicContact CG-CD2 3.9Å; I39-L60 HydrophobicContact CG2-CD1 4Å; T43-L60 HydrophobicContact CG2-CD1 4.04Å; V56-L60 HydrophobicContact CG1-CD1 3.58Å; V56-L60 HydrophobicContact CG1-CG 4.13Å; V56-L60 WeakPolarHBondContact O-CB 3.45Å; V56-L60 VanDerWaalsContact O-CG 3.3Å; V56-L60 WeakPolarHBondContact O-CG 3.24Å; V56-L60 PolarHBondContact O-N 3.2Å; F57-L60 CarbonylContact O-C 3.59Å; F57-L60 PolarHBondContact O-N 3.28Å; L60-K62 PolarHBondContact O-N 3.24Å; L60-P63 VanDerWaalsContact O-CD 3.22Å; L60-P63 WeakPolarHBondContact O-CD 3.18Å; L60-L64 HydrophobicContact CB-CD1 3.92Å; L60-L64 HydrophobicContact CB-CG 4.4Å; L60-L64 WeakPolarHBondContact O-CB 3.43Å; L60-L64 VanDerWaalsContact O-CG 3.26Å; L60-L64 WeakPolarHBondContact O-CG 3.36Å; L60-L64 PolarHBondContact O-N 2.93Å; L60-F86 HydrophobicContact CD1-CE2 4.08Å; L60-F86 HydrophobicContact CD1-CZ 3.84Å
61L94.8Very high93.6Very high5 Ų537.3 Ų37.33%0.02622%0.215CC..Hα-helixtrans-55.9-53.4-170.5179.260.5000112.2F57 L64 L65 A96 Y99F57-L61 HydrophobicContact CE2-CB 4.45Å; F57-L61 HydrophobicContact CE2-CD1 3.85Å; F57-L61 HydrophobicContact CZ-CD1 3.8Å; F57-L61 WeakPolarHBondContact O-CB 3.31Å; F57-L61 PolarHBondContact O-N 2.86Å; L61-L64 PolarHBondContact O-N 3.16Å; L61-L65 HydrophobicContact CD1-CD1 3.85Å; L61-L65 HydrophobicContact CD1-CD2 4.28Å; L61-L65 HydrophobicContact CD1-CG 3.91Å; L61-L65 HydrophobicContact CG-CD1 3.83Å; L61-L65 HydrophobicContact CG-CG 4.29Å; L61-L65 WeakPolarHBondContact O-CB 3.27Å; L61-L65 VanDerWaalsContact O-CG 3.23Å; L61-L65 WeakPolarHBondContact O-CG 3.48Å; L61-L65 PolarHBondContact O-N 3.01Å; L61-A96 HydrophobicContact CD1-CB 4.43Å; L61-A96 HydrophobicContact CD2-CB 3.65Å; L61-Y99 HydrophobicContact CD2-CD2 4.09Å
62K94.6Very high93.7Very high117 Ų11738 Ų3851%0.50922%0.215SC..Hα-helixtrans-62-47.8-179-65.7175.2-176.61740112.9L60 L64 L65 K66 Y99L60-K62 PolarHBondContact O-N 3.24Å; K62-L64 VanDerWaalsContact C-N 3.33Å; K62-L64 PolarHBondContact O-N 3.35Å; K62-L65 PolarHBondContact O-N 3.27Å; K62-K66 PolarHBondContact O-N 3.32Å; K62-K66 VanDerWaalsContact O-N 3.16Å; K62-Y99 PolarHBondContact NZ-OH 3.05Å; K62-Y99 VanDerWaalsContact NZ-OH 3.13Å
63P93.9Very high93.8Very high47 Ų4742 Ų4231%0.30523%0.233SC..Hα-helixtrans-53.6-45.6171.5-27.731.7000113.7L21 L24 L60 K66 C67L21-P63 HydrophobicContact CD2-CB 3.95Å; L21-P63 HydrophobicContact CD2-CG 4.16Å; L24-P63 HydrophobicContact CD1-CB 4.29Å; L60-P63 VanDerWaalsContact O-CD 3.22Å; L60-P63 WeakPolarHBondContact O-CD 3.18Å; P63-K66 WeakPolarHBondContact O-CB 3.19Å; P63-K66 PolarHBondContact O-N 3.22Å; P63-C67 PolarHBondContact O-N 3.46Å; P63-C67 PolarHBondContact O-SG 2.64Å
64L95.1Very high93.8Very high0 Ų045.4 Ų45.40%025%0.248CC..Hα-helixtrans-66-45.2179.6-69170.9000111.4L36 L60 L61 K62 K66 C67 L68 T79 I82 I83 F86L36-L64 HydrophobicContact CD2-CD2 3.94Å; L60-L64 HydrophobicContact CB-CD1 3.92Å; L60-L64 HydrophobicContact CB-CG 4.4Å; L60-L64 WeakPolarHBondContact O-CB 3.43Å; L60-L64 VanDerWaalsContact O-CG 3.26Å; L60-L64 WeakPolarHBondContact O-CG 3.36Å; L60-L64 PolarHBondContact O-N 2.93Å; L61-L64 PolarHBondContact O-N 3.16Å; K62-L64 VanDerWaalsContact C-N 3.33Å; K62-L64 PolarHBondContact O-N 3.35Å; L64-K66 PolarHBondContact O-N 2.98Å; L64-C67 WeakPolarHBondContact O-CA 3.34Å; L64-C67 WeakPolarHBondContact O-CB 3.38Å; L64-C67 PolarHBondContact O-N 2.95Å; L64-L68 PolarHBondContact O-N 3.28Å; L64-T79 HydrophobicContact CB-CG2 4.15Å; L64-T79 HydrophobicContact CD2-CG2 4.49Å; L64-T79 WeakPolarHBondContact O-CG2 3.36Å; L64-I82 HydrophobicContact CD1-CG2 3.67Å; L64-I82 HydrophobicContact CD2-CD1 4.22Å; L64-I82 HydrophobicContact CD2-CG2 4.13Å; L64-I83 HydrophobicContact CB-CD1 4.18Å; L64-I83 HydrophobicContact CB-CG1 4.15Å; L64-I83 HydrophobicContact CD1-CG1 4.26Å; L64-F86 HydrophobicContact CD1-CE2 4.4Å
65L95.1Very high93.8Very high11 Ų1145 Ų456%0.05825%0.246CC..Hα-helixtrans-57.8-35.6177.7-69.8173.6000112.3L61 K62 C67 L68 I83 Y99 L100 C103L61-L65 HydrophobicContact CD1-CD1 3.85Å; L61-L65 HydrophobicContact CD1-CD2 4.28Å; L61-L65 HydrophobicContact CD1-CG 3.91Å; L61-L65 HydrophobicContact CG-CD1 3.83Å; L61-L65 HydrophobicContact CG-CG 4.29Å; L61-L65 WeakPolarHBondContact O-CB 3.27Å; L61-L65 VanDerWaalsContact O-CG 3.23Å; L61-L65 WeakPolarHBondContact O-CG 3.48Å; L61-L65 PolarHBondContact O-N 3.01Å; K62-L65 PolarHBondContact O-N 3.27Å; L65-C67 VanDerWaalsContact C-N 3.3Å; L65-C67 PolarHBondContact O-N 3.4Å; L65-L68 HydrophobicContact CD2-CD1 3.82Å; L65-L68 VanDerWaalsContact O-CB 3.31Å; L65-L68 WeakPolarHBondContact O-CB 3.44Å; L65-L68 PolarHBondContact O-N 3.42Å; L65-I83 HydrophobicContact CD2-CD1 4.08Å; L65-Y99 WeakPolarHBondContact CD1-O 3.36Å; L65-L100 HydrophobicContact CD2-CD1 3.68Å; L65-C103 HydrophobicContact CD1-CB 4.43Å; L65-C103 HydrophobicContact CD2-CB 4Å
66K93.4Very high93.8Very high139 Ų13942.2 Ų42.260%0.60423%0.232SC*.Hα-helixtrans-62.8-36.9173.6-169.7-177.2177.3-170.60112.2N25 K62 P63 L64 L68 S69N25-K66 PolarHBondContact OD1-NZ 2.72Å; K62-K66 PolarHBondContact O-N 3.32Å; K62-K66 VanDerWaalsContact O-N 3.16Å; P63-K66 WeakPolarHBondContact O-CB 3.19Å; P63-K66 PolarHBondContact O-N 3.22Å; L64-K66 PolarHBondContact O-N 2.98Å; K66-L68 PolarHBondContact O-N 3.31Å; K66-S69 PolarHBondContact O-N 2.86Å
67C94.4Very high94Very high8 Ų845.5 Ų45.55%0.05425%0.247CC..Hα-helixtrans-70-14.3177.6-65.20000113.7P63 L64 L65 S69 D70 T79P63-C67 PolarHBondContact O-N 3.46Å; P63-C67 PolarHBondContact O-SG 2.64Å; L64-C67 WeakPolarHBondContact O-CA 3.34Å; L64-C67 WeakPolarHBondContact O-CB 3.38Å; L64-C67 PolarHBondContact O-N 2.95Å; L65-C67 VanDerWaalsContact C-N 3.3Å; L65-C67 PolarHBondContact O-N 3.4Å; C67-S69 PolarHBondContact O-N 3.26Å; C67-D70 VanDerWaalsContact O-CB 3.29Å; C67-D70 WeakPolarHBondContact O-CB 3.45Å; C67-D70 PolarHBondContact O-N 2.88Å; C67-D70 VanDerWaalsContact O-N 3.1Å; C67-T79 HydrophobicContact CB-CG2 3.99Å; C67-T79 VanDerWaalsContact CB-OG1 3.27Å; C67-T79 WeakPolarHBondContact CB-OG1 3.39Å
68L92.6Very high93.9Very high6 Ų645.7 Ų45.73%0.03125%0.249CC..THydrogen-bonded Turntrans-61.9-24.1169.6-64.4177.2000111.8L64 L65 K66 R76 T79 I80 I83 L104 R107L64-L68 PolarHBondContact O-N 3.28Å; L65-L68 HydrophobicContact CD2-CD1 3.82Å; L65-L68 VanDerWaalsContact O-CB 3.31Å; L65-L68 WeakPolarHBondContact O-CB 3.44Å; L65-L68 PolarHBondContact O-N 3.42Å; K66-L68 PolarHBondContact O-N 3.31Å; L68-R76 WeakPolarHBondContact O-CD 3.49Å; L68-R76 WeakPolarHBondContact O-CG 3.5Å; L68-T79 HydrophobicContact CD2-CG2 3.64Å; L68-T79 HydrophobicContact CG-CG2 4Å; L68-I80 HydrophobicContact CD2-CD1 4.45Å; L68-I80 HydrophobicContact CD2-CG1 3.55Å; L68-I83 HydrophobicContact CD1-CD1 4.42Å; L68-I83 HydrophobicContact CD2-CD1 4.42Å; L68-L104 HydrophobicContact CD1-CD2 4.46Å; L68-R107 PolarHBondContact O-NE 3.36Å; L68-R107 VanDerWaalsContact O-NE 3.12Å; L68-R107 PolarHBondContact O-NH1 2.91Å; L68-R107 PolarHBondContact O-NH2 3.3Å
69S91.7Very high94.1Very high84 Ų8442.9 Ų42.959%0.58723%0.229SC*.THydrogen-bonded Turntrans-99.516175.7-63.10000113.8K66 C67 R107K66-S69 PolarHBondContact O-N 2.86Å; C67-S69 PolarHBondContact O-N 3.26Å; S69-R107 PolarHBondContact OG-NH1 2.88Å; S69-R107 VanDerWaalsContact OG-NH1 3.17Å
70D93.8Very high94.3Very high12 Ų1240.1 Ų40.16%0.06421%0.209CC..  trans-61.4138.1175.5-163.4-62.6000110.4R32 C67 T72 C75 R76R32-D70 WeakPolarHBondContact CD-OD2 3.36Å; R32-D70 IonicContact CZ-OD1 3.6Å; R32-D70 IonicContact CZ-OD2 3.84Å; R32-D70 IonicContact NE-OD1 3.64Å; R32-D70 IonicContact NE-OD2 2.72Å; R32-D70 PolarHBondContact NE-OD2 3.19Å; R32-D70 IonicContact NH2-OD1 2.71Å; R32-D70 PolarHBondContact NH2-OD1 3.31Å; R32-D70 IonicContact NH2-OD2 3.68Å; R32-D70 PolarHBondContact NH2-OD2 3.37Å; C67-D70 VanDerWaalsContact O-CB 3.29Å; C67-D70 WeakPolarHBondContact O-CB 3.45Å; C67-D70 PolarHBondContact O-N 2.88Å; C67-D70 VanDerWaalsContact O-N 3.1Å; D70-T72 PolarHBondContact O-N 3.35Å; D70-T72 WeakPolarHBondContact OD1-CA 3.37Å; D70-T72 WeakPolarHBondContact OD1-CB 3.36Å; D70-T72 PolarHBondContact OD1-N 3.44Å; D70-T72 PolarHBondContact OD1-OG1 3.47Å; D70-T72 VanDerWaalsContact OD1-OG1 3.11Å; D70-C75 HydrophobicContact CB-CB 3.87Å; D70-R76 HydrophobicContact CB-CG 4.15Å; D70-R76 VanDerWaalsContact O-CD 3.27Å; D70-R76 WeakPolarHBondContact O-CD 3.47Å; D70-R76 WeakPolarHBondContact O-CG 3.28Å; D70-R76 PolarHBondContact O-NH1 2.99Å
71P91.3Very high94.4Very high112 Ų11241.3 Ų41.373%0.72722%0.219SC*.SBendtrans-61.2-24.3174.324.7-35.5000113.1R76P71-R76 PolarHBondContact O-NH1 3.36Å; P71-R76 VanDerWaalsContact O-NH1 3.15Å
72T93.4Very high94.5Very high34 Ų3441.1 Ų41.121%0.20922%0.218CC..SBendtrans-86.4116.5-179.2-47.80000111K29 R32 D70 K74 C75 R76K29-T72 HydrophobicContact CB-CG2 4.49Å; K29-T72 WeakPolarHBondContact CB-OG1 3.5Å; R32-T72 PolarHBondContact NH2-OG1 3.13Å; D70-T72 PolarHBondContact O-N 3.35Å; D70-T72 WeakPolarHBondContact OD1-CA 3.37Å; D70-T72 WeakPolarHBondContact OD1-CB 3.36Å; D70-T72 PolarHBondContact OD1-N 3.44Å; D70-T72 PolarHBondContact OD1-OG1 3.47Å; D70-T72 VanDerWaalsContact OD1-OG1 3.11Å; T72-K74 VanDerWaalsContact C-N 3.34Å; T72-K74 HydrophobicContact CG2-CB 4.48Å; T72-K74 PolarHBondContact O-N 3.32Å; T72-C75 WeakPolarHBondContact O-CB 3.47Å; T72-C75 PolarHBondContact O-N 2.94Å; T72-R76 PolarHBondContact O-N 3.41Å
73E93.8Very high94.7Very high89 Ų8935.5 Ų35.542%0.41619%0.194SC..Hα-helixtrans-52.1-47.5178.6-173.1172.317200113.3C75 R76 E77 S117 L120E73-C75 PolarHBondContact O-N 3.36Å; E73-R76 WeakPolarHBondContact O-CB 3.21Å; E73-R76 PolarHBondContact O-N 3.37Å; E73-E77 PolarHBondContact O-N 3.47Å; E73-S117 VanDerWaalsContact OE1-CB 3.26Å; E73-S117 WeakPolarHBondContact OE1-CB 3.38Å; E73-S117 PolarHBondContact OE1-OG 3.32Å; E73-L120 HydrophobicContact CG-CD1 3.38Å; E73-L120 WeakPolarHBondContact OE1-CD1 3.35Å
74K94.3Very high94.8Very high80 Ų8033.9 Ų33.935%0.34818%0.183SC..Hα-helixtrans-61.1-31.2179.8-166.767.9-163.9170.20113.5K33 T72 E77 T78K33-K74 HydrophobicContact CD-CG 3.95Å; K33-K74 HydrophobicContact CG-CG 4.41Å; T72-K74 VanDerWaalsContact C-N 3.34Å; T72-K74 HydrophobicContact CG2-CB 4.48Å; T72-K74 PolarHBondContact O-N 3.32Å; K74-E77 WeakPolarHBondContact CD-OE2 3.41Å; K74-E77 WeakPolarHBondContact CE-OE2 3.48Å; K74-E77 IonicContact NZ-OE1 3.08Å; K74-E77 PolarHBondContact NZ-OE1 3.47Å; K74-E77 IonicContact NZ-OE2 3.65Å; K74-E77 PolarHBondContact NZ-OE2 3.27Å; K74-T78 WeakPolarHBondContact O-CB 3.42Å; K74-T78 PolarHBondContact O-N 3.22Å; K74-T78 PolarHBondContact O-OG1 3.14Å
75C94.7Very high94.9Very high0 Ų035.6 Ų35.60%019%0.191CC..Hα-helixtrans-69.1-44.3174.9-67.60000110.5L36 D70 T72 E73 T78 T79L36-C75 HydrophobicContact CD1-CB 3.7Å; L36-C75 WeakPolarHBondContact CD1-O 3.42Å; D70-C75 HydrophobicContact CB-CB 3.87Å; T72-C75 WeakPolarHBondContact O-CB 3.47Å; T72-C75 PolarHBondContact O-N 2.94Å; E73-C75 PolarHBondContact O-N 3.36Å; C75-T78 PolarHBondContact O-N 2.97Å; C75-T79 WeakPolarHBondContact O-CB 3.34Å; C75-T79 PolarHBondContact O-N 2.94Å; C75-T79 PolarHBondContact O-OG1 3.23Å
76R95.3Very high95Very high17 Ų1735.1 Ų35.16%0.06419%0.188CC..Hα-helixtrans-61-46.1175.7-58.8-164.6-64.1-89.65.2111.4L68 D70 P71 T72 E73 T78 T79 I80 E115 L120L68-R76 WeakPolarHBondContact O-CD 3.49Å; L68-R76 WeakPolarHBondContact O-CG 3.5Å; D70-R76 HydrophobicContact CB-CG 4.15Å; D70-R76 VanDerWaalsContact O-CD 3.27Å; D70-R76 WeakPolarHBondContact O-CD 3.47Å; D70-R76 WeakPolarHBondContact O-CG 3.28Å; D70-R76 PolarHBondContact O-NH1 2.99Å; P71-R76 PolarHBondContact O-NH1 3.36Å; P71-R76 VanDerWaalsContact O-NH1 3.15Å; T72-R76 PolarHBondContact O-N 3.41Å; E73-R76 WeakPolarHBondContact O-CB 3.21Å; E73-R76 PolarHBondContact O-N 3.37Å; R76-T78 PolarHBondContact O-N 3.49Å; R76-T79 WeakPolarHBondContact O-CB 3.3Å; R76-T79 PolarHBondContact O-N 2.93Å; R76-I80 WeakPolarHBondContact O-CG1 3.49Å; R76-I80 PolarHBondContact O-N 2.97Å; R76-E115 WeakPolarHBondContact CD-OE2 3.12Å; R76-E115 IonicContact CZ-OE1 3.69Å; R76-E115 IonicContact CZ-OE2 2.92Å; R76-E115 IonicContact NE-OE1 3.76Å; R76-E115 PolarHBondContact NE-OE1 2.89Å; R76-E115 IonicContact NE-OE2 3.25Å; R76-E115 PolarHBondContact NE-OE2 2.94Å; R76-E115 IonicContact NH2-OE1 2.82Å; R76-E115 PolarHBondContact NH2-OE1 3.26Å; R76-E115 IonicContact NH2-OE2 3.42Å; R76-L120 HydrophobicContact CB-CD2 3.39Å
77E96.2Very high95.1Very high69 Ų6928.6 Ų28.632%0.32216%0.16SC..Hα-helixtrans-60-49.5179.3-173.5-157.7143.300111E73 K74 T79 I80 A81 L120E73-E77 PolarHBondContact O-N 3.47Å; K74-E77 WeakPolarHBondContact CD-OE2 3.41Å; K74-E77 WeakPolarHBondContact CE-OE2 3.48Å; K74-E77 IonicContact NZ-OE1 3.08Å; K74-E77 PolarHBondContact NZ-OE1 3.47Å; K74-E77 IonicContact NZ-OE2 3.65Å; K74-E77 PolarHBondContact NZ-OE2 3.27Å; E77-T79 VanDerWaalsContact C-N 3.25Å; E77-T79 PolarHBondContact O-N 3.43Å; E77-I80 PolarHBondContact O-N 3.16Å; E77-A81 PolarHBondContact O-N 3.38Å; E77-L120 HydrophobicContact CB-CD1 4.48Å; E77-L120 HydrophobicContact CB-CD2 4.03Å; E77-L120 HydrophobicContact CB-CG 4.28Å; E77-L120 VanDerWaalsContact N-CD2 3.3Å
78T95.3Very high95.2Very high6 Ų635.6 Ų35.64%0.03719%0.186CC..Hα-helixtrans-63.1-35.5178.8-51.20000111.2L36 K74 C75 R76 A81 I82L36-T78 HydrophobicContact CB-CG2 3.84Å; K74-T78 WeakPolarHBondContact O-CB 3.42Å; K74-T78 PolarHBondContact O-N 3.22Å; K74-T78 PolarHBondContact O-OG1 3.14Å; C75-T78 PolarHBondContact O-N 2.97Å; R76-T78 PolarHBondContact O-N 3.49Å; T78-A81 PolarHBondContact O-N 3.32Å; T78-I82 HydrophobicContact CG2-CD1 4.06Å; T78-I82 HydrophobicContact CG2-CG1 4.5Å; T78-I82 WeakPolarHBondContact O-CD1 3.48Å; T78-I82 WeakPolarHBondContact O-CG1 3.26Å; T78-I82 PolarHBondContact O-N 3.38Å
79T96.4Very high95.2Very high0 Ų038.1 Ų38.10%020%0.203CC..Hα-helixtrans-64.8-48.3176.7-60.20000111.6L64 C67 L68 C75 R76 E77 A81 I82 I83L64-T79 HydrophobicContact CB-CG2 4.15Å; L64-T79 HydrophobicContact CD2-CG2 4.49Å; L64-T79 WeakPolarHBondContact O-CG2 3.36Å; C67-T79 HydrophobicContact CB-CG2 3.99Å; C67-T79 VanDerWaalsContact CB-OG1 3.27Å; C67-T79 WeakPolarHBondContact CB-OG1 3.39Å; L68-T79 HydrophobicContact CD2-CG2 3.64Å; L68-T79 HydrophobicContact CG-CG2 4Å; C75-T79 WeakPolarHBondContact O-CB 3.34Å; C75-T79 PolarHBondContact O-N 2.94Å; C75-T79 PolarHBondContact O-OG1 3.23Å; R76-T79 WeakPolarHBondContact O-CB 3.3Å; R76-T79 PolarHBondContact O-N 2.93Å; E77-T79 VanDerWaalsContact C-N 3.25Å; E77-T79 PolarHBondContact O-N 3.43Å; T79-A81 VanDerWaalsContact C-N 3.28Å; T79-A81 PolarHBondContact O-N 3.39Å; T79-I82 PolarHBondContact O-N 2.84Å; T79-I83 HydrophobicContact CG2-CD1 3.96Å; T79-I83 WeakPolarHBondContact O-CG1 3.26Å; T79-I83 PolarHBondContact O-N 2.93Å
80I96.7Very high95.4Very high6 Ų634.6 Ų34.63%0.03118%0.178CC..Hα-helixtrans-58.7-44.2176.2-64.4171.6000109.9L68 R76 E77 I82 I83 T84 L120 A124 L127L68-I80 HydrophobicContact CD2-CD1 4.45Å; L68-I80 HydrophobicContact CD2-CG1 3.55Å; R76-I80 WeakPolarHBondContact O-CG1 3.49Å; R76-I80 PolarHBondContact O-N 2.97Å; E77-I80 PolarHBondContact O-N 3.16Å; I80-I82 PolarHBondContact O-N 2.74Å; I80-I83 PolarHBondContact O-N 3.48Å; I80-T84 WeakPolarHBondContact O-CB 3.22Å; I80-T84 PolarHBondContact O-N 3.13Å; I80-T84 PolarHBondContact O-OG1 2.89Å; I80-L120 HydrophobicContact CD1-CB 4.35Å; I80-L120 HydrophobicContact CD1-CD2 4.05Å; I80-L120 HydrophobicContact CD1-CG 4.49Å; I80-A124 HydrophobicContact CD1-CB 4.34Å; I80-L127 HydrophobicContact CG2-CB 4.42Å; I80-L127 HydrophobicContact CG2-CD2 4.36Å
81A96.7Very high95.4Very high26 Ų2637.6 Ų37.622%0.21520%0.198CC..Hα-helixtrans-60-45.7177.800000112.5E77 T78 T79 T84 E85E77-A81 PolarHBondContact O-N 3.38Å; T78-A81 PolarHBondContact O-N 3.32Å; T79-A81 VanDerWaalsContact C-N 3.28Å; T79-A81 PolarHBondContact O-N 3.39Å; A81-T84 PolarHBondContact O-N 3.4Å; A81-E85 WeakPolarHBondContact O-CB 3.37Å; A81-E85 WeakPolarHBondContact O-CG 3.37Å; A81-E85 PolarHBondContact O-N 3.38Å
82I96.3Very high95.6Very high0 Ų037.1 Ų37.10%018%0.184CC..Hα-helixtrans-60.9-49.5177.3-69.1164000110.7L36 R40 L64 T78 T79 I80 T84 E85 F86L36-I82 HydrophobicContact CB-CD1 4.32Å; L36-I82 HydrophobicContact CD2-CD1 4.13Å; L36-I82 WeakPolarHBondContact O-CD1 3.45Å; R40-I82 HydrophobicContact CB-CD1 3.95Å; R40-I82 HydrophobicContact CB-CG1 3.68Å; R40-I82 HydrophobicContact CG-CG1 3.78Å; L64-I82 HydrophobicContact CD1-CG2 3.67Å; L64-I82 HydrophobicContact CD2-CD1 4.22Å; L64-I82 HydrophobicContact CD2-CG2 4.13Å; T78-I82 HydrophobicContact CG2-CD1 4.06Å; T78-I82 HydrophobicContact CG2-CG1 4.5Å; T78-I82 WeakPolarHBondContact O-CD1 3.48Å; T78-I82 WeakPolarHBondContact O-CG1 3.26Å; T78-I82 PolarHBondContact O-N 3.38Å; T79-I82 PolarHBondContact O-N 2.84Å; I80-I82 PolarHBondContact O-N 2.74Å; I82-T84 VanDerWaalsContact C-N 3.3Å; I82-T84 PolarHBondContact O-N 2.9Å; I82-E85 PolarHBondContact O-N 3.49Å; I82-F86 HydrophobicContact CG2-CD2 3.58Å; I82-F86 HydrophobicContact CG2-CE2 3.45Å; I82-F86 VanDerWaalsContact CG2-CE2 3.45Å; I82-F86 VanDerWaalsContact O-CD2 3.24Å; I82-F86 WeakPolarHBondContact O-CD2 3.44Å; I82-F86 PolarHBondContact O-N 3.41Å
83I97.4Very high95.8Very high0 Ų036 Ų360%018%0.178CC..Hα-helixtrans-60.1-44.2179.9-66.2170.4000110.1F57 L64 L65 L68 T79 I80 E85 F86 I87 L100 L127F57-I83 HydrophobicContact CZ-CG2 4.35Å; L64-I83 HydrophobicContact CB-CD1 4.18Å; L64-I83 HydrophobicContact CB-CG1 4.15Å; L64-I83 HydrophobicContact CD1-CG1 4.26Å; L65-I83 HydrophobicContact CD2-CD1 4.08Å; L68-I83 HydrophobicContact CD1-CD1 4.42Å; L68-I83 HydrophobicContact CD2-CD1 4.42Å; T79-I83 HydrophobicContact CG2-CD1 3.96Å; T79-I83 WeakPolarHBondContact O-CG1 3.26Å; T79-I83 PolarHBondContact O-N 2.93Å; I80-I83 PolarHBondContact O-N 3.48Å; I83-E85 PolarHBondContact O-N 3.46Å; I83-F86 PolarHBondContact O-N 2.74Å; I83-I87 HydrophobicContact CG2-CG1 4.31Å; I83-I87 VanDerWaalsContact O-CG1 3.3Å; I83-I87 WeakPolarHBondContact O-CG1 3.23Å; I83-I87 PolarHBondContact O-N 3.16Å; I83-L100 HydrophobicContact CG2-CD1 4.14Å; I83-L127 HydrophobicContact CB-CD2 4.45Å; I83-L127 HydrophobicContact CG2-CD1 4.05Å; I83-L127 HydrophobicContact CG2-CD2 3.92Å
84T97.4Very high95.9Very high12 Ų1234.5 Ų34.57%0.07417%0.171CC..Hα-helixtrans-60-46.1178-54.30000111.5I80 A81 I82 F86 I87 R88 L130I80-T84 WeakPolarHBondContact O-CB 3.22Å; I80-T84 PolarHBondContact O-N 3.13Å; I80-T84 PolarHBondContact O-OG1 2.89Å; A81-T84 PolarHBondContact O-N 3.4Å; I82-T84 VanDerWaalsContact C-N 3.3Å; I82-T84 PolarHBondContact O-N 2.9Å; T84-F86 PolarHBondContact O-N 2.94Å; T84-I87 PolarHBondContact O-N 3.2Å; T84-R88 WeakPolarHBondContact O-CG 3.37Å; T84-R88 PolarHBondContact O-N 3.1Å; T84-R88 VanDerWaalsContact O-N 3.11Å; T84-L130 HydrophobicContact CG2-CD2 3.67Å
85E96.2Very high96Very high37 Ų3734.9 Ų34.917%0.17317%0.174CC..Hα-helixtrans-63.6-39.9177.8-75171.9174.300112.3R40 V44 A81 I82 I83 R88 C89R40-E85 IonicContact CZ-OE1 2.54Å; R40-E85 IonicContact CZ-OE2 3.87Å; R40-E85 IonicContact NE-OE1 3.56Å; R40-E85 PolarHBondContact NE-OE1 3.17Å; R40-E85 IonicContact NE-OE2 2.79Å; R40-E85 PolarHBondContact NE-OE2 3.46Å; R40-E85 IonicContact NH2-OE1 3.6Å; R40-E85 PolarHBondContact NH2-OE1 2.93Å; R40-E85 IonicContact NH2-OE2 2.7Å; V44-E85 HydrophobicContact CB-CB 3.93Å; V44-E85 HydrophobicContact CG1-CB 3.9Å; V44-E85 HydrophobicContact CG2-CB 3.99Å; V44-E85 WeakPolarHBondContact CG2-OE2 3.15Å; A81-E85 WeakPolarHBondContact O-CB 3.37Å; A81-E85 WeakPolarHBondContact O-CG 3.37Å; A81-E85 PolarHBondContact O-N 3.38Å; I82-E85 PolarHBondContact O-N 3.49Å; I83-E85 PolarHBondContact O-N 3.46Å; E85-R88 PolarHBondContact O-N 3.31Å; E85-C89 PolarHBondContact O-N 3.28Å; E85-C89 PolarHBondContact O-SG 3.08Å
86F96.9Very high96.1Very high0 Ų035 Ų350%018%0.175CC..Hα-helixtrans-61.9-51.3173.5-84.7-66.1000111.4T43 V44 L53 V56 F57 L60 L64 I82 I83 T84 R88 C89 V90T43-F86 HydrophobicContact CG2-CZ 4.15Å; V44-F86 HydrophobicContact CG1-CB 4.43Å; V44-F86 HydrophobicContact CG1-CD1 3.6Å; V44-F86 HydrophobicContact CG1-CD2 3.89Å; V44-F86 HydrophobicContact CG1-CE1 3.73Å; V44-F86 HydrophobicContact CG1-CE2 4Å; V44-F86 HydrophobicContact CG1-CG 3.69Å; V44-F86 HydrophobicContact CG1-CZ 3.93Å; L53-F86 HydrophobicContact CD2-CD1 4.42Å; L53-F86 HydrophobicContact CD2-CE1 3.85Å; V56-F86 HydrophobicContact CG1-CE1 4.3Å; V56-F86 HydrophobicContact CG1-CZ 4.15Å; F57-F86 HydrophobicContact CB-CB 4.35Å; F57-F86 HydrophobicContact CB-CD1 3.64Å; F57-F86 HydrophobicContact CB-CE1 4.01Å; F57-F86 HydrophobicContact CB-CG 4.01Å; F57-F86 HydrophobicContact CD1-CB 4.1Å; F57-F86 HydrophobicContact CD2-CB 3.47Å; F57-F86 VanDerWaalsContact CD2-CB 3.47Å; F57-F86 AromaticContact CD2-CD1 3.99Å; F57-F86 HydrophobicContact CD2-CD1 3.99Å; F57-F86 AromaticContact CD2-CD2 3.61Å; F57-F86 HydrophobicContact CD2-CD2 3.61Å; F57-F86 HydrophobicContact CD2-CE2 4.3Å; F57-F86 AromaticContact CD2-CG 3.43Å; F57-F86 HydrophobicContact CD2-CG 3.43Å; F57-F86 VanDerWaalsContact CD2-CG 3.43Å; F57-F86 HydrophobicContact CE1-CB 4.21Å; F57-F86 HydrophobicContact CE2-CB 3.63Å; F57-F86 HydrophobicContact CE2-CD2 4.07Å; F57-F86 HydrophobicContact CE2-CG 4.01Å; F57-F86 HydrophobicContact CG-CB 3.72Å; F57-F86 AromaticContact CG-CD1 3.95Å; F57-F86 HydrophobicContact CG-CD1 3.95Å; F57-F86 HydrophobicContact CG-CD2 4.39Å; F57-F86 AromaticContact CG-CG 3.8Å; F57-F86 HydrophobicContact CG-CG 3.8Å; F57-F86 HydrophobicContact CZ-CB 4Å; L60-F86 HydrophobicContact CD1-CE2 4.08Å; L60-F86 HydrophobicContact CD1-CZ 3.84Å; L64-F86 HydrophobicContact CD1-CE2 4.4Å; I82-F86 HydrophobicContact CG2-CD2 3.58Å; I82-F86 HydrophobicContact CG2-CE2 3.45Å; I82-F86 VanDerWaalsContact CG2-CE2 3.45Å; I82-F86 VanDerWaalsContact O-CD2 3.24Å; I82-F86 WeakPolarHBondContact O-CD2 3.44Å; I82-F86 PolarHBondContact O-N 3.41Å; I83-F86 PolarHBondContact O-N 2.74Å; T84-F86 PolarHBondContact O-N 2.94Å; F86-R88 PolarHBondContact O-N 3.26Å; F86-R88 VanDerWaalsContact O-N 3.14Å; F86-C89 PolarHBondContact O-N 3.12Å; F86-V90 HydrophobicContact CD1-CG1 4.28Å; F86-V90 VanDerWaalsContact O-CG1 3.31Å; F86-V90 WeakPolarHBondContact O-CG1 3.47Å; F86-V90 WeakPolarHBondContact O-CG2 3.27Å; F86-V90 PolarHBondContact O-N 3.03Å
87I96.9Very high96.2Very high3 Ų334.4 Ų34.42%0.01517%0.173CC..Hα-helixtrans-56-34-180-67.7-69.5000111.8F57 I83 T84 P93 A96 L100 L127 L130 V131 V134F57-I87 HydrophobicContact CE1-CD1 3.71Å; F57-I87 HydrophobicContact CE1-CG1 4.31Å; F57-I87 HydrophobicContact CZ-CD1 3.92Å; F57-I87 HydrophobicContact CZ-CG1 4.16Å; I83-I87 HydrophobicContact CG2-CG1 4.31Å; I83-I87 VanDerWaalsContact O-CG1 3.3Å; I83-I87 WeakPolarHBondContact O-CG1 3.23Å; I83-I87 PolarHBondContact O-N 3.16Å; T84-I87 PolarHBondContact O-N 3.2Å; I87-P93 HydrophobicContact CD1-CB 4.02Å; I87-P93 HydrophobicContact CG2-CB 4.19Å; I87-A96 HydrophobicContact CD1-CB 4.15Å; I87-L100 HydrophobicContact CD1-CD2 4.37Å; I87-L127 HydrophobicContact CG1-CD1 4.38Å; I87-L130 HydrophobicContact CB-CD2 4.09Å; I87-L130 HydrophobicContact CG2-CD2 3.75Å; I87-L130 HydrophobicContact CG2-CG 3.91Å; I87-V131 HydrophobicContact CG1-CG2 4.48Å; I87-V131 HydrophobicContact CG2-CG2 4.15Å; I87-V134 HydrophobicContact CG2-CG2 3.64Å
88R95.5Very high96.2Very high155 Ų15534.1 Ų34.159%0.58518%0.177SC*.Hα-helixtrans-69.3-31.8175-70.1-176.7-175.9128.71.8114.3T84 E85 F86 L130T84-R88 WeakPolarHBondContact O-CG 3.37Å; T84-R88 PolarHBondContact O-N 3.1Å; T84-R88 VanDerWaalsContact O-N 3.11Å; E85-R88 PolarHBondContact O-N 3.31Å; F86-R88 PolarHBondContact O-N 3.26Å; F86-R88 VanDerWaalsContact O-N 3.14Å; R88-L130 HydrophobicContact CG-CD1 3.94Å; R88-L130 HydrophobicContact CG-CD2 3.51Å; R88-L130 HydrophobicContact CG-CG 4.37Å
89C94.1Very high96.2Very high58 Ų5839.2 Ų39.239%0.39220%0.197SC..Hα-helixtrans-103.9-21.1-166.2-610000113.9S50 L53 E85 F86S50-C89 WeakPolarHBondContact CB-O 3.36Å; L53-C89 HydrophobicContact CD1-CB 3.79Å; E85-C89 PolarHBondContact O-N 3.28Å; E85-C89 PolarHBondContact O-SG 3.08Å; F86-C89 PolarHBondContact O-N 3.12Å
90V95.4Very high96.3Very high11 Ų1139.2 Ų39.27%0.06720%0.197CC..  trans-82.3145.5-175.2-62.70000111.8L53 F57 F86 K92 P93L53-V90 HydrophobicContact CB-CG1 4.03Å; F57-V90 HydrophobicContact CB-CG1 4.2Å; F57-V90 HydrophobicContact CD1-CG1 4.26Å; F57-V90 HydrophobicContact CD1-CG2 4.38Å; F86-V90 HydrophobicContact CD1-CG1 4.28Å; F86-V90 VanDerWaalsContact O-CG1 3.31Å; F86-V90 WeakPolarHBondContact O-CG1 3.47Å; F86-V90 WeakPolarHBondContact O-CG2 3.27Å; F86-V90 PolarHBondContact O-N 3.03Å; V90-K92 VanDerWaalsContact C-N 3.34Å; V90-K92 PolarHBondContact O-N 3.08Å; V90-P93 HydrophobicContact CG2-CB 3.98Å
91P94Very high96.3Very high75 Ų7539 Ų3949%0.48720%0.195SC..SBendtrans-74.1-21.2-177.730.4-36.7000114S50 Q54S50-P91 WeakPolarHBondContact O-CD 3.35Å; Q54-P91 HydrophobicContact CB-CG 4.22Å
92K95.8Very high96.2Very high101 Ų10140.4 Ų40.444%0.43920%0.203SC..  trans-133.267.9-178.8-60.9179.5-178.5176.20111.4Q54 V90 E94 E95Q54-K92 PolarHBondContact NE2-O 3.41Å; Q54-K92 PolarHBondContact OE1-O 3.47Å; V90-K92 VanDerWaalsContact C-N 3.34Å; V90-K92 PolarHBondContact O-N 3.08Å; K92-E94 VanDerWaalsContact CA-OE2 3.22Å; K92-E94 WeakPolarHBondContact CA-OE2 3.4Å; K92-E94 PolarHBondContact O-N 2.97Å; K92-E95 HydrophobicContact CB-CG 4.1Å; K92-E95 WeakPolarHBondContact CD-OE1 3.36Å; K92-E95 IonicContact NZ-OE1 3.61Å; K92-E95 PolarHBondContact O-N 2.89Å
93P95.9Very high96.1Very high10 Ų1042.6 Ų42.67%0.06522%0.217CC..G310 helixtrans-61.5-22.8-179.627-34.9000112.8I87 V90 E95 A96 V134I87-P93 HydrophobicContact CD1-CB 4.02Å; I87-P93 HydrophobicContact CG2-CB 4.19Å; V90-P93 HydrophobicContact CG2-CB 3.98Å; P93-E95 PolarHBondContact O-N 2.99Å; P93-A96 WeakPolarHBondContact O-CB 3.38Å; P93-A96 PolarHBondContact O-N 3.47Å; P93-A96 VanDerWaalsContact O-N 3.15Å; P93-V134 HydrophobicContact CB-CG2 3.87Å; P93-V134 HydrophobicContact CG-CB 4.13Å; P93-V134 HydrophobicContact CG-CG2 3.66Å
94E96.3Very high95.9Very high58 Ų5842.8 Ų42.827%0.27122%0.218SC..G310 helixtrans-62.8-24.3178.769.8-81.1-170.100113.7K92 A96 L97 H138K92-E94 VanDerWaalsContact CA-OE2 3.22Å; K92-E94 WeakPolarHBondContact CA-OE2 3.4Å; K92-E94 PolarHBondContact O-N 2.97Å; E94-A96 PolarHBondContact O-N 3.29Å; E94-L97 HydrophobicContact CB-CD1 4.13Å; E94-L97 WeakPolarHBondContact O-CB 3.47Å; E94-L97 WeakPolarHBondContact O-CG 3.43Å; E94-L97 PolarHBondContact O-N 2.93Å; E94-H138 HydrophobicContact CB-CB 3.88Å
95E96.3Very high95.7Very high88 Ų8842.6 Ų42.641%0.41122%0.219SC..G310 helixtrans-65.1-20.1176.7-67.9-177.1-17800112.5Q54 K92 P93 P98Q54-E95 PolarHBondContact NE2-OE2 3.3Å; K92-E95 HydrophobicContact CB-CG 4.1Å; K92-E95 WeakPolarHBondContact CD-OE1 3.36Å; K92-E95 IonicContact NZ-OE1 3.61Å; K92-E95 PolarHBondContact O-N 2.89Å; P93-E95 PolarHBondContact O-N 2.99Å; E95-P98 WeakPolarHBondContact O-CD 3.23Å
96A96.4Very high95.5Very high3 Ų346.7 Ų46.73%0.02524%0.238CC..G310 helixtrans-82.2-20.617800000113.7F57 L61 I87 P93 E94 P98 Y99 L100F57-A96 HydrophobicContact CE1-CB 3.59Å; F57-A96 HydrophobicContact CZ-CB 4.03Å; L61-A96 HydrophobicContact CD1-CB 4.43Å; L61-A96 HydrophobicContact CD2-CB 3.65Å; I87-A96 HydrophobicContact CD1-CB 4.15Å; P93-A96 WeakPolarHBondContact O-CB 3.38Å; P93-A96 PolarHBondContact O-N 3.47Å; P93-A96 VanDerWaalsContact O-N 3.15Å; E94-A96 PolarHBondContact O-N 3.29Å; A96-P98 VanDerWaalsContact C-CD 3.41Å; A96-Y99 PolarHBondContact O-N 3.4Å; A96-Y99 VanDerWaalsContact O-N 3.17Å; A96-L100 VanDerWaalsContact O-CB 3.27Å; A96-L100 WeakPolarHBondContact O-CB 3.43Å; A96-L100 PolarHBondContact O-N 2.78Å
97L97.3Very high95.3Very high4 Ų447.8 Ų47.82%0.02124%0.242CC..Hα-helixtrans-55.7-41.2-172.3-61.5176.3000114.7E94 Y99 L100 M101 V131 C135 H138 L139 Y142E94-L97 HydrophobicContact CB-CD1 4.13Å; E94-L97 WeakPolarHBondContact O-CB 3.47Å; E94-L97 WeakPolarHBondContact O-CG 3.43Å; E94-L97 PolarHBondContact O-N 2.93Å; L97-Y99 PolarHBondContact O-N 3.45Å; L97-Y99 VanDerWaalsContact O-N 3.08Å; L97-L100 PolarHBondContact O-N 2.91Å; L97-M101 HydrophobicContact CB-CG 4.3Å; L97-M101 HydrophobicContact CD2-CG 3.93Å; L97-M101 HydrophobicContact CD2-SD 4.29Å; L97-M101 WeakPolarHBondContact O-CB 3.38Å; L97-M101 PolarHBondContact O-N 2.91Å; L97-V131 HydrophobicContact CD2-CG1 3.54Å; L97-C135 HydrophobicContact CD1-CB 4.1Å; L97-C135 HydrophobicContact CD2-CB 4.49Å; L97-H138 HydrophobicContact CD1-CB 3.96Å; L97-L139 HydrophobicContact CD1-CD2 4.17Å; L97-L139 HydrophobicContact CD1-CG 4.37Å; L97-L139 HydrophobicContact CD2-CD2 3.65Å; L97-L139 HydrophobicContact CD2-CG 4.45Å; L97-Y142 HydrophobicContact CB-CD2 4.05Å; L97-Y142 HydrophobicContact CB-CE2 3.41Å; L97-Y142 VanDerWaalsContact CB-CE2 3.41Å; L97-Y142 HydrophobicContact CD1-CD2 4.3Å; L97-Y142 HydrophobicContact CD1-CE2 4.02Å; L97-Y142 HydrophobicContact CG-CE2 4.31Å
98P97.2Very high95Very high64 Ų6447.9 Ų47.942%0.41624%0.243SC..Hα-helixtrans-59.5-24.1-178.9-23.432.8000114.7E95 A96 P102 Y142E95-P98 WeakPolarHBondContact O-CD 3.23Å; A96-P98 VanDerWaalsContact C-CD 3.41Å; P98-P102 WeakPolarHBondContact O-CG 3.32Å; P98-Y142 WeakPolarHBondContact CA-OH 3.33Å; P98-Y142 WeakPolarHBondContact CG-OH 3.4Å
99Y96.2Very high94.6Very high113 Ų11340.8 Ų40.844%0.44322%0.218SC..Hα-helixtrans-105.8-38.3177.6-59.1-64000112L61 K62 L65 A96 L97 C103L61-Y99 HydrophobicContact CD2-CD2 4.09Å; K62-Y99 PolarHBondContact NZ-OH 3.05Å; K62-Y99 VanDerWaalsContact NZ-OH 3.13Å; L65-Y99 WeakPolarHBondContact CD1-O 3.36Å; A96-Y99 PolarHBondContact O-N 3.4Å; A96-Y99 VanDerWaalsContact O-N 3.17Å; L97-Y99 PolarHBondContact O-N 3.45Å; L97-Y99 VanDerWaalsContact O-N 3.08Å; Y99-C103 PolarHBondContact O-N 3.11Å; Y99-C103 PolarHBondContact O-SG 3.23Å
100L96.8Very high94.2Very high0 Ų042 Ų420%022%0.22CC..Hα-helixtrans-66.8-50.4-177.3-178.962.3000112L65 I83 I87 A96 L97 C103 L104 V131L65-L100 HydrophobicContact CD2-CD1 3.68Å; I83-L100 HydrophobicContact CG2-CD1 4.14Å; I87-L100 HydrophobicContact CD1-CD2 4.37Å; A96-L100 VanDerWaalsContact O-CB 3.27Å; A96-L100 WeakPolarHBondContact O-CB 3.43Å; A96-L100 PolarHBondContact O-N 2.78Å; L97-L100 PolarHBondContact O-N 2.91Å; L100-C103 PolarHBondContact O-N 3.18Å; L100-L104 HydrophobicContact CD1-CD1 3.93Å; L100-L104 HydrophobicContact CD1-CD2 4.45Å; L100-L104 HydrophobicContact CD1-CG 3.99Å; L100-L104 HydrophobicContact CG-CD1 3.91Å; L100-L104 HydrophobicContact CG-CG 4.29Å; L100-L104 WeakPolarHBondContact O-CG 3.46Å; L100-L104 PolarHBondContact O-N 3.23Å; L100-V131 HydrophobicContact CD2-CG2 3.83Å
101M96.6Very high93.5Very high0 Ų050.4 Ų50.40%026%0.256CS..Hα-helixtrans-65-44.1-172.6-66-54.9-57.900113.3L97 C103 L104 G105 L128 V131 L139 Y142 E145 T146L97-M101 HydrophobicContact CB-CG 4.3Å; L97-M101 HydrophobicContact CD2-CG 3.93Å; L97-M101 HydrophobicContact CD2-SD 4.29Å; L97-M101 WeakPolarHBondContact O-CB 3.38Å; L97-M101 PolarHBondContact O-N 2.91Å; M101-C103 VanDerWaalsContact C-N 3.34Å; M101-C103 PolarHBondContact O-N 3.35Å; M101-L104 PolarHBondContact O-N 2.89Å; M101-G105 PolarHBondContact O-N 2.94Å; M101-L128 HydrophobicContact CE-CD1 3.88Å; M101-L128 HydrophobicContact SD-CD1 4.21Å; M101-V131 HydrophobicContact SD-CG1 4.4Å; M101-L139 HydrophobicContact CE-CD2 4.25Å; M101-L139 HydrophobicContact CG-CD2 4.14Å; M101-L139 HydrophobicContact SD-CD2 3.87Å; M101-Y142 HydrophobicContact CB-CD1 3.53Å; M101-Y142 HydrophobicContact CB-CE1 4.16Å; M101-Y142 HydrophobicContact CB-CG 3.76Å; M101-Y142 HydrophobicContact CG-CD1 3.98Å; M101-Y142 HydrophobicContact CG-CD2 4.1Å; M101-Y142 HydrophobicContact CG-CG 3.71Å; M101-E145 HydrophobicContact CE-CB 4.4Å; M101-T146 VanDerWaalsContact CE-OG1 3.23Å; M101-T146 WeakPolarHBondContact CE-OG1 3.48Å
102P94.4Very high92.8Very high57 Ų5754.3 Ų54.337%0.3727%0.267SS..Hα-helixtrans-61-39.9173.7-25.836.4000113.1P98 G105 Q106P98-P102 WeakPolarHBondContact O-CG 3.32Å; P102-G105 PolarHBondContact O-N 3.06Å; P102-Q106 WeakPolarHBondContact O-CB 3.47Å; P102-Q106 PolarHBondContact O-N 3.12Å
103C94.3Very high92.1Very high45 Ų4552 Ų5230%0.30426%0.26SS..Hα-helixtrans-66.4-41.9177.9-77.50000112.5L65 Y99 L100 M101 R107L65-C103 HydrophobicContact CD1-CB 4.43Å; L65-C103 HydrophobicContact CD2-CB 4Å; Y99-C103 PolarHBondContact O-N 3.11Å; Y99-C103 PolarHBondContact O-SG 3.23Å; L100-C103 PolarHBondContact O-N 3.18Å; M101-C103 VanDerWaalsContact C-N 3.34Å; M101-C103 PolarHBondContact O-N 3.35Å; C103-R107 WeakPolarHBondContact O-CB 3.4Å; C103-R107 PolarHBondContact O-N 3.41Å
104L94.5Very high91.7Very high4 Ų456.1 Ų56.12%0.02128%0.28CS..Hα-helixtrans-66.5-42174-66.9-178.8000111.1L68 L100 M101 Q106 R107 F108 I149L68-L104 HydrophobicContact CD1-CD2 4.46Å; L100-L104 HydrophobicContact CD1-CD1 3.93Å; L100-L104 HydrophobicContact CD1-CD2 4.45Å; L100-L104 HydrophobicContact CD1-CG 3.99Å; L100-L104 HydrophobicContact CG-CD1 3.91Å; L100-L104 HydrophobicContact CG-CG 4.29Å; L100-L104 WeakPolarHBondContact O-CG 3.46Å; L100-L104 PolarHBondContact O-N 3.23Å; M101-L104 PolarHBondContact O-N 2.89Å; L104-Q106 PolarHBondContact O-N 2.87Å; L104-R107 PolarHBondContact O-N 2.96Å; L104-F108 HydrophobicContact CB-CD2 4.41Å; L104-F108 HydrophobicContact CD2-CD2 3.98Å; L104-F108 HydrophobicContact CD2-CE2 3.75Å; L104-F108 WeakPolarHBondContact O-CB 3.41Å; L104-F108 WeakPolarHBondContact O-CD2 3.41Å; L104-F108 PolarHBondContact O-N 2.74Å; L104-I149 HydrophobicContact CB-CD1 3.88Å
105G93Very high91.5Very high9 Ų953.4 Ų53.49%0.09327%0.268CS..Iπ-helixtrans-58.5-47.8177.800000112.3M101 P102 R107 G109 D110M101-G105 PolarHBondContact O-N 2.94Å; P102-G105 PolarHBondContact O-N 3.06Å; G105-R107 VanDerWaalsContact C-N 3.35Å; G105-R107 PolarHBondContact O-N 2.69Å; G105-G109 CarbonylContact O-C 3.55Å; G105-G109 WeakPolarHBondContact O-CA 3.38Å; G105-G109 PolarHBondContact O-N 3.06Å; G105-D110 PolarHBondContact O-N 3.3Å
106Q91.9Very high91.3Very high123 Ų12353.8 Ų53.858%0.57528%0.278SS*.Iπ-helixtrans-63.6-38.7177.5-172.9-179.617.700112.6P102 L104P102-Q106 WeakPolarHBondContact O-CB 3.47Å; P102-Q106 PolarHBondContact O-N 3.12Å; L104-Q106 PolarHBondContact O-N 2.87Å
107R91.9Very high91.2Very high22 Ų2254.5 Ų54.58%0.08328%0.282CS..Iπ-helixtrans-80.8-36-175-170.5171-171779.1113.3L68 S69 C103 L104 G105 L114 E115L68-R107 PolarHBondContact O-NE 3.36Å; L68-R107 VanDerWaalsContact O-NE 3.12Å; L68-R107 PolarHBondContact O-NH1 2.91Å; L68-R107 PolarHBondContact O-NH2 3.3Å; S69-R107 PolarHBondContact OG-NH1 2.88Å; S69-R107 VanDerWaalsContact OG-NH1 3.17Å; C103-R107 WeakPolarHBondContact O-CB 3.4Å; C103-R107 PolarHBondContact O-N 3.41Å; L104-R107 PolarHBondContact O-N 2.96Å; G105-R107 VanDerWaalsContact C-N 3.35Å; G105-R107 PolarHBondContact O-N 2.69Å; R107-L114 HydrophobicContact CG-CB 4.38Å; R107-L114 PolarHBondContact O-N 2.65Å; R107-L114 VanDerWaalsContact O-N 3.16Å; R107-E115 IonicContact CZ-OE2 2.94Å; R107-E115 IonicContact NE-OE2 3.01Å; R107-E115 PolarHBondContact NE-OE2 3Å; R107-E115 IonicContact NH2-OE2 2.95Å; R107-E115 PolarHBondContact NH2-OE2 3.42Å
108F90.2Very high91.1Very high6 Ų658.6 Ų58.63%0.02630%0.301CS..Iπ-helixtrans-121.7-12.8-168.6-56-76.5000114.4L104 I113 E115 R121 A124 I149L104-F108 HydrophobicContact CB-CD2 4.41Å; L104-F108 HydrophobicContact CD2-CD2 3.98Å; L104-F108 HydrophobicContact CD2-CE2 3.75Å; L104-F108 WeakPolarHBondContact O-CB 3.41Å; L104-F108 WeakPolarHBondContact O-CD2 3.41Å; L104-F108 PolarHBondContact O-N 2.74Å; F108-I113 HydrophobicContact CD1-CG2 4.4Å; F108-E115 HydrophobicContact CD1-CB 4.2Å; F108-E115 HydrophobicContact CE1-CB 3.53Å; F108-E115 HydrophobicContact CE1-CG 4.02Å; F108-E115 HydrophobicContact CZ-CB 4.32Å; F108-R121 HydrophobicContact CE1-CG 4.49Å; F108-A124 HydrophobicContact CD1-CB 4.24Å; F108-A124 HydrophobicContact CD2-CB 4.18Å; F108-A124 HydrophobicContact CE1-CB 3.64Å; F108-A124 HydrophobicContact CE2-CB 3.61Å; F108-A124 HydrophobicContact CG-CB 4.49Å; F108-A124 HydrophobicContact CZ-CB 3.3Å; F108-I149 HydrophobicContact CB-CG1 4.26Å; F108-I149 HydrophobicContact CB-CG2 4.01Å
109G87.6Confident91.1Very high6 Ų661.6 Ų61.66%0.06231%0.31CS..Iπ-helixtrans-109.3-11.7-176.700000115.7G105G105-G109 CarbonylContact O-C 3.55Å; G105-G109 WeakPolarHBondContact O-CA 3.38Å; G105-G109 PolarHBondContact O-N 3.06Å
110D86.6Confident91.1Very high84 Ų8456.3 Ų56.345%0.44929%0.289SS..SBendtrans-69.6171.2175.9-87.9-21.2000112.6G105 E112 R152G105-D110 PolarHBondContact O-N 3.3Å; D110-E112 PolarHBondContact O-N 3.28Å; D110-R152 WeakPolarHBondContact O-CD 3.18Å
111K79.8Confident91.1Very high186 Ų18657.4 Ų57.481%0.80929%0.294SS*.SBendtrans-55.6-38.9-175.6-76-175.4-179.9177.60113R152K111-R152 PolarHBondContact O-NH1 3.14Å
112E80.1Confident91.1Very high157 Ų15758.9 Ų58.973%0.73430%0.301SS*.SBendtrans-110.9124.9173.8-68.6-179.8179.500108.8D110 L114D110-E112 PolarHBondContact O-N 3.28Å; E112-L114 PolarHBondContact O-N 2.97Å
113I80.9Confident91.3Very high54 Ų5457.7 Ų57.728%0.27729%0.294SS..  trans-71.2119.6174.9-60.6168.2000108.1F108 E115 R121 R152F108-I113 HydrophobicContact CD1-CG2 4.4Å; I113-E115 VanDerWaalsContact C-N 3.32Å; I113-E115 HydrophobicContact CG2-CB 4.41Å; I113-E115 PolarHBondContact O-N 3.29Å; I113-R121 HydrophobicContact CG2-CG 4.38Å; I113-R152 HydrophobicContact CD1-CB 4.03Å; I113-R152 HydrophobicContact CG1-CB 4.11Å
114L86.9Confident91.4Very high95 Ų9555.8 Ų55.850%0.49728%0.282SS..  trans-77.7-15.8-176-62.2178.9000113.4R107 E112 P116R107-L114 HydrophobicContact CG-CB 4.38Å; R107-L114 PolarHBondContact O-N 2.65Å; R107-L114 VanDerWaalsContact O-N 3.16Å; E112-L114 PolarHBondContact O-N 2.97Å; L114-P116 VanDerWaalsContact O-CD 3.25Å; L114-P116 WeakPolarHBondContact O-CD 3.35Å
115E93.3Very high91.5Very high2 Ų255.7 Ų55.71%0.00928%0.282CS..  trans-90.1109.3178-177.158.6-118.100111.9R76 R107 F108 I113 S117 L120 R121R76-E115 WeakPolarHBondContact CD-OE2 3.12Å; R76-E115 IonicContact CZ-OE1 3.69Å; R76-E115 IonicContact CZ-OE2 2.92Å; R76-E115 IonicContact NE-OE1 3.76Å; R76-E115 PolarHBondContact NE-OE1 2.89Å; R76-E115 IonicContact NE-OE2 3.25Å; R76-E115 PolarHBondContact NE-OE2 2.94Å; R76-E115 IonicContact NH2-OE1 2.82Å; R76-E115 PolarHBondContact NH2-OE1 3.26Å; R76-E115 IonicContact NH2-OE2 3.42Å; R107-E115 IonicContact CZ-OE2 2.94Å; R107-E115 IonicContact NE-OE2 3.01Å; R107-E115 PolarHBondContact NE-OE2 3Å; R107-E115 IonicContact NH2-OE2 2.95Å; R107-E115 PolarHBondContact NH2-OE2 3.42Å; F108-E115 HydrophobicContact CD1-CB 4.2Å; F108-E115 HydrophobicContact CE1-CB 3.53Å; F108-E115 HydrophobicContact CE1-CG 4.02Å; F108-E115 HydrophobicContact CZ-CB 4.32Å; I113-E115 VanDerWaalsContact C-N 3.32Å; I113-E115 HydrophobicContact CG2-CB 4.41Å; I113-E115 PolarHBondContact O-N 3.29Å; E115-S117 PolarHBondContact OE1-N 3.47Å; E115-L120 HydrophobicContact CG-CB 3.83Å; E115-R121 HydrophobicContact CB-CG 4.01Å; E115-R121 HydrophobicContact CG-CG 3.94Å; E115-R121 WeakPolarHBondContact O-CD 2.9Å; E115-R121 PolarHBondContact O-NH1 3.2Å
116P91.4Very high91.8Very high95 Ų9559.3 Ų59.362%0.61730%0.296SS*.  trans-73.8-29-178.329.2-36.6000113.6L114 R121L114-P116 VanDerWaalsContact O-CD 3.25Å; L114-P116 WeakPolarHBondContact O-CD 3.35Å; P116-R121 VanDerWaalsContact C-NH1 3.3Å; P116-R121 PolarHBondContact O-NH1 3.33Å
117S95.2Very high92.1Very high18 Ų1853.5 Ų53.513%0.12627%0.269CS..  trans-81.5122.9-174.1-179.10000111.7E73 E115 E119 L120 R121E73-S117 VanDerWaalsContact OE1-CB 3.26Å; E73-S117 WeakPolarHBondContact OE1-CB 3.38Å; E73-S117 PolarHBondContact OE1-OG 3.32Å; E115-S117 PolarHBondContact OE1-N 3.47Å; S117-E119 VanDerWaalsContact C-N 3.33Å; S117-E119 PolarHBondContact O-N 3.04Å; S117-L120 VanDerWaalsContact CB-CD1 3.42Å; S117-L120 PolarHBondContact O-N 2.94Å; S117-L120 VanDerWaalsContact OG-CD1 3.24Å; S117-L120 WeakPolarHBondContact OG-CD1 3.34Å; S117-R121 WeakPolarHBondContact O-CG 3.38Å; S117-R121 PolarHBondContact O-N 3.21Å
118E95.1Very high92.4Very high90 Ų9052.5 Ų52.542%0.42127%0.265SS..Hα-helixtrans-65.5-34.4-179.264.8-173.5-178.100113.2R121 L122 F158E118-R121 PolarHBondContact O-N 3Å; E118-L122 PolarHBondContact O-N 3.44Å; E118-F158 HydrophobicContact CB-CB 3.83Å; E118-F158 HydrophobicContact CB-CD1 3.82Å; E118-F158 HydrophobicContact CB-CD2 4.45Å; E118-F158 HydrophobicContact CB-CG 3.8Å; E118-F158 HydrophobicContact CG-CD1 4.12Å; E118-F158 HydrophobicContact CG-CD2 4.28Å; E118-F158 HydrophobicContact CG-CE1 4.42Å; E118-F158 HydrophobicContact CG-CG 4.09Å; E118-F158 WeakPolarHBondContact OE2-CD2 3.41Å
119E96.5Very high92.7Very high128 Ų12852.4 Ų52.460%0.59827%0.265SS*.Hα-helixtrans-66.7-37.4176-63.8-173.7174.200111.8S117 L122 S123S117-E119 VanDerWaalsContact C-N 3.33Å; S117-E119 PolarHBondContact O-N 3.04Å; E119-L122 PolarHBondContact O-N 3.15Å; E119-S123 WeakPolarHBondContact O-CB 3.49Å; E119-S123 PolarHBondContact O-N 2.93Å; E119-S123 PolarHBondContact O-OG 3.3Å
120L95.9Very high93.3Very high1 Ų153 Ų531%0.00527%0.267CS..Hα-helixtrans-75.2-34.4174.7-77.6100.6000112.5E73 R76 E77 I80 E115 S117 L122 S123 A124E73-L120 HydrophobicContact CG-CD1 3.38Å; E73-L120 WeakPolarHBondContact OE1-CD1 3.35Å; R76-L120 HydrophobicContact CB-CD2 3.39Å; E77-L120 HydrophobicContact CB-CD1 4.48Å; E77-L120 HydrophobicContact CB-CD2 4.03Å; E77-L120 HydrophobicContact CB-CG 4.28Å; E77-L120 VanDerWaalsContact N-CD2 3.3Å; I80-L120 HydrophobicContact CD1-CB 4.35Å; I80-L120 HydrophobicContact CD1-CD2 4.05Å; I80-L120 HydrophobicContact CD1-CG 4.49Å; E115-L120 HydrophobicContact CG-CB 3.83Å; S117-L120 VanDerWaalsContact CB-CD1 3.42Å; S117-L120 PolarHBondContact O-N 2.94Å; S117-L120 VanDerWaalsContact OG-CD1 3.24Å; S117-L120 WeakPolarHBondContact OG-CD1 3.34Å; L120-L122 VanDerWaalsContact C-N 3.3Å; L120-S123 PolarHBondContact O-N 2.93Å; L120-A124 VanDerWaalsContact O-CB 3.31Å; L120-A124 WeakPolarHBondContact O-CB 3.37Å; L120-A124 PolarHBondContact O-N 3.33Å
121R96.4Very high93.8Very high24 Ų2449 Ų499%0.09125%0.245CC..Hα-helixtrans-59.6-45.2170-69.8-162.9-56.8-85.2-1.5110.1F108 I113 E115 P116 S117 E118 A124 V125 D156 V161F108-R121 HydrophobicContact CE1-CG 4.49Å; I113-R121 HydrophobicContact CG2-CG 4.38Å; E115-R121 HydrophobicContact CB-CG 4.01Å; E115-R121 HydrophobicContact CG-CG 3.94Å; E115-R121 WeakPolarHBondContact O-CD 2.9Å; E115-R121 PolarHBondContact O-NH1 3.2Å; P116-R121 VanDerWaalsContact C-NH1 3.3Å; P116-R121 PolarHBondContact O-NH1 3.33Å; S117-R121 WeakPolarHBondContact O-CG 3.38Å; S117-R121 PolarHBondContact O-N 3.21Å; E118-R121 PolarHBondContact O-N 3Å; R121-A124 PolarHBondContact O-N 2.91Å; R121-V125 WeakPolarHBondContact O-CG2 3.42Å; R121-V125 PolarHBondContact O-N 2.7Å; R121-D156 WeakPolarHBondContact CD-OD2 3.39Å; R121-D156 IonicContact CZ-OD1 3.91Å; R121-D156 IonicContact CZ-OD2 2.69Å; R121-D156 IonicContact NE-OD1 2.99Å; R121-D156 IonicContact NE-OD2 3.47Å; R121-D156 PolarHBondContact NE-OD2 3.02Å; R121-D156 IonicContact NH2-OD1 3.64Å; R121-D156 PolarHBondContact NH2-OD1 3.46Å; R121-D156 IonicContact NH2-OD2 3.51Å; R121-V161 HydrophobicContact CB-CG2 4.04Å
122L97.6Very high94.6Very high30 Ų3040.2 Ų40.216%0.15721%0.207CC..Hα-helixtrans-58.7-52.8174.3176.660.2000111.2E118 E119 L120 A124 V125 E126 F158 D160 V161 E164E118-L122 PolarHBondContact O-N 3.44Å; E119-L122 PolarHBondContact O-N 3.15Å; L120-L122 VanDerWaalsContact C-N 3.3Å; L122-A124 PolarHBondContact O-N 3.26Å; L122-V125 PolarHBondContact O-N 2.96Å; L122-E126 HydrophobicContact CD1-CG 4.17Å; L122-E126 HydrophobicContact CG-CG 4.37Å; L122-E126 WeakPolarHBondContact O-CG 3.46Å; L122-E126 PolarHBondContact O-N 3.03Å; L122-F158 HydrophobicContact CB-CE1 4.41Å; L122-F158 HydrophobicContact CD2-CE1 4.12Å; L122-D160 HydrophobicContact CD1-CB 4.13Å; L122-D160 HydrophobicContact CD2-CB 3.85Å; L122-V161 HydrophobicContact CB-CG2 3.87Å; L122-E164 HydrophobicContact CD1-CB 3.83Å; L122-E164 HydrophobicContact CD1-CG 4.15Å
123S97.8Very high95.4Very high33 Ų3338.8 Ų38.823%0.23120%0.2CC..Hα-helixtrans-56.8-35179.7-58.10000112.5E119 L120 L127E119-S123 WeakPolarHBondContact O-CB 3.49Å; E119-S123 PolarHBondContact O-N 2.93Å; E119-S123 PolarHBondContact O-OG 3.3Å; L120-S123 PolarHBondContact O-N 2.93Å; S123-L127 WeakPolarHBondContact O-CB 3.3Å; S123-L127 PolarHBondContact O-N 3.38Å
124A96.1Very high96.2Very high5 Ų539.1 Ų39.14%0.04121%0.205CC..Hα-helixtrans-72-38.817700000112.7I80 F108 L120 R121 L122 L127 L128I80-A124 HydrophobicContact CD1-CB 4.34Å; F108-A124 HydrophobicContact CD1-CB 4.24Å; F108-A124 HydrophobicContact CD2-CB 4.18Å; F108-A124 HydrophobicContact CE1-CB 3.64Å; F108-A124 HydrophobicContact CE2-CB 3.61Å; F108-A124 HydrophobicContact CG-CB 4.49Å; F108-A124 HydrophobicContact CZ-CB 3.3Å; L120-A124 VanDerWaalsContact O-CB 3.31Å; L120-A124 WeakPolarHBondContact O-CB 3.37Å; L120-A124 PolarHBondContact O-N 3.33Å; R121-A124 PolarHBondContact O-N 2.91Å; L122-A124 PolarHBondContact O-N 3.26Å; A124-L127 WeakPolarHBondContact O-CB 3.34Å; A124-L127 PolarHBondContact O-N 3.34Å; A124-L128 PolarHBondContact O-N 3Å
125V97.8Very high96.7Very high2 Ų234.9 Ų34.91%0.01218%0.183CC..Hα-helixtrans-70.8-36.6174.1-173.40000110.6R121 L122 L127 L128 T129 T153 V161 E164 C168R121-V125 WeakPolarHBondContact O-CG2 3.42Å; R121-V125 PolarHBondContact O-N 2.7Å; L122-V125 PolarHBondContact O-N 2.96Å; V125-L127 VanDerWaalsContact C-N 3.32Å; V125-L127 PolarHBondContact O-N 2.69Å; V125-L128 CarbonylContact O-C 3.6Å; V125-L128 WeakPolarHBondContact O-CA 3.43Å; V125-L128 WeakPolarHBondContact O-CB 3.39Å; V125-L128 PolarHBondContact O-N 3.28Å; V125-L128 VanDerWaalsContact O-N 3.08Å; V125-T129 PolarHBondContact O-N 3.43Å; V125-T129 PolarHBondContact O-OG1 3.17Å; V125-T129 VanDerWaalsContact O-OG1 3.08Å; V125-T153 HydrophobicContact CG2-CG2 3.81Å; V125-V161 HydrophobicContact CG2-CG1 4.18Å; V125-E164 HydrophobicContact CB-CG 4.08Å; V125-E164 HydrophobicContact CG1-CB 4.13Å; V125-E164 HydrophobicContact CG1-CG 3.76Å; V125-C168 HydrophobicContact CG1-CB 4.45Å
126E98.4Very high96.7Very high84 Ų8435.5 Ų35.539%0.39319%0.19SC..Hα-helixtrans-61-40.4171.8-70.2-179.4153.500112L122 T129 L130 E164L122-E126 HydrophobicContact CD1-CG 4.17Å; L122-E126 HydrophobicContact CG-CG 4.37Å; L122-E126 WeakPolarHBondContact O-CG 3.46Å; L122-E126 PolarHBondContact O-N 3.03Å; E126-T129 PolarHBondContact O-N 3.42Å; E126-L130 WeakPolarHBondContact O-CB 3.35Å; E126-L130 PolarHBondContact O-N 2.95Å; E126-E164 HydrophobicContact CG-CG 3.82Å
127L97.9Very high96.9Very high1 Ų138.5 Ų38.51%0.00519%0.194CC..Hα-helixtrans-61-45170.5169.861.9000111I80 I83 I87 S123 A124 V125 L130 V131I80-L127 HydrophobicContact CG2-CB 4.42Å; I80-L127 HydrophobicContact CG2-CD2 4.36Å; I83-L127 HydrophobicContact CB-CD2 4.45Å; I83-L127 HydrophobicContact CG2-CD1 4.05Å; I83-L127 HydrophobicContact CG2-CD2 3.92Å; I87-L127 HydrophobicContact CG1-CD1 4.38Å; S123-L127 WeakPolarHBondContact O-CB 3.3Å; S123-L127 PolarHBondContact O-N 3.38Å; A124-L127 WeakPolarHBondContact O-CB 3.34Å; A124-L127 PolarHBondContact O-N 3.34Å; V125-L127 VanDerWaalsContact C-N 3.32Å; V125-L127 PolarHBondContact O-N 2.69Å; L127-L130 PolarHBondContact O-N 2.69Å; L127-V131 HydrophobicContact CD1-CG2 4.1Å; L127-V131 VanDerWaalsContact O-CG2 3.26Å; L127-V131 WeakPolarHBondContact O-CG2 3.01Å; L127-V131 PolarHBondContact O-N 3.41Å
128L98.1Very high97Very high1 Ų142 Ų421%0.00521%0.208CC..Hα-helixtrans-61.7-44177.6-17764000111.6M101 A124 V125 L130 V131 V132 T146 I149 L150M101-L128 HydrophobicContact CE-CD1 3.88Å; M101-L128 HydrophobicContact SD-CD1 4.21Å; A124-L128 PolarHBondContact O-N 3Å; V125-L128 CarbonylContact O-C 3.6Å; V125-L128 WeakPolarHBondContact O-CA 3.43Å; V125-L128 WeakPolarHBondContact O-CB 3.39Å; V125-L128 PolarHBondContact O-N 3.28Å; V125-L128 VanDerWaalsContact O-N 3.08Å; L128-L130 PolarHBondContact O-N 3.5Å; L128-V131 WeakPolarHBondContact O-CB 3.33Å; L128-V131 PolarHBondContact O-N 3.01Å; L128-V132 WeakPolarHBondContact O-CG2 3.32Å; L128-V132 PolarHBondContact O-N 2.64Å; L128-T146 HydrophobicContact CD1-CG2 4.43Å; L128-T146 HydrophobicContact CD2-CG2 4.47Å; L128-I149 HydrophobicContact CD2-CB 4.25Å; L128-I149 HydrophobicContact CD2-CD1 4.34Å; L128-I149 HydrophobicContact CD2-CG2 3.8Å; L128-L150 HydrophobicContact CD2-CD2 4.45Å
129T98.4Very high97Very high4 Ų437.7 Ų37.73%0.02519%0.188CC..Hα-helixtrans-59.1-47175.3-58.20000111.1V125 E126 V131 V132 E133 E164 C168V125-T129 PolarHBondContact O-N 3.43Å; V125-T129 PolarHBondContact O-OG1 3.17Å; V125-T129 VanDerWaalsContact O-OG1 3.08Å; E126-T129 PolarHBondContact O-N 3.42Å; T129-V131 VanDerWaalsContact C-N 3.31Å; T129-V131 PolarHBondContact O-N 2.96Å; T129-V132 WeakPolarHBondContact O-CB 3.27Å; T129-V132 PolarHBondContact O-N 3.33Å; T129-V132 VanDerWaalsContact O-N 3.13Å; T129-E133 WeakPolarHBondContact O-CG 3.13Å; T129-E133 PolarHBondContact O-N 3.08Å; T129-E164 WeakPolarHBondContact CB-OE1 3.31Å; T129-E164 WeakPolarHBondContact CG2-OE1 3.47Å; T129-E164 PolarHBondContact OG1-OE1 3.46Å; T129-C168 VanDerWaalsContact OG1-CB 3.27Å; T129-C168 WeakPolarHBondContact OG1-CB 3.37Å
130L98.3Very high97Very high19 Ų1932.7 Ų32.710%0.09917%0.168CC..Hα-helixtrans-58.3-45.7175.9173.768.9000111.1T84 I87 R88 E126 L127 L128 V132 E133 V134T84-L130 HydrophobicContact CG2-CD2 3.67Å; I87-L130 HydrophobicContact CB-CD2 4.09Å; I87-L130 HydrophobicContact CG2-CD2 3.75Å; I87-L130 HydrophobicContact CG2-CG 3.91Å; R88-L130 HydrophobicContact CG-CD1 3.94Å; R88-L130 HydrophobicContact CG-CD2 3.51Å; R88-L130 HydrophobicContact CG-CG 4.37Å; E126-L130 WeakPolarHBondContact O-CB 3.35Å; E126-L130 PolarHBondContact O-N 2.95Å; L127-L130 PolarHBondContact O-N 2.69Å; L128-L130 PolarHBondContact O-N 3.5Å; L130-V132 VanDerWaalsContact C-N 3.27Å; L130-V132 PolarHBondContact O-N 3.14Å; L130-E133 PolarHBondContact O-N 3.16Å; L130-E133 VanDerWaalsContact O-N 3.14Å; L130-V134 HydrophobicContact CD1-CG1 3.83Å; L130-V134 HydrophobicContact CG-CG1 4.47Å; L130-V134 WeakPolarHBondContact O-CG2 3.46Å; L130-V134 PolarHBondContact O-N 3.08Å
131V97.9Very high97Very high0 Ų037.3 Ų37.30%020%0.198CC..Hα-helixtrans-59.4-40.3177.2170.20000110.8I87 L97 L100 M101 L127 L128 T129 C135 L139I87-V131 HydrophobicContact CG1-CG2 4.48Å; I87-V131 HydrophobicContact CG2-CG2 4.15Å; L97-V131 HydrophobicContact CD2-CG1 3.54Å; L100-V131 HydrophobicContact CD2-CG2 3.83Å; M101-V131 HydrophobicContact SD-CG1 4.4Å; L127-V131 HydrophobicContact CD1-CG2 4.1Å; L127-V131 VanDerWaalsContact O-CG2 3.26Å; L127-V131 WeakPolarHBondContact O-CG2 3.01Å; L127-V131 PolarHBondContact O-N 3.41Å; L128-V131 WeakPolarHBondContact O-CB 3.33Å; L128-V131 PolarHBondContact O-N 3.01Å; T129-V131 VanDerWaalsContact C-N 3.31Å; T129-V131 PolarHBondContact O-N 2.96Å; V131-C135 WeakPolarHBondContact O-CB 3.44Å; V131-C135 PolarHBondContact O-N 3.08Å; V131-L139 HydrophobicContact CG1-CD1 4.23Å; V131-L139 HydrophobicContact CG1-CD2 4Å
132V97.6Very high97.1Very high1 Ų138.1 Ų38.11%0.00620%0.202CC..Hα-helixtrans-61.6-43.7173.9168.40000112.3L128 T129 L130 G136 L139 G171 F172 S175L128-V132 WeakPolarHBondContact O-CG2 3.32Å; L128-V132 PolarHBondContact O-N 2.64Å; T129-V132 WeakPolarHBondContact O-CB 3.27Å; T129-V132 PolarHBondContact O-N 3.33Å; T129-V132 VanDerWaalsContact O-N 3.13Å; L130-V132 VanDerWaalsContact C-N 3.27Å; L130-V132 PolarHBondContact O-N 3.14Å; V132-G136 PolarHBondContact O-N 2.92Å; V132-G136 VanDerWaalsContact O-N 3.16Å; V132-L139 VanDerWaalsContact CA-CD1 3.5Å; V132-L139 HydrophobicContact CB-CD1 4.15Å; V132-L139 HydrophobicContact CG2-CD1 3.69Å; V132-G171 VanDerWaalsContact CG1-C 3.44Å; V132-F172 HydrophobicContact CG1-CB 3.99Å; V132-F172 HydrophobicContact CG2-CB 4.09Å; V132-F172 HydrophobicContact CG2-CD2 4.05Å; V132-F172 HydrophobicContact CG2-CG 4.4Å; V132-S175 PolarHBondContact O-OG 2.6Å
133E96.8Very high97Very high127 Ų12737.2 Ų37.259%0.59320%0.197SC*.Hα-helixtrans-66.9-42.1-179.7-71.4173.1174.500112.4T129 L130T129-E133 WeakPolarHBondContact O-CG 3.13Å; T129-E133 PolarHBondContact O-N 3.08Å; L130-E133 PolarHBondContact O-N 3.16Å; L130-E133 VanDerWaalsContact O-N 3.14Å
134V97Very high96.9Very high62 Ų6239.5 Ų39.538%0.37621%0.207SC..Hα-helixtrans-91.5-29.8-173.7-540000114.1I87 P93 L130I87-V134 HydrophobicContact CG2-CG2 3.64Å; P93-V134 HydrophobicContact CB-CG2 3.87Å; P93-V134 HydrophobicContact CG-CB 4.13Å; P93-V134 HydrophobicContact CG-CG2 3.66Å; L130-V134 HydrophobicContact CD1-CG1 3.83Å; L130-V134 HydrophobicContact CG-CG1 4.47Å; L130-V134 WeakPolarHBondContact O-CG2 3.46Å; L130-V134 PolarHBondContact O-N 3.08Å
135C96.6Very high96.9Very high5 Ų542 Ų423%0.03422%0.217CC..Hα-helixtrans-94.3-23.2-179.3-61.30000113L97 V131 K137 H138 L139L97-C135 HydrophobicContact CD1-CB 4.1Å; L97-C135 HydrophobicContact CD2-CB 4.49Å; V131-C135 WeakPolarHBondContact O-CB 3.44Å; V131-C135 PolarHBondContact O-N 3.08Å; C135-K137 PolarHBondContact O-N 3.42Å; C135-H138 HydrophobicContact CB-CB 4.47Å; C135-H138 WeakPolarHBondContact O-CB 3.17Å; C135-H138 PolarHBondContact O-CD2 2.8Å; C135-H138 VanDerWaalsContact O-CD2 3.28Å; C135-H138 PolarHBondContact O-N 3.45Å; C135-H138 VanDerWaalsContact O-N 3.07Å; C135-L139 HydrophobicContact CB-CD1 4.46Å; C135-L139 HydrophobicContact CB-CG 4.29Å
136G94.5Very high96.8Very high16 Ų1641.9 Ų41.917%0.16522%0.217CC..G310 helixtrans48.7-123.7175.900000113.7V132 H138 L139V132-G136 PolarHBondContact O-N 2.92Å; V132-G136 VanDerWaalsContact O-N 3.16Å; G136-H138 PolarHBondContact O-N 2.93Å; G136-L139 PolarHBondContact O-N 3.44Å; G136-L139 VanDerWaalsContact O-N 3.13Å
137K95.4Very high96.8Very high158 Ų15837.9 Ų37.969%0.68720%0.198SC*.G310 helixtrans-57.8-21.2-177.964.8179.6178.4-179.90115.1C135 L139 A140C135-K137 PolarHBondContact O-N 3.42Å; K137-L139 PolarHBondContact O-N 3.43Å; K137-L139 VanDerWaalsContact O-N 3.16Å; K137-A140 WeakPolarHBondContact O-CB 3.49Å; K137-A140 PolarHBondContact O-N 3Å; K137-A140 VanDerWaalsContact O-N 3.16Å
138H96.3Very high96.7Very high91 Ų9141 Ų4142%0.42121%0.214SC..G310 helixtrans-66.5-12.6178.2-67.2-79.4000113.1E94 L97 C135 G136 A140 P141E94-H138 HydrophobicContact CB-CB 3.88Å; L97-H138 HydrophobicContact CD1-CB 3.96Å; C135-H138 HydrophobicContact CB-CB 4.47Å; C135-H138 WeakPolarHBondContact O-CB 3.17Å; C135-H138 PolarHBondContact O-CD2 2.8Å; C135-H138 VanDerWaalsContact O-CD2 3.28Å; C135-H138 PolarHBondContact O-N 3.45Å; C135-H138 VanDerWaalsContact O-N 3.07Å; G136-H138 PolarHBondContact O-N 2.93Å; H138-A140 VanDerWaalsContact C-N 3.34Å; H138-P141 VanDerWaalsContact O-CD 3.26Å; H138-P141 WeakPolarHBondContact O-CD 3.27Å
139L96.3Very high96.6Very high0 Ų041.1 Ų41.10%022%0.215CC..G310 helixtrans-80.8-7174.3-75.7164.4000114.7L97 M101 V131 V132 C135 G136 K137 P141 Y142 F172L97-L139 HydrophobicContact CD1-CD2 4.17Å; L97-L139 HydrophobicContact CD1-CG 4.37Å; L97-L139 HydrophobicContact CD2-CD2 3.65Å; L97-L139 HydrophobicContact CD2-CG 4.45Å; M101-L139 HydrophobicContact CE-CD2 4.25Å; M101-L139 HydrophobicContact CG-CD2 4.14Å; M101-L139 HydrophobicContact SD-CD2 3.87Å; V131-L139 HydrophobicContact CG1-CD1 4.23Å; V131-L139 HydrophobicContact CG1-CD2 4Å; V132-L139 VanDerWaalsContact CA-CD1 3.5Å; V132-L139 HydrophobicContact CB-CD1 4.15Å; V132-L139 HydrophobicContact CG2-CD1 3.69Å; C135-L139 HydrophobicContact CB-CD1 4.46Å; C135-L139 HydrophobicContact CB-CG 4.29Å; G136-L139 PolarHBondContact O-N 3.44Å; G136-L139 VanDerWaalsContact O-N 3.13Å; K137-L139 PolarHBondContact O-N 3.43Å; K137-L139 VanDerWaalsContact O-N 3.16Å; L139-P141 VanDerWaalsContact C-CD 3.4Å; L139-P141 VanDerWaalsContact C-N 3.32Å; L139-Y142 HydrophobicContact CD2-CD2 4.41Å; L139-Y142 CarbonylContact O-C 3.47Å; L139-Y142 WeakPolarHBondContact O-CA 3.41Å; L139-Y142 PolarHBondContact O-N 2.9Å; L139-F172 HydrophobicContact CB-CE2 3.83Å; L139-F172 HydrophobicContact CD1-CD2 4.39Å; L139-F172 HydrophobicContact CD1-CE2 4.43Å
140A95.9Very high96.6Very high22 Ų2241 Ų4118%0.18221%0.214CC..G310 helixtrans-52.9-39.9-179.700000114.2K137 H138 Y142 L143 V176K137-A140 WeakPolarHBondContact O-CB 3.49Å; K137-A140 PolarHBondContact O-N 3Å; K137-A140 VanDerWaalsContact O-N 3.16Å; H138-A140 VanDerWaalsContact C-N 3.34Å; A140-Y142 PolarHBondContact O-N 3.39Å; A140-L143 PolarHBondContact O-N 3.38Å; A140-V176 HydrophobicContact CB-CG1 4.05Å
141P96.9Very high96.5Very high99 Ų9942 Ų4264%0.64322%0.219SC*.G310 helixtrans-65.7-17.7175.5-21.535.1000114.6H138 L139H138-P141 VanDerWaalsContact O-CD 3.26Å; H138-P141 WeakPolarHBondContact O-CD 3.27Å; L139-P141 VanDerWaalsContact C-CD 3.4Å; L139-P141 VanDerWaalsContact C-N 3.32Å
142Y96.7Very high96.4Very high40 Ų4046.2 Ų46.216%0.15724%0.235CC..G310 helixtrans-108.826.2-176.4-51-77.6000112.2L97 P98 M101 L139 A140 N144 E145 T146L97-Y142 HydrophobicContact CB-CD2 4.05Å; L97-Y142 HydrophobicContact CB-CE2 3.41Å; L97-Y142 VanDerWaalsContact CB-CE2 3.41Å; L97-Y142 HydrophobicContact CD1-CD2 4.3Å; L97-Y142 HydrophobicContact CD1-CE2 4.02Å; L97-Y142 HydrophobicContact CG-CE2 4.31Å; P98-Y142 WeakPolarHBondContact CA-OH 3.33Å; P98-Y142 WeakPolarHBondContact CG-OH 3.4Å; M101-Y142 HydrophobicContact CB-CD1 3.53Å; M101-Y142 HydrophobicContact CB-CE1 4.16Å; M101-Y142 HydrophobicContact CB-CG 3.76Å; M101-Y142 HydrophobicContact CG-CD1 3.98Å; M101-Y142 HydrophobicContact CG-CD2 4.1Å; M101-Y142 HydrophobicContact CG-CG 3.71Å; L139-Y142 HydrophobicContact CD2-CD2 4.41Å; L139-Y142 CarbonylContact O-C 3.47Å; L139-Y142 WeakPolarHBondContact O-CA 3.41Å; L139-Y142 PolarHBondContact O-N 2.9Å; A140-Y142 PolarHBondContact O-N 3.39Å; Y142-N144 VanDerWaalsContact C-N 3.32Å; Y142-N144 PolarHBondContact O-N 3.19Å; Y142-E145 VanDerWaalsContact CA-OE2 3.32Å; Y142-E145 WeakPolarHBondContact CA-OE2 3.48Å; Y142-E145 PolarHBondContact O-N 3.21Å; Y142-T146 WeakPolarHBondContact O-CB 3.31Å; Y142-T146 PolarHBondContact O-N 3.44Å; Y142-T146 PolarHBondContact O-OG1 3.35Å
143L96Very high96.4Very high12 Ų1246.2 Ų46.26%0.06324%0.235CC..Hα-helixtrans-54.7-48.4-179.4179.168.4000111.3A140 T146 I147 F172 H179 M182 Q183A140-L143 PolarHBondContact O-N 3.38Å; L143-T146 PolarHBondContact O-N 3.42Å; L143-I147 HydrophobicContact CD1-CG1 3.99Å; L143-I147 HydrophobicContact CG-CG1 4.33Å; L143-I147 WeakPolarHBondContact O-CB 3.47Å; L143-I147 WeakPolarHBondContact O-CG1 3.35Å; L143-I147 PolarHBondContact O-N 3.24Å; L143-F172 HydrophobicContact CD1-CE1 3.7Å; L143-F172 HydrophobicContact CD1-CZ 3.76Å; L143-H179 WeakPolarHBondContact CD2-O 3.33Å; L143-M182 HydrophobicContact CD2-CB 4.05Å; L143-Q183 HydrophobicContact CD2-CB 4.17Å; L143-Q183 HydrophobicContact CD2-CG 3.83Å; L143-Q183 HydrophobicContact CG-CB 4.26Å; L143-Q183 HydrophobicContact CG-CG 4.08Å
144N95.7Very high96.4Very high81 Ų8140.2 Ų40.243%0.43321%0.206SC..Hα-helixtrans-65-45.9-175.5-67.1-30.6000111.7Y142 T146 I147 N148 Q183Y142-N144 VanDerWaalsContact C-N 3.32Å; Y142-N144 PolarHBondContact O-N 3.19Å; N144-T146 PolarHBondContact O-N 2.99Å; N144-I147 PolarHBondContact O-N 3.38Å; N144-N148 VanDerWaalsContact O-CB 3.29Å; N144-N148 WeakPolarHBondContact O-CB 3.43Å; N144-N148 PolarHBondContact O-N 2.86Å; N144-N148 PolarHBondContact O-ND2 3.35Å; N144-N148 PolarHBondContact O-OD1 3.22Å; N144-Q183 PolarHBondContact OD1-NE2 2.82Å
145E95.8Very high96.4Very high57 Ų5739.8 Ų39.827%0.26620%0.204SC..Hα-helixtrans-60.7-47.6178.4-67.379.2178.600110.7M101 Y142 N148 I149M101-E145 HydrophobicContact CE-CB 4.4Å; Y142-E145 VanDerWaalsContact CA-OE2 3.32Å; Y142-E145 WeakPolarHBondContact CA-OE2 3.48Å; Y142-E145 PolarHBondContact O-N 3.21Å; E145-N148 PolarHBondContact O-N 2.95Å; E145-I149 WeakPolarHBondContact O-CD1 3.44Å; E145-I149 VanDerWaalsContact O-CG1 3.24Å; E145-I149 WeakPolarHBondContact O-CG1 3.41Å; E145-I149 PolarHBondContact O-N 2.83Å; E145-I149 VanDerWaalsContact O-N 3.08Å
146T97Very high96.4Very high0 Ų039.7 Ų39.70%020%0.203CC..Hα-helixtrans-62.5-47.8-179.8-50.60000111.1M101 L128 Y142 L143 N144 N148 I149 L150 F172M101-T146 VanDerWaalsContact CE-OG1 3.23Å; M101-T146 WeakPolarHBondContact CE-OG1 3.48Å; L128-T146 HydrophobicContact CD1-CG2 4.43Å; L128-T146 HydrophobicContact CD2-CG2 4.47Å; Y142-T146 WeakPolarHBondContact O-CB 3.31Å; Y142-T146 PolarHBondContact O-N 3.44Å; Y142-T146 PolarHBondContact O-OG1 3.35Å; L143-T146 PolarHBondContact O-N 3.42Å; N144-T146 PolarHBondContact O-N 2.99Å; T146-N148 PolarHBondContact O-N 3.01Å; T146-I149 PolarHBondContact O-N 3.46Å; T146-L150 HydrophobicContact CG2-CD1 4.12Å; T146-L150 VanDerWaalsContact O-CG 3.3Å; T146-L150 WeakPolarHBondContact O-CG 3.22Å; T146-L150 PolarHBondContact O-N 2.93Å; T146-F172 HydrophobicContact CG2-CD1 3.65Å; T146-F172 HydrophobicContact CG2-CD2 4.03Å; T146-F172 HydrophobicContact CG2-CE1 3.62Å; T146-F172 HydrophobicContact CG2-CE2 4.02Å; T146-F172 HydrophobicContact CG2-CG 3.87Å; T146-F172 HydrophobicContact CG2-CZ 3.81Å
147I96.9Very high96.4Very high0 Ų043.9 Ų43.90%023%0.228CC..Hα-helixtrans-63.4-43.5179.3-67.2-68.8000111.2L143 N144 I149 L150 Q151 F172 F180 Q183 S186 L187L143-I147 HydrophobicContact CD1-CG1 3.99Å; L143-I147 HydrophobicContact CG-CG1 4.33Å; L143-I147 WeakPolarHBondContact O-CB 3.47Å; L143-I147 WeakPolarHBondContact O-CG1 3.35Å; L143-I147 PolarHBondContact O-N 3.24Å; N144-I147 PolarHBondContact O-N 3.38Å; I147-I149 VanDerWaalsContact C-N 3.33Å; I147-I149 PolarHBondContact O-N 2.82Å; I147-L150 PolarHBondContact O-N 3.37Å; I147-L150 VanDerWaalsContact O-N 3.15Å; I147-Q151 HydrophobicContact CG2-CG 4.21Å; I147-Q151 WeakPolarHBondContact O-CG 3.38Å; I147-Q151 PolarHBondContact O-N 2.94Å; I147-F172 HydrophobicContact CD1-CD1 4.38Å; I147-F172 HydrophobicContact CD1-CE1 4.08Å; I147-F172 HydrophobicContact CG1-CE1 4.22Å; I147-F180 HydrophobicContact CD1-CD2 4.42Å; I147-F180 HydrophobicContact CD1-CE2 3.81Å; I147-F180 HydrophobicContact CD1-CZ 4.41Å; I147-Q183 HydrophobicContact CB-CB 4.44Å; I147-Q183 HydrophobicContact CD1-CB 4.43Å; I147-Q183 HydrophobicContact CG1-CB 3.87Å; I147-Q183 HydrophobicContact CG2-CB 4.23Å; I147-S186 WeakPolarHBondContact CG2-OG 3.31Å; I147-L187 HydrophobicContact CD1-CD1 3.62Å; I147-L187 HydrophobicContact CD1-CG 4.14Å; I147-L187 HydrophobicContact CG2-CD2 4.27Å; I147-L187 HydrophobicContact CG2-CG 4.4Å
148N96.3Very high96.5Very high65 Ų6538.1 Ų38.135%0.34820%0.203SC..Hα-helixtrans-59.6-43.8178.2-73.5-14000111.6N144 E145 T146 L150 Q151 R152N144-N148 VanDerWaalsContact O-CB 3.29Å; N144-N148 WeakPolarHBondContact O-CB 3.43Å; N144-N148 PolarHBondContact O-N 2.86Å; N144-N148 PolarHBondContact O-ND2 3.35Å; N144-N148 PolarHBondContact O-OD1 3.22Å; E145-N148 PolarHBondContact O-N 2.95Å; T146-N148 PolarHBondContact O-N 3.01Å; N148-L150 PolarHBondContact O-N 3.24Å; N148-Q151 PolarHBondContact O-N 3.35Å; N148-R152 WeakPolarHBondContact O-CG 3.42Å; N148-R152 PolarHBondContact O-N 2.92Å
149I97.1Very high96.6Very high5 Ų535.3 Ų35.33%0.02619%0.192CC..Hα-helixtrans-60.4-46.5174.7-63161.6000110.5L104 F108 L128 E145 T146 I147 R152 T153L104-I149 HydrophobicContact CB-CD1 3.88Å; F108-I149 HydrophobicContact CB-CG1 4.26Å; F108-I149 HydrophobicContact CB-CG2 4.01Å; L128-I149 HydrophobicContact CD2-CB 4.25Å; L128-I149 HydrophobicContact CD2-CD1 4.34Å; L128-I149 HydrophobicContact CD2-CG2 3.8Å; E145-I149 WeakPolarHBondContact O-CD1 3.44Å; E145-I149 VanDerWaalsContact O-CG1 3.24Å; E145-I149 WeakPolarHBondContact O-CG1 3.41Å; E145-I149 PolarHBondContact O-N 2.83Å; E145-I149 VanDerWaalsContact O-N 3.08Å; T146-I149 PolarHBondContact O-N 3.46Å; I147-I149 VanDerWaalsContact C-N 3.33Å; I147-I149 PolarHBondContact O-N 2.82Å; I149-R152 PolarHBondContact O-N 2.93Å; I149-T153 HydrophobicContact CG2-CG2 4.15Å; I149-T153 WeakPolarHBondContact O-CB 3.43Å; I149-T153 WeakPolarHBondContact O-CG2 3.38Å; I149-T153 PolarHBondContact O-N 2.93Å; I149-T153 PolarHBondContact O-OG1 3.29Å
150L97.8Very high96.6Very high0 Ų038.1 Ų38.10%021%0.207CC..Hα-helixtrans-64.7-41.1-179.4-68.4173.2000112.4L128 T146 I147 N148 R152 T153 I154 S165 C168 F172 L187L128-L150 HydrophobicContact CD2-CD2 4.45Å; T146-L150 HydrophobicContact CG2-CD1 4.12Å; T146-L150 VanDerWaalsContact O-CG 3.3Å; T146-L150 WeakPolarHBondContact O-CG 3.22Å; T146-L150 PolarHBondContact O-N 2.93Å; I147-L150 PolarHBondContact O-N 3.37Å; I147-L150 VanDerWaalsContact O-N 3.15Å; N148-L150 PolarHBondContact O-N 3.24Å; L150-R152 PolarHBondContact O-N 3.49Å; L150-T153 PolarHBondContact O-N 3.22Å; L150-I154 HydrophobicContact CB-CD1 4.31Å; L150-I154 WeakPolarHBondContact O-CB 3.23Å; L150-I154 WeakPolarHBondContact O-CD1 3.46Å; L150-I154 WeakPolarHBondContact O-CG1 3.44Å; L150-I154 PolarHBondContact O-N 3.05Å; L150-S165 WeakPolarHBondContact CD2-O 3.37Å; L150-C168 HydrophobicContact CD2-CB 3.9Å; L150-F172 HydrophobicContact CD1-CD1 4.34Å; L150-L187 HydrophobicContact CB-CD2 3.85Å
151Q96.8Very high96.7Very high42 Ų4237.1 Ų37.120%0.19620%0.199CC..Hα-helixtrans-56-38176.1-76.6-173.2-4800112.7I147 N148 S186 L187 P190I147-Q151 HydrophobicContact CG2-CG 4.21Å; I147-Q151 WeakPolarHBondContact O-CG 3.38Å; I147-Q151 PolarHBondContact O-N 2.94Å; N148-Q151 PolarHBondContact O-N 3.35Å; Q151-S186 PolarHBondContact NE2-O 3.19Å; Q151-S186 PolarHBondContact NE2-OG 3.47Å; Q151-L187 HydrophobicContact CG-CD2 3.76Å; Q151-P190 HydrophobicContact CB-CG 4.45Å; Q151-P190 HydrophobicContact CG-CG 4.46Å
152R95.6Very high96.8Very high88 Ų8833.3 Ų33.333%0.33217%0.172SC..Hα-helixtrans-78.1-44.2179.2-60.1-63.2132.1163.9-1.3111.7D110 K111 I113 N148 I149 L150 V155 D156D110-R152 WeakPolarHBondContact O-CD 3.18Å; K111-R152 PolarHBondContact O-NH1 3.14Å; I113-R152 HydrophobicContact CD1-CB 4.03Å; I113-R152 HydrophobicContact CG1-CB 4.11Å; N148-R152 WeakPolarHBondContact O-CG 3.42Å; N148-R152 PolarHBondContact O-N 2.92Å; I149-R152 PolarHBondContact O-N 2.93Å; L150-R152 PolarHBondContact O-N 3.49Å; R152-V155 VanDerWaalsContact O-CG2 3.31Å; R152-V155 WeakPolarHBondContact O-CG2 3.38Å; R152-D156 PolarHBondContact O-N 2.95Å
153T96.6Very high96.9Very high1 Ų133.8 Ų33.81%0.00618%0.175CC..Hα-helixtrans-82.1-25.5-170.356.80000113.5V125 I149 L150 V155 D156 V161 S165V125-T153 HydrophobicContact CG2-CG2 3.81Å; I149-T153 HydrophobicContact CG2-CG2 4.15Å; I149-T153 WeakPolarHBondContact O-CB 3.43Å; I149-T153 WeakPolarHBondContact O-CG2 3.38Å; I149-T153 PolarHBondContact O-N 2.93Å; I149-T153 PolarHBondContact O-OG1 3.29Å; L150-T153 PolarHBondContact O-N 3.22Å; T153-V155 PolarHBondContact O-N 3.32Å; T153-D156 WeakPolarHBondContact O-CB 3.45Å; T153-D156 PolarHBondContact O-N 3.46Å; T153-D156 VanDerWaalsContact O-N 3.11Å; T153-V161 HydrophobicContact CG2-CG1 4.31Å; T153-S165 WeakPolarHBondContact CB-OG 3.21Å; T153-S165 PolarHBondContact OG1-OG 2.97Å
154I97.9Very high97Very high0 Ų034 Ų340%018%0.176CC..THydrogen-bonded Turntrans-59.6-35.7171.4-72.8166.4000111.4L150 K162 L187 P190 L191 T194L150-I154 HydrophobicContact CB-CD1 4.31Å; L150-I154 WeakPolarHBondContact O-CB 3.23Å; L150-I154 WeakPolarHBondContact O-CD1 3.46Å; L150-I154 WeakPolarHBondContact O-CG1 3.44Å; L150-I154 PolarHBondContact O-N 3.05Å; I154-K162 WeakPolarHBondContact O-CG 3.44Å; I154-K162 PolarHBondContact O-NZ 3.39Å; I154-L187 HydrophobicContact CD1-CD2 3.97Å; I154-P190 HydrophobicContact CB-CB 4.11Å; I154-P190 HydrophobicContact CG2-CB 3.81Å; I154-L191 HydrophobicContact CD1-CD2 4.08Å; I154-L191 HydrophobicContact CD1-CG 4.24Å; I154-L191 HydrophobicContact CG2-CD2 3.95Å; I154-L191 HydrophobicContact CG2-CG 4.33Å; I154-T194 PolarHBondContact O-OG1 3.46Å; I154-T194 VanDerWaalsContact O-OG1 3.05Å
155V96.9Very high97.1Very high54 Ų5430.1 Ų30.133%0.32716%0.155SC..THydrogen-bonded Turntrans-95.510.3179.3-63.50000113.2R152 T153 K162 P190 Q193R152-V155 VanDerWaalsContact O-CG2 3.31Å; R152-V155 WeakPolarHBondContact O-CG2 3.38Å; T153-V155 PolarHBondContact O-N 3.32Å; V155-K162 VanDerWaalsContact CA-NZ 3.35Å; V155-K162 PolarHBondContact O-NZ 3.08Å; V155-K162 VanDerWaalsContact O-NZ 3.14Å; V155-P190 HydrophobicContact CG1-CB 3.85Å; V155-Q193 HydrophobicContact CG1-CB 4.29Å
156D96.6Very high97.3Very high2 Ų227.4 Ų27.41%0.01114%0.143CC..  trans-55.2142.2-179.5-163.2-78.2000112R121 R152 T153 F158 V161 K162R121-D156 WeakPolarHBondContact CD-OD2 3.39Å; R121-D156 IonicContact CZ-OD1 3.91Å; R121-D156 IonicContact CZ-OD2 2.69Å; R121-D156 IonicContact NE-OD1 2.99Å; R121-D156 IonicContact NE-OD2 3.47Å; R121-D156 PolarHBondContact NE-OD2 3.02Å; R121-D156 IonicContact NH2-OD1 3.64Å; R121-D156 PolarHBondContact NH2-OD1 3.46Å; R121-D156 IonicContact NH2-OD2 3.51Å; R152-D156 PolarHBondContact O-N 2.95Å; T153-D156 WeakPolarHBondContact O-CB 3.45Å; T153-D156 PolarHBondContact O-N 3.46Å; T153-D156 VanDerWaalsContact O-N 3.11Å; D156-F158 PolarHBondContact O-N 3.34Å; D156-F158 WeakPolarHBondContact OD1-CB 3.27Å; D156-F158 PolarHBondContact OD1-N 2.79Å; D156-V161 HydrophobicContact CB-CB 3.85Å; D156-V161 HydrophobicContact CB-CG1 3.48Å; D156-V161 VanDerWaalsContact CB-CG1 3.48Å; D156-K162 WeakPolarHBondContact O-CE 3.11Å; D156-K162 VanDerWaalsContact O-CG 3.29Å; D156-K162 WeakPolarHBondContact O-CG 3.47Å; D156-K162 PolarHBondContact O-NZ 2.94Å
157P94.9Very high97.3Very high105 Ų10533.6 Ų33.668%0.68217%0.166SC*.SBendtrans-59.6-28.4175.623.9-35.7000113.7P159P157-P159 WeakPolarHBondContact O-CD 3.37Å
158F96.4Very high97.4Very high37 Ų3733.6 Ų33.616%0.16217%0.166CC..SBendtrans-85119.8-176.3-171.9-136.1000111.7E118 L122 D156 D160 V161 K162E118-F158 HydrophobicContact CB-CB 3.83Å; E118-F158 HydrophobicContact CB-CD1 3.82Å; E118-F158 HydrophobicContact CB-CD2 4.45Å; E118-F158 HydrophobicContact CB-CG 3.8Å; E118-F158 HydrophobicContact CG-CD1 4.12Å; E118-F158 HydrophobicContact CG-CD2 4.28Å; E118-F158 HydrophobicContact CG-CE1 4.42Å; E118-F158 HydrophobicContact CG-CG 4.09Å; E118-F158 WeakPolarHBondContact OE2-CD2 3.41Å; L122-F158 HydrophobicContact CB-CE1 4.41Å; L122-F158 HydrophobicContact CD2-CE1 4.12Å; D156-F158 PolarHBondContact O-N 3.34Å; D156-F158 WeakPolarHBondContact OD1-CB 3.27Å; D156-F158 PolarHBondContact OD1-N 2.79Å; F158-D160 VanDerWaalsContact C-N 3.29Å; F158-D160 HydrophobicContact CD1-CB 4.18Å; F158-D160 HydrophobicContact CE1-CB 3.67Å; F158-D160 HydrophobicContact CZ-CB 3.94Å; F158-D160 WeakPolarHBondContact CZ-OD2 3.46Å; F158-D160 PolarHBondContact O-N 3.43Å; F158-V161 HydrophobicContact CB-CG2 4.2Å; F158-V161 HydrophobicContact CD1-CG2 3.78Å; F158-V161 HydrophobicContact CG-CG2 4.48Å; F158-V161 PolarHBondContact O-N 3.04Å; F158-V161 VanDerWaalsContact O-N 3.16Å; F158-K162 PolarHBondContact O-N 2.95Å
159P97.5Very high97.5Very high31 Ų3130.5 Ų30.520%0.20115%0.149CC..Hα-helixtrans-59.5-32.2-173.4-28.737000115.4P157 K162 K163 V202P157-P159 WeakPolarHBondContact O-CD 3.37Å; P159-K162 PolarHBondContact O-N 3.5Å; P159-K163 PolarHBondContact O-N 3.24Å; P159-V202 HydrophobicContact CB-CG2 3.95Å
160D98.1Very high97.6Very high60 Ų6031.6 Ų31.632%0.32116%0.156SC..Hα-helixtrans-71-36.3-180-68.2-33.2000111.8L122 F158 K163 E164L122-D160 HydrophobicContact CD1-CB 4.13Å; L122-D160 HydrophobicContact CD2-CB 3.85Å; F158-D160 VanDerWaalsContact C-N 3.29Å; F158-D160 HydrophobicContact CD1-CB 4.18Å; F158-D160 HydrophobicContact CE1-CB 3.67Å; F158-D160 HydrophobicContact CZ-CB 3.94Å; F158-D160 WeakPolarHBondContact CZ-OD2 3.46Å; F158-D160 PolarHBondContact O-N 3.43Å; D160-K163 PolarHBondContact O-N 3.31Å; D160-K163 WeakPolarHBondContact OD1-CE 3.35Å; D160-K163 IonicContact OD1-NZ 2.64Å; D160-K163 PolarHBondContact OD1-NZ 3.45Å; D160-E164 WeakPolarHBondContact O-CB 3.35Å; D160-E164 PolarHBondContact O-N 3.18Å
161V97.8Very high97.6Very high0 Ų032.7 Ų32.70%017%0.168CC..Hα-helixtrans-60.8-46.9172174.70000109.9R121 L122 V125 T153 D156 F158 K163 E164 S165R121-V161 HydrophobicContact CB-CG2 4.04Å; L122-V161 HydrophobicContact CB-CG2 3.87Å; V125-V161 HydrophobicContact CG2-CG1 4.18Å; T153-V161 HydrophobicContact CG2-CG1 4.31Å; D156-V161 HydrophobicContact CB-CB 3.85Å; D156-V161 HydrophobicContact CB-CG1 3.48Å; D156-V161 VanDerWaalsContact CB-CG1 3.48Å; F158-V161 HydrophobicContact CB-CG2 4.2Å; F158-V161 HydrophobicContact CD1-CG2 3.78Å; F158-V161 HydrophobicContact CG-CG2 4.48Å; F158-V161 PolarHBondContact O-N 3.04Å; F158-V161 VanDerWaalsContact O-N 3.16Å; V161-K163 VanDerWaalsContact C-N 3.33Å; V161-K163 PolarHBondContact O-N 3.17Å; V161-E164 PolarHBondContact O-N 3Å; V161-S165 WeakPolarHBondContact O-CB 3.49Å; V161-S165 PolarHBondContact O-N 2.82Å; V161-S165 PolarHBondContact O-OG 3.42Å
162K98.4Very high97.7Very high19 Ų1930.7 Ų30.78%0.08316%0.158CC..Hα-helixtrans-55.4-47.2178.2-59.4-176169.9-55.60112.5I154 V155 D156 F158 P159 C166 T194 V202I154-K162 WeakPolarHBondContact O-CG 3.44Å; I154-K162 PolarHBondContact O-NZ 3.39Å; V155-K162 VanDerWaalsContact CA-NZ 3.35Å; V155-K162 PolarHBondContact O-NZ 3.08Å; V155-K162 VanDerWaalsContact O-NZ 3.14Å; D156-K162 WeakPolarHBondContact O-CE 3.11Å; D156-K162 VanDerWaalsContact O-CG 3.29Å; D156-K162 WeakPolarHBondContact O-CG 3.47Å; D156-K162 PolarHBondContact O-NZ 2.94Å; F158-K162 PolarHBondContact O-N 2.95Å; P159-K162 PolarHBondContact O-N 3.5Å; K162-C166 WeakPolarHBondContact O-CB 3.29Å; K162-C166 PolarHBondContact O-N 3.01Å; K162-C166 PolarHBondContact O-SG 2.99Å; K162-T194 HydrophobicContact CB-CG2 4.38Å; K162-T194 HydrophobicContact CD-CG2 3.92Å; K162-V202 HydrophobicContact CB-CG1 3.96Å; K162-V202 HydrophobicContact CD-CG1 3.78Å
163K98.4Very high97.7Very high50 Ų5026.5 Ų26.522%0.21714%0.143CC..Hα-helixtrans-62.8-46.6179.3-72.1-178.9-63.4173.80111.2P159 D160 V161 C166 R167 R201 V202P159-K163 PolarHBondContact O-N 3.24Å; D160-K163 PolarHBondContact O-N 3.31Å; D160-K163 WeakPolarHBondContact OD1-CE 3.35Å; D160-K163 IonicContact OD1-NZ 2.64Å; D160-K163 PolarHBondContact OD1-NZ 3.45Å; V161-K163 VanDerWaalsContact C-N 3.33Å; V161-K163 PolarHBondContact O-N 3.17Å; K163-C166 WeakPolarHBondContact O-CB 3.15Å; K163-C166 PolarHBondContact O-N 3.12Å; K163-R167 PolarHBondContact O-N 3.35Å; K163-R201 HydrophobicContact CD-CB 4.14Å; K163-V202 HydrophobicContact CD-CG2 4.39Å; K163-V202 HydrophobicContact CG-CG2 3.98Å
164E98.5Very high97.7Very high16 Ų1632.8 Ų32.88%0.07517%0.17CC..Hα-helixtrans-65.9-40.3-179-17053.1-14300111.5L122 V125 E126 T129 D160 V161 C166 R167 C168L122-E164 HydrophobicContact CD1-CB 3.83Å; L122-E164 HydrophobicContact CD1-CG 4.15Å; V125-E164 HydrophobicContact CB-CG 4.08Å; V125-E164 HydrophobicContact CG1-CB 4.13Å; V125-E164 HydrophobicContact CG1-CG 3.76Å; E126-E164 HydrophobicContact CG-CG 3.82Å; T129-E164 WeakPolarHBondContact CB-OE1 3.31Å; T129-E164 WeakPolarHBondContact CG2-OE1 3.47Å; T129-E164 PolarHBondContact OG1-OE1 3.46Å; D160-E164 WeakPolarHBondContact O-CB 3.35Å; D160-E164 PolarHBondContact O-N 3.18Å; V161-E164 PolarHBondContact O-N 3Å; E164-C166 VanDerWaalsContact C-N 3.34Å; E164-C166 PolarHBondContact O-N 3.32Å; E164-R167 VanDerWaalsContact CD-CZ 3.45Å; E164-R167 WeakPolarHBondContact O-CB 3.45Å; E164-R167 PolarHBondContact O-N 3.49Å; E164-R167 IonicContact OE1-CZ 2.65Å; E164-R167 IonicContact OE1-NE 2.88Å; E164-R167 PolarHBondContact OE1-NE 3.46Å; E164-R167 IonicContact OE1-NH2 3.35Å; E164-R167 PolarHBondContact OE1-NH2 3.46Å; E164-R167 IonicContact OE2-CZ 3.85Å; E164-R167 IonicContact OE2-NE 3.76Å; E164-R167 PolarHBondContact OE2-NE 3.41Å; E164-R167 VanDerWaalsContact OE2-NE 3.08Å; E164-R167 IonicContact OE2-NH1 3.7Å; E164-R167 IonicContact OE2-NH2 2.64Å; E164-R167 PolarHBondContact OE2-NH2 2.82Å; E164-C168 WeakPolarHBondContact O-CB 3.17Å; E164-C168 PolarHBondContact O-N 3.25Å
165S98.4Very high97.6Very high0 Ų034.4 Ų34.40%018%0.181CC..Hα-helixtrans-63.3-39.5174-620000112.2L150 T153 V161 C168 T169L150-S165 WeakPolarHBondContact CD2-O 3.37Å; T153-S165 WeakPolarHBondContact CB-OG 3.21Å; T153-S165 PolarHBondContact OG1-OG 2.97Å; V161-S165 WeakPolarHBondContact O-CB 3.49Å; V161-S165 PolarHBondContact O-N 2.82Å; V161-S165 PolarHBondContact O-OG 3.42Å; S165-C168 PolarHBondContact O-N 2.73Å; S165-T169 WeakPolarHBondContact O-CB 3.41Å; S165-T169 PolarHBondContact O-N 2.86Å; S165-T169 PolarHBondContact O-OG1 3.35Å
166C98.6Very high97.5Very high1 Ų132 Ų321%0.00717%0.167CC..Hα-helixtrans-64-44.1174-70.60000111.4K162 K163 E164 T169 V170 S205 A209K162-C166 WeakPolarHBondContact O-CB 3.29Å; K162-C166 PolarHBondContact O-N 3.01Å; K162-C166 PolarHBondContact O-SG 2.99Å; K163-C166 WeakPolarHBondContact O-CB 3.15Å; K163-C166 PolarHBondContact O-N 3.12Å; E164-C166 VanDerWaalsContact C-N 3.34Å; E164-C166 PolarHBondContact O-N 3.32Å; C166-T169 WeakPolarHBondContact O-CB 3.19Å; C166-T169 PolarHBondContact O-N 3.46Å; C166-V170 WeakPolarHBondContact O-CG2 3.31Å; C166-V170 PolarHBondContact O-N 3.44Å; C166-S205 WeakPolarHBondContact CB-O 3.31Å; C166-A209 HydrophobicContact CB-CB 3.77Å
167R98.6Very high97.2Very high130 Ų13034.9 Ų34.949%0.49119%0.185SC..Hα-helixtrans-59.4-48.3174.4-175.7176.276.8173.28.7111.6K163 E164 T169 V170 G171K163-R167 PolarHBondContact O-N 3.35Å; E164-R167 VanDerWaalsContact CD-CZ 3.45Å; E164-R167 WeakPolarHBondContact O-CB 3.45Å; E164-R167 PolarHBondContact O-N 3.49Å; E164-R167 IonicContact OE1-CZ 2.65Å; E164-R167 IonicContact OE1-NE 2.88Å; E164-R167 PolarHBondContact OE1-NE 3.46Å; E164-R167 IonicContact OE1-NH2 3.35Å; E164-R167 PolarHBondContact OE1-NH2 3.46Å; E164-R167 IonicContact OE2-CZ 3.85Å; E164-R167 IonicContact OE2-NE 3.76Å; E164-R167 PolarHBondContact OE2-NE 3.41Å; E164-R167 VanDerWaalsContact OE2-NE 3.08Å; E164-R167 IonicContact OE2-NH1 3.7Å; E164-R167 IonicContact OE2-NH2 2.64Å; E164-R167 PolarHBondContact OE2-NH2 2.82Å; R167-T169 VanDerWaalsContact C-N 3.28Å; R167-T169 PolarHBondContact O-N 2.93Å; R167-V170 PolarHBondContact O-N 2.93Å; R167-G171 PolarHBondContact O-N 2.87Å
168C98.6Very high97.1Very high0 Ų037.1 Ų37.10%019%0.187CC..Hα-helixtrans-57.4-42.5175.5-170.90000111.5V125 T129 L150 E164 S165 G171 F172V125-C168 HydrophobicContact CG1-CB 4.45Å; T129-C168 VanDerWaalsContact OG1-CB 3.27Å; T129-C168 WeakPolarHBondContact OG1-CB 3.37Å; L150-C168 HydrophobicContact CD2-CB 3.9Å; E164-C168 WeakPolarHBondContact O-CB 3.17Å; E164-C168 PolarHBondContact O-N 3.25Å; S165-C168 PolarHBondContact O-N 2.73Å; C168-G171 PolarHBondContact O-N 3.09Å; C168-F172 WeakPolarHBondContact O-CB 3.34Å; C168-F172 PolarHBondContact O-N 2.81Å
169T98.6Very high96.9Very high0 Ų038.8 Ų38.80%020%0.195CC..Hα-helixtrans-59.9-46.9177.7-59.20000111.4S165 C166 R167 F172 A173 L187 A209 V213S165-T169 WeakPolarHBondContact O-CB 3.41Å; S165-T169 PolarHBondContact O-N 2.86Å; S165-T169 PolarHBondContact O-OG1 3.35Å; C166-T169 WeakPolarHBondContact O-CB 3.19Å; C166-T169 PolarHBondContact O-N 3.46Å; R167-T169 VanDerWaalsContact C-N 3.28Å; R167-T169 PolarHBondContact O-N 2.93Å; T169-F172 PolarHBondContact O-N 3.15Å; T169-A173 WeakPolarHBondContact O-CB 3.28Å; T169-A173 PolarHBondContact O-N 3.23Å; T169-L187 HydrophobicContact CG2-CD1 3.8Å; T169-A209 HydrophobicContact CG2-CB 4.37Å; T169-V213 HydrophobicContact CG2-CG2 3.61Å
170V98.4Very high96.9Very high27 Ų2737.3 Ų37.316%0.16419%0.185CC..Hα-helixtrans-60.7-48.3176.9175.10000111C166 R167 F172 K174 E208 A209 A212C166-V170 WeakPolarHBondContact O-CG2 3.31Å; C166-V170 PolarHBondContact O-N 3.44Å; R167-V170 PolarHBondContact O-N 2.93Å; V170-F172 VanDerWaalsContact C-N 3.32Å; V170-F172 PolarHBondContact O-N 3.07Å; V170-K174 HydrophobicContact CG1-CD 4.22Å; V170-K174 WeakPolarHBondContact O-CG 3.41Å; V170-K174 PolarHBondContact O-N 3.44Å; V170-E208 HydrophobicContact CG2-CB 4.46Å; V170-A209 HydrophobicContact CG2-CB 4.15Å; V170-A212 HydrophobicContact CB-CB 4.23Å; V170-A212 HydrophobicContact CG1-CB 4.19Å; V170-A212 HydrophobicContact CG2-CB 3.98Å
171G97.9Very high96.6Very high24 Ų2438.4 Ų38.425%0.24719%0.188CC..Hα-helixtrans-59.7-44.1177.800000111.7V132 R167 C168 K174 S175V132-G171 VanDerWaalsContact CG1-C 3.44Å; R167-G171 PolarHBondContact O-N 2.87Å; C168-G171 PolarHBondContact O-N 3.09Å; G171-K174 PolarHBondContact O-N 3.18Å; G171-S175 WeakPolarHBondContact O-CB 3.48Å; G171-S175 PolarHBondContact O-N 3.19Å; G171-S175 PolarHBondContact O-OG 3.36Å; G171-S175 VanDerWaalsContact O-OG 3.12Å
172F98.1Very high96.5Very high0 Ų044.2 Ų44.20%022%0.217CC..Hα-helixtrans-68.7-44.3-176-175.7-125.7000112V132 L139 L143 T146 I147 L150 C168 T169 V170 K174 S175 V176 F180V132-F172 HydrophobicContact CG1-CB 3.99Å; V132-F172 HydrophobicContact CG2-CB 4.09Å; V132-F172 HydrophobicContact CG2-CD2 4.05Å; V132-F172 HydrophobicContact CG2-CG 4.4Å; L139-F172 HydrophobicContact CB-CE2 3.83Å; L139-F172 HydrophobicContact CD1-CD2 4.39Å; L139-F172 HydrophobicContact CD1-CE2 4.43Å; L143-F172 HydrophobicContact CD1-CE1 3.7Å; L143-F172 HydrophobicContact CD1-CZ 3.76Å; T146-F172 HydrophobicContact CG2-CD1 3.65Å; T146-F172 HydrophobicContact CG2-CD2 4.03Å; T146-F172 HydrophobicContact CG2-CE1 3.62Å; T146-F172 HydrophobicContact CG2-CE2 4.02Å; T146-F172 HydrophobicContact CG2-CG 3.87Å; T146-F172 HydrophobicContact CG2-CZ 3.81Å; I147-F172 HydrophobicContact CD1-CD1 4.38Å; I147-F172 HydrophobicContact CD1-CE1 4.08Å; I147-F172 HydrophobicContact CG1-CE1 4.22Å; L150-F172 HydrophobicContact CD1-CD1 4.34Å; C168-F172 WeakPolarHBondContact O-CB 3.34Å; C168-F172 PolarHBondContact O-N 2.81Å; T169-F172 PolarHBondContact O-N 3.15Å; V170-F172 VanDerWaalsContact C-N 3.32Å; V170-F172 PolarHBondContact O-N 3.07Å; F172-K174 PolarHBondContact O-N 2.89Å; F172-S175 PolarHBondContact O-N 3.48Å; F172-S175 VanDerWaalsContact O-N 3.1Å; F172-V176 HydrophobicContact CD1-CG2 4.47Å; F172-V176 HydrophobicContact CD2-CG2 3.81Å; F172-V176 HydrophobicContact CE1-CG2 4.15Å; F172-V176 HydrophobicContact CE2-CB 4.48Å; F172-V176 HydrophobicContact CE2-CG1 4.23Å; F172-V176 HydrophobicContact CE2-CG2 3.41Å; F172-V176 VanDerWaalsContact CE2-CG2 3.41Å; F172-V176 HydrophobicContact CG-CG2 4.31Å; F172-V176 HydrophobicContact CZ-CG2 3.6Å; F172-V176 VanDerWaalsContact O-CG2 3.23Å; F172-V176 WeakPolarHBondContact O-CG2 3.42Å; F172-V176 PolarHBondContact O-N 3.49Å; F172-V176 VanDerWaalsContact O-N 3.08Å; F172-F180 AromaticContact CD1-CD2 3.92Å; F172-F180 HydrophobicContact CD1-CD2 3.92Å; F172-F180 AromaticContact CD1-CE2 3.78Å; F172-F180 HydrophobicContact CD1-CE2 3.78Å; F172-F180 HydrophobicContact CE1-CD2 4.07Å; F172-F180 HydrophobicContact CE1-CE2 4.22Å
173A96.8Very high96.4Very high0 Ų046.4 Ų46.40%023%0.227CC..Hα-helixtrans-56-40.117500000112.3T169 F180 A212 H216T169-A173 WeakPolarHBondContact O-CB 3.28Å; T169-A173 PolarHBondContact O-N 3.23Å; A173-F180 HydrophobicContact CB-CD1 3.98Å; A173-F180 HydrophobicContact CB-CD2 4.11Å; A173-F180 HydrophobicContact CB-CE1 3.8Å; A173-F180 HydrophobicContact CB-CE2 3.91Å; A173-F180 HydrophobicContact CB-CG 4.13Å; A173-F180 HydrophobicContact CB-CZ 3.75Å; A173-A212 HydrophobicContact CB-CB 4.17Å; A173-H216 HydrophobicContact CB-CB 4.2Å
174K95.7Very high96.2Very high132 Ų13244.1 Ų44.157%0.57422%0.218SC*.Hα-helixtrans-74.2-30.9177.3-69.4176.2179.8-178.70113.4V170 G171 F172 P177V170-K174 HydrophobicContact CG1-CD 4.22Å; V170-K174 WeakPolarHBondContact O-CG 3.41Å; V170-K174 PolarHBondContact O-N 3.44Å; G171-K174 PolarHBondContact O-N 3.18Å; F172-K174 PolarHBondContact O-N 2.89Å; K174-P177 WeakPolarHBondContact O-CD 3.39Å
175S96.3Very high96Very high35 Ų3548.8 Ų48.825%0.24524%0.24CC..Hα-helixtrans-77.7-29.1-179.3-73.90000114V132 G171 F172 P177V132-S175 PolarHBondContact O-OG 2.6Å; G171-S175 WeakPolarHBondContact O-CB 3.48Å; G171-S175 PolarHBondContact O-N 3.19Å; G171-S175 PolarHBondContact O-OG 3.36Å; G171-S175 VanDerWaalsContact O-OG 3.12Å; F172-S175 PolarHBondContact O-N 3.48Å; F172-S175 VanDerWaalsContact O-N 3.1Å; S175-P177 VanDerWaalsContact C-CD 3.45Å
176V95.3Very high95.9Very high4 Ų450.2 Ų50.22%0.02425%0.249CC..SBendtrans-129.650.8-178.9-67.20000113.9A140 F172 E178 H179 F180A140-V176 HydrophobicContact CB-CG1 4.05Å; F172-V176 HydrophobicContact CD1-CG2 4.47Å; F172-V176 HydrophobicContact CD2-CG2 3.81Å; F172-V176 HydrophobicContact CE1-CG2 4.15Å; F172-V176 HydrophobicContact CE2-CB 4.48Å; F172-V176 HydrophobicContact CE2-CG1 4.23Å; F172-V176 HydrophobicContact CE2-CG2 3.41Å; F172-V176 VanDerWaalsContact CE2-CG2 3.41Å; F172-V176 HydrophobicContact CG-CG2 4.31Å; F172-V176 HydrophobicContact CZ-CG2 3.6Å; F172-V176 VanDerWaalsContact O-CG2 3.23Å; F172-V176 WeakPolarHBondContact O-CG2 3.42Å; F172-V176 PolarHBondContact O-N 3.49Å; F172-V176 VanDerWaalsContact O-N 3.08Å; V176-E178 PolarHBondContact O-N 3.14Å; V176-E178 VanDerWaalsContact O-N 3.12Å; V176-H179 PolarHBondContact O-N 3.46Å; V176-F180 HydrophobicContact CG2-CB 4.38Å; V176-F180 HydrophobicContact CG2-CD2 4.47Å; V176-F180 WeakPolarHBondContact O-CB 3.19Å; V176-F180 PolarHBondContact O-N 3.4Å
177P90.6Very high95.9Very high61 Ų6150.1 Ų50.140%0.39625%0.249SC..Hα-helixtrans-61.9-29.5-169.626.3-35.7000113.7K174 S175 H179K174-P177 WeakPolarHBondContact O-CD 3.39Å; S175-P177 VanDerWaalsContact C-CD 3.45Å; P177-H179 VanDerWaalsContact C-N 3.31Å; P177-H179 PolarHBondContact O-N 3.07Å
178E91.3Very high95.8Very high152 Ų15244.5 Ų44.571%0.7123%0.229SC*.Hα-helixtrans-68.9-27.1179.1-65.8179.7176.900113.4V176 H181V176-E178 PolarHBondContact O-N 3.14Å; V176-E178 VanDerWaalsContact O-N 3.12Å; E178-H181 PolarHBondContact O-CE1 3.01Å; E178-H181 PolarHBondContact O-ND1 2.92Å
179H94.2Very high95.7Very high72 Ų7251.7 Ų51.733%0.33326%0.26SS..Hα-helixtrans-111.7-25.6-174-60.781.2000112.4L143 V176 P177 H181 M182L143-H179 WeakPolarHBondContact CD2-O 3.33Å; V176-H179 PolarHBondContact O-N 3.46Å; P177-H179 VanDerWaalsContact C-N 3.31Å; P177-H179 PolarHBondContact O-N 3.07Å; H179-H181 PolarHBondContact O-N 3Å; H179-H181 VanDerWaalsContact O-N 3.15Å; H179-M182 WeakPolarHBondContact O-CB 3.44Å; H179-M182 WeakPolarHBondContact O-CG 3.45Å; H179-M182 PolarHBondContact O-N 2.81Å
180F95.6Very high95.7Very high0 Ų052.3 Ų52.30%026%0.264CS..Hα-helixtrans-54.4-38.8-173.8-171.2-98.6000113.4I147 F172 A173 V176 M182 Q183 A184 L187 V213 H216I147-F180 HydrophobicContact CD1-CD2 4.42Å; I147-F180 HydrophobicContact CD1-CE2 3.81Å; I147-F180 HydrophobicContact CD1-CZ 4.41Å; F172-F180 AromaticContact CD1-CD2 3.92Å; F172-F180 HydrophobicContact CD1-CD2 3.92Å; F172-F180 AromaticContact CD1-CE2 3.78Å; F172-F180 HydrophobicContact CD1-CE2 3.78Å; F172-F180 HydrophobicContact CE1-CD2 4.07Å; F172-F180 HydrophobicContact CE1-CE2 4.22Å; A173-F180 HydrophobicContact CB-CD1 3.98Å; A173-F180 HydrophobicContact CB-CD2 4.11Å; A173-F180 HydrophobicContact CB-CE1 3.8Å; A173-F180 HydrophobicContact CB-CE2 3.91Å; A173-F180 HydrophobicContact CB-CG 4.13Å; A173-F180 HydrophobicContact CB-CZ 3.75Å; V176-F180 HydrophobicContact CG2-CB 4.38Å; V176-F180 HydrophobicContact CG2-CD2 4.47Å; V176-F180 WeakPolarHBondContact O-CB 3.19Å; V176-F180 PolarHBondContact O-N 3.4Å; F180-M182 PolarHBondContact O-N 3.39Å; F180-Q183 PolarHBondContact O-N 3.33Å; F180-Q183 VanDerWaalsContact O-N 3.07Å; F180-A184 HydrophobicContact CD1-CB 3.7Å; F180-A184 HydrophobicContact CE1-CB 3.48Å; F180-A184 VanDerWaalsContact CE1-CB 3.48Å; F180-A184 HydrophobicContact CZ-CB 4.34Å; F180-A184 PolarHBondContact O-N 2.86Å; F180-L187 HydrophobicContact CE2-CD1 4.33Å; F180-L187 HydrophobicContact CZ-CD1 3.87Å; F180-V213 HydrophobicContact CE1-CG2 4.25Å; F180-V213 HydrophobicContact CZ-CG2 4.04Å; F180-H216 HydrophobicContact CD1-CB 3.91Å
181H93.8Very high95.7Very high83 Ų8351 Ų5138%0.38426%0.257SS..THydrogen-bonded Turntrans-55.9-22.4179.174.3-85.1000114.6E178 H179 Q183 H216E178-H181 PolarHBondContact O-CE1 3.01Å; E178-H181 PolarHBondContact O-ND1 2.92Å; H179-H181 PolarHBondContact O-N 3Å; H179-H181 VanDerWaalsContact O-N 3.15Å; H181-Q183 VanDerWaalsContact C-N 3.26Å; H181-Q183 PolarHBondContact O-N 2.64Å; H181-H216 PolarHBondContact N-O 3.43Å
182M94.8Very high95.7Very high122 Ų12251 Ų5160%0.60125%0.25SS*.THydrogen-bonded Turntrans-68.1-24.6179.1-61.3-179.2-178.600113L143 H179 F180L143-M182 HydrophobicContact CD2-CB 4.05Å; H179-M182 WeakPolarHBondContact O-CB 3.44Å; H179-M182 WeakPolarHBondContact O-CG 3.45Å; H179-M182 PolarHBondContact O-N 2.81Å; F180-M182 PolarHBondContact O-N 3.39Å
183Q95.3Very high95.6Very high65 Ų6556.7 Ų56.730%0.30428%0.277SS..THydrogen-bonded Turntrans-132.1-3.8-175.4-72.1-72.513.100114L143 N144 I147 F180 H181 E185 S186L143-Q183 HydrophobicContact CD2-CB 4.17Å; L143-Q183 HydrophobicContact CD2-CG 3.83Å; L143-Q183 HydrophobicContact CG-CB 4.26Å; L143-Q183 HydrophobicContact CG-CG 4.08Å; N144-Q183 PolarHBondContact OD1-NE2 2.82Å; I147-Q183 HydrophobicContact CB-CB 4.44Å; I147-Q183 HydrophobicContact CD1-CB 4.43Å; I147-Q183 HydrophobicContact CG1-CB 3.87Å; I147-Q183 HydrophobicContact CG2-CB 4.23Å; F180-Q183 PolarHBondContact O-N 3.33Å; F180-Q183 VanDerWaalsContact O-N 3.07Å; H181-Q183 VanDerWaalsContact C-N 3.26Å; H181-Q183 PolarHBondContact O-N 2.64Å; Q183-E185 VanDerWaalsContact C-N 3.3Å; Q183-E185 PolarHBondContact O-N 3.49Å; Q183-S186 VanDerWaalsContact O-CB 3.29Å; Q183-S186 WeakPolarHBondContact O-CB 3.43Å; Q183-S186 PolarHBondContact O-N 3.2Å; Q183-S186 VanDerWaalsContact O-N 3.11Å; Q183-S186 PolarHBondContact O-OG 3.1Å
184A94.5Very high95.6Very high2 Ų256.8 Ų56.82%0.01728%0.278CS..G310 helixtrans-52.8-41.8-176.200000114.1F180 S186 L187 V213F180-A184 HydrophobicContact CD1-CB 3.7Å; F180-A184 HydrophobicContact CE1-CB 3.48Å; F180-A184 VanDerWaalsContact CE1-CB 3.48Å; F180-A184 HydrophobicContact CZ-CB 4.34Å; F180-A184 PolarHBondContact O-N 2.86Å; A184-S186 PolarHBondContact O-N 3.31Å; A184-S186 VanDerWaalsContact O-N 3.13Å; A184-L187 WeakPolarHBondContact O-CB 3.43Å; A184-L187 PolarHBondContact O-N 3Å; A184-V213 HydrophobicContact CB-CG1 4.31Å; A184-V213 WeakPolarHBondContact O-CG1 3.49Å
185E95.5Very high95.7Very high115 Ų11550.5 Ų50.554%0.53725%0.25SS..G310 helixtrans-54.9-34-179.4175.3166.6-158.300112.6Q183 L187 V188 N221Q183-E185 VanDerWaalsContact C-N 3.3Å; Q183-E185 PolarHBondContact O-N 3.49Å; E185-L187 PolarHBondContact O-N 3.17Å; E185-L187 VanDerWaalsContact O-N 3.11Å; E185-V188 WeakPolarHBondContact O-CB 3.4Å; E185-V188 WeakPolarHBondContact O-CG2 3.29Å; E185-V188 PolarHBondContact O-N 2.76Å; E185-V188 VanDerWaalsContact O-N 3.09Å; E185-N221 WeakPolarHBondContact CB-OD1 3.4Å; E185-N221 WeakPolarHBondContact CG-OD1 3.3Å; E185-N221 PolarHBondContact OE1-ND2 3.01Å; E185-N221 VanDerWaalsContact OE1-ND2 3.11Å
186S96Very high95.7Very high29 Ų2952 Ų5220%0.20326%0.26CS..G310 helixtrans-65.3-17.5-177.881.10000113.5I147 Q151 Q183 A184 P190I147-S186 WeakPolarHBondContact CG2-OG 3.31Å; Q151-S186 PolarHBondContact NE2-O 3.19Å; Q151-S186 PolarHBondContact NE2-OG 3.47Å; Q183-S186 VanDerWaalsContact O-CB 3.29Å; Q183-S186 WeakPolarHBondContact O-CB 3.43Å; Q183-S186 PolarHBondContact O-N 3.2Å; Q183-S186 VanDerWaalsContact O-N 3.11Å; Q183-S186 PolarHBondContact O-OG 3.1Å; A184-S186 PolarHBondContact O-N 3.31Å; A184-S186 VanDerWaalsContact O-N 3.13Å; S186-P190 WeakPolarHBondContact O-CD 3.49Å
187L97.6Very high95.8Very high0 Ų053.4 Ų53.40%027%0.267CS..G310 helixtrans-90.7-16.1177.5-63.4175.3000113.5I147 L150 Q151 I154 T169 F180 A184 E185 K189 P190 L191 V213I147-L187 HydrophobicContact CD1-CD1 3.62Å; I147-L187 HydrophobicContact CD1-CG 4.14Å; I147-L187 HydrophobicContact CG2-CD2 4.27Å; I147-L187 HydrophobicContact CG2-CG 4.4Å; L150-L187 HydrophobicContact CB-CD2 3.85Å; Q151-L187 HydrophobicContact CG-CD2 3.76Å; I154-L187 HydrophobicContact CD1-CD2 3.97Å; T169-L187 HydrophobicContact CG2-CD1 3.8Å; F180-L187 HydrophobicContact CE2-CD1 4.33Å; F180-L187 HydrophobicContact CZ-CD1 3.87Å; A184-L187 WeakPolarHBondContact O-CB 3.43Å; A184-L187 PolarHBondContact O-N 3Å; E185-L187 PolarHBondContact O-N 3.17Å; E185-L187 VanDerWaalsContact O-N 3.11Å; L187-K189 PolarHBondContact O-N 2.74Å; L187-P190 WeakPolarHBondContact O-CD 3.37Å; L187-L191 HydrophobicContact CB-CD1 4.31Å; L187-L191 WeakPolarHBondContact O-CB 3.2Å; L187-L191 WeakPolarHBondContact O-CD1 3.35Å; L187-L191 VanDerWaalsContact O-CG 3.28Å; L187-L191 WeakPolarHBondContact O-CG 3.33Å; L187-L191 PolarHBondContact O-N 2.73Å; L187-L191 VanDerWaalsContact O-N 3.1Å; L187-V213 HydrophobicContact CB-CG1 4.46Å; L187-V213 HydrophobicContact CB-CG2 4.2Å; L187-V213 HydrophobicContact CD1-CG2 3.98Å
188V97.4Very high96Very high12 Ų1257.7 Ų57.77%0.07328%0.282CS..Hα-helixtrans-59.6-50.9-176174.40000110.8E185 L191 M192 V213 N221 D224 V225E185-V188 WeakPolarHBondContact O-CB 3.4Å; E185-V188 WeakPolarHBondContact O-CG2 3.29Å; E185-V188 PolarHBondContact O-N 2.76Å; E185-V188 VanDerWaalsContact O-N 3.09Å; V188-L191 PolarHBondContact O-N 3.03Å; V188-M192 HydrophobicContact CG1-CG 4.19Å; V188-M192 WeakPolarHBondContact O-CG 3.38Å; V188-M192 PolarHBondContact O-N 3.2Å; V188-V213 HydrophobicContact CG2-CG1 4.16Å; V188-N221 HydrophobicContact CG2-CB 3.89Å; V188-D224 HydrophobicContact CG1-CB 4.14Å; V188-V225 HydrophobicContact CG1-CG1 3.81Å
189K97Very high96.3Very high150 Ų15054.7 Ų54.765%0.65227%0.267SS*.Hα-helixtrans-60.1-50.6-179.4175.2179.7-178.8179.30113L187 L191 M192 Q193L187-K189 PolarHBondContact O-N 2.74Å; K189-L191 VanDerWaalsContact C-N 3.27Å; K189-L191 PolarHBondContact O-N 3.19Å; K189-M192 PolarHBondContact O-N 2.87Å; K189-Q193 WeakPolarHBondContact O-CG 3.48Å; K189-Q193 PolarHBondContact O-N 3.04Å; K189-Q193 VanDerWaalsContact O-N 3.08Å
190P97.6Very high96.4Very high13 Ų1353.2 Ų53.28%0.08427%0.265CS..Hα-helixtrans-52.3-41.7172.2-30.434.8000114.2Q151 I154 V155 S186 L187 Q193 T194Q151-P190 HydrophobicContact CB-CG 4.45Å; Q151-P190 HydrophobicContact CG-CG 4.46Å; I154-P190 HydrophobicContact CB-CB 4.11Å; I154-P190 HydrophobicContact CG2-CB 3.81Å; V155-P190 HydrophobicContact CG1-CB 3.85Å; S186-P190 WeakPolarHBondContact O-CD 3.49Å; L187-P190 WeakPolarHBondContact O-CD 3.37Å; P190-Q193 PolarHBondContact O-N 3.48Å; P190-T194 PolarHBondContact O-N 3.05Å; P190-T194 PolarHBondContact O-OG1 3.3Å
191L98.4Very high96.6Very high1 Ų162 Ų621%0.00530%0.298CS..Hα-helixtrans-68.8-42.7179.4-71.7167.9000112I154 L187 V188 K189 Q193 T194 I195 A209 V213I154-L191 HydrophobicContact CD1-CD2 4.08Å; I154-L191 HydrophobicContact CD1-CG 4.24Å; I154-L191 HydrophobicContact CG2-CD2 3.95Å; I154-L191 HydrophobicContact CG2-CG 4.33Å; L187-L191 HydrophobicContact CB-CD1 4.31Å; L187-L191 WeakPolarHBondContact O-CB 3.2Å; L187-L191 WeakPolarHBondContact O-CD1 3.35Å; L187-L191 VanDerWaalsContact O-CG 3.28Å; L187-L191 WeakPolarHBondContact O-CG 3.33Å; L187-L191 PolarHBondContact O-N 2.73Å; L187-L191 VanDerWaalsContact O-N 3.1Å; V188-L191 PolarHBondContact O-N 3.03Å; K189-L191 VanDerWaalsContact C-N 3.27Å; K189-L191 PolarHBondContact O-N 3.19Å; L191-Q193 VanDerWaalsContact C-N 3.25Å; L191-Q193 PolarHBondContact O-N 3.47Å; L191-T194 CarbonylContact O-C 3.39Å; L191-T194 WeakPolarHBondContact O-CA 3.32Å; L191-T194 PolarHBondContact O-N 3.2Å; L191-I195 PolarHBondContact O-N 3.28Å; L191-A209 HydrophobicContact CD1-CB 4.46Å; L191-A209 HydrophobicContact CD2-CB 3.7Å; L191-V213 HydrophobicContact CD1-CB 4.25Å; L191-V213 HydrophobicContact CD1-CG2 3.77Å
192M97.3Very high96.8Very high22 Ų2258.1 Ų58.111%0.10828%0.28CS..Hα-helixtrans-67.2-26177.7-65.1-52.596.100112.7V188 K189 T194 I195 T210 V225 H228V188-M192 HydrophobicContact CG1-CG 4.19Å; V188-M192 WeakPolarHBondContact O-CG 3.38Å; V188-M192 PolarHBondContact O-N 3.2Å; K189-M192 PolarHBondContact O-N 2.87Å; M192-T194 VanDerWaalsContact C-N 3.33Å; M192-I195 HydrophobicContact CE-CD1 4.12Å; M192-I195 WeakPolarHBondContact O-CG2 3.48Å; M192-I195 HydrophobicContact SD-CG2 4.49Å; M192-T210 HydrophobicContact CE-CG2 3.65Å; M192-T210 WeakPolarHBondContact CE-OG1 3.47Å; M192-V225 HydrophobicContact CE-CB 4.16Å; M192-V225 HydrophobicContact CE-CG1 3.82Å; M192-V225 HydrophobicContact CG-CG1 4.38Å; M192-V225 HydrophobicContact SD-CB 3.97Å; M192-V225 HydrophobicContact SD-CG1 3.82Å; M192-H228 HydrophobicContact SD-CB 3.69Å; M192-H228 PolarHBondContact SD-CD2 3.37Å
193Q96.6Very high97Very high121 Ų12153.7 Ų53.757%0.56526%0.257SS*.Hα-helixtrans-70.7-31.2168.9-70.2177.3-14.900112.2V155 K189 P190 L191V155-Q193 HydrophobicContact CG1-CB 4.29Å; K189-Q193 WeakPolarHBondContact O-CG 3.48Å; K189-Q193 PolarHBondContact O-N 3.04Å; K189-Q193 VanDerWaalsContact O-N 3.08Å; P190-Q193 PolarHBondContact O-N 3.48Å; L191-Q193 VanDerWaalsContact C-N 3.25Å; L191-Q193 PolarHBondContact O-N 3.47Å
194T97.9Very high97.1Very high2 Ų251.7 Ų51.71%0.01225%0.249CC..Hα-helixtrans-92.6-23.5-172.9-56.70000113.3I154 K162 P190 L191 M192 S196 H197 V202 A206I154-T194 PolarHBondContact O-OG1 3.46Å; I154-T194 VanDerWaalsContact O-OG1 3.05Å; K162-T194 HydrophobicContact CB-CG2 4.38Å; K162-T194 HydrophobicContact CD-CG2 3.92Å; P190-T194 PolarHBondContact O-N 3.05Å; P190-T194 PolarHBondContact O-OG1 3.3Å; L191-T194 CarbonylContact O-C 3.39Å; L191-T194 WeakPolarHBondContact O-CA 3.32Å; L191-T194 PolarHBondContact O-N 3.2Å; M192-T194 VanDerWaalsContact C-N 3.33Å; T194-S196 PolarHBondContact O-N 3.01Å; T194-S196 VanDerWaalsContact O-N 3.11Å; T194-H197 WeakPolarHBondContact O-CB 3.38Å; T194-H197 PolarHBondContact O-N 3.13Å; T194-V202 HydrophobicContact CG2-CG1 3.64Å; T194-A206 HydrophobicContact CG2-CB 4.12Å
195I97.5Very high97.3Very high0 Ų052.6 Ų52.60%026%0.256CS..THydrogen-bonded Turntrans-63.8-17.9-179-160.3165.8000114.2L191 M192 R203 A206 I207 H228 L229 R232L191-I195 PolarHBondContact O-N 3.28Å; M192-I195 HydrophobicContact CE-CD1 4.12Å; M192-I195 WeakPolarHBondContact O-CG2 3.48Å; M192-I195 HydrophobicContact SD-CG2 4.49Å; I195-R203 VanDerWaalsContact O-CD 3.23Å; I195-R203 WeakPolarHBondContact O-CD 3.38Å; I195-R203 VanDerWaalsContact O-CG 3.32Å; I195-R203 WeakPolarHBondContact O-CG 3.39Å; I195-A206 HydrophobicContact CB-CB 4.41Å; I195-I207 HydrophobicContact CD1-CG1 3.75Å; I195-I207 HydrophobicContact CG1-CG1 3.82Å; I195-H228 HydrophobicContact CD1-CB 4.27Å; I195-H228 HydrophobicContact CG2-CB 4.15Å; I195-L229 HydrophobicContact CD1-CD2 4.02Å; I195-R232 HydrophobicContact CD1-CG 4.46Å; I195-R232 HydrophobicContact CG1-CG 4.15Å; I195-R232 PolarHBondContact O-NH1 2.81Å
196S95.6Very high97.5Very high65 Ų6547.1 Ų47.146%0.45523%0.23SC..THydrogen-bonded Turntrans-10317.4177.4-62.40000113.5T194 R232T194-S196 PolarHBondContact O-N 3.01Å; T194-S196 VanDerWaalsContact O-N 3.11Å; S196-R232 VanDerWaalsContact CA-NH1 3.33Å; S196-R232 PolarHBondContact OG-NH1 3.36Å
197H97.4Very high97.6Very high34 Ų3445.8 Ų45.816%0.15722%0.22CC..  trans-61.6148.8-179.9-167.5-96.6000113T194 H199 V202 R203T194-H197 WeakPolarHBondContact O-CB 3.38Å; T194-H197 PolarHBondContact O-N 3.13Å; H197-H199 VanDerWaalsContact C-N 3.31Å; H197-H199 AromaticContact CE1-CD2 3.45Å; H197-H199 PolarHBondContact CE1-CD2 3.03Å; H197-H199 VanDerWaalsContact CE1-CD2 3.45Å; H197-H199 AromaticContact CE1-CG 3.97Å; H197-H199 AromaticContact ND1-CD2 3.97Å; H197-H199 PolarHBondContact ND1-N 2.91Å; H197-H199 VanDerWaalsContact ND1-N 3.18Å; H197-H199 PolarHBondContact O-N 3.38Å; H197-V202 HydrophobicContact CB-CB 4.09Å; H197-V202 HydrophobicContact CB-CG1 3.79Å; H197-R203 HydrophobicContact CB-CG 4.31Å; H197-R203 WeakPolarHBondContact O-CD 3.49Å; H197-R203 WeakPolarHBondContact O-CG 3.46Å; H197-R203 PolarHBondContact O-NH1 2.77Å
198Q96.1Very high97.7Very high152 Ų15250.4 Ų50.471%0.7124%0.242SC*.SBendtrans-59.3-36.2-178.664.8-179.49.400113.9R203Q198-R203 VanDerWaalsContact C-NH1 3.33Å; Q198-R203 PolarHBondContact O-NH1 3.21Å
199H96.1Very high97.7Very high89 Ų8949.8 Ų49.841%0.41224%0.238SC..SBendtrans-87.1122.9-179.9-58.8-44.1000111.9H197 R201 V202 R203H197-H199 VanDerWaalsContact C-N 3.31Å; H197-H199 AromaticContact CE1-CD2 3.45Å; H197-H199 PolarHBondContact CE1-CD2 3.03Å; H197-H199 VanDerWaalsContact CE1-CD2 3.45Å; H197-H199 AromaticContact CE1-CG 3.97Å; H197-H199 AromaticContact ND1-CD2 3.97Å; H197-H199 PolarHBondContact ND1-N 2.91Å; H197-H199 VanDerWaalsContact ND1-N 3.18Å; H197-H199 PolarHBondContact O-N 3.38Å; H199-R201 VanDerWaalsContact C-N 3.31Å; H199-R201 PolarHBondContact O-N 3.24Å; H199-V202 HydrophobicContact CB-CG2 4.08Å; H199-V202 WeakPolarHBondContact O-CB 3.4Å; H199-V202 PolarHBondContact O-N 2.69Å; H199-R203 PolarHBondContact O-N 2.89Å
200S97.8Very high97.8Very high41 Ų4142.8 Ų42.829%0.28721%0.208SC..Hα-helixtrans-57.1-39.1-178.756.90000113.5V202 R203 V204 S237S200-V202 VanDerWaalsContact C-N 3.27Å; S200-V202 PolarHBondContact O-N 2.87Å; S200-R203 WeakPolarHBondContact O-CB 3.31Å; S200-R203 PolarHBondContact O-N 3.25Å; S200-R203 VanDerWaalsContact O-N 3.09Å; S200-V204 WeakPolarHBondContact O-CG2 3.43Å; S200-V204 PolarHBondContact O-N 3.1Å; S200-S237 WeakPolarHBondContact CB-OG 3.29Å
201R98.3Very high97.7Very high184 Ų18442.3 Ų42.369%0.69421%0.205SC*.Hα-helixtrans-60.7-34.3177.8-62.6-178.781173.75.5112.9K163 H199 S205K163-R201 HydrophobicContact CD-CB 4.14Å; H199-R201 VanDerWaalsContact C-N 3.31Å; H199-R201 PolarHBondContact O-N 3.24Å; R201-S205 PolarHBondContact O-N 3.47Å; R201-S205 PolarHBondContact O-OG 3.03Å
202V98.3Very high97.7Very high2 Ų242.6 Ų42.61%0.01221%0.208CC..Hα-helixtrans-70.8-42.4174.9179.20000110.2P159 K162 K163 T194 H197 H199 S200 V204 S205 A206P159-V202 HydrophobicContact CB-CG2 3.95Å; K162-V202 HydrophobicContact CB-CG1 3.96Å; K162-V202 HydrophobicContact CD-CG1 3.78Å; K163-V202 HydrophobicContact CD-CG2 4.39Å; K163-V202 HydrophobicContact CG-CG2 3.98Å; T194-V202 HydrophobicContact CG2-CG1 3.64Å; H197-V202 HydrophobicContact CB-CB 4.09Å; H197-V202 HydrophobicContact CB-CG1 3.79Å; H199-V202 HydrophobicContact CB-CG2 4.08Å; H199-V202 WeakPolarHBondContact O-CB 3.4Å; H199-V202 PolarHBondContact O-N 2.69Å; S200-V202 VanDerWaalsContact C-N 3.27Å; S200-V202 PolarHBondContact O-N 2.87Å; V202-V204 VanDerWaalsContact C-N 3.35Å; V202-V204 PolarHBondContact O-N 3.27Å; V202-S205 PolarHBondContact O-N 3.07Å; V202-A206 WeakPolarHBondContact O-CB 3.38Å; V202-A206 PolarHBondContact O-N 3.16Å
203R98.4Very high97.7Very high28 Ų2841.7 Ų41.711%0.10620%0.204CC..Hα-helixtrans-60.4-43.9176.4-59.8-163.6-65.6-85.37.8111.7I195 H197 Q198 H199 S200 A206 I207 D235 V240I195-R203 VanDerWaalsContact O-CD 3.23Å; I195-R203 WeakPolarHBondContact O-CD 3.38Å; I195-R203 VanDerWaalsContact O-CG 3.32Å; I195-R203 WeakPolarHBondContact O-CG 3.39Å; H197-R203 HydrophobicContact CB-CG 4.31Å; H197-R203 WeakPolarHBondContact O-CD 3.49Å; H197-R203 WeakPolarHBondContact O-CG 3.46Å; H197-R203 PolarHBondContact O-NH1 2.77Å; Q198-R203 VanDerWaalsContact C-NH1 3.33Å; Q198-R203 PolarHBondContact O-NH1 3.21Å; H199-R203 PolarHBondContact O-N 2.89Å; S200-R203 WeakPolarHBondContact O-CB 3.31Å; S200-R203 PolarHBondContact O-N 3.25Å; S200-R203 VanDerWaalsContact O-N 3.09Å; R203-A206 PolarHBondContact O-N 2.95Å; R203-I207 WeakPolarHBondContact O-CD1 3.03Å; R203-I207 VanDerWaalsContact O-CG1 3.26Å; R203-I207 WeakPolarHBondContact O-CG1 2.97Å; R203-I207 PolarHBondContact O-N 2.78Å; R203-D235 IonicContact CZ-OD1 3.05Å; R203-D235 IonicContact CZ-OD2 2.74Å; R203-D235 VanDerWaalsContact CZ-OD2 3.26Å; R203-D235 IonicContact NE-OD1 3.38Å; R203-D235 IonicContact NE-OD2 3.01Å; R203-D235 PolarHBondContact NE-OD2 3.44Å; R203-D235 VanDerWaalsContact NH2-CG 3.34Å; R203-D235 IonicContact NH2-OD1 2.93Å; R203-D235 PolarHBondContact NH2-OD1 2.8Å; R203-D235 IonicContact NH2-OD2 2.73Å; R203-D235 PolarHBondContact NH2-OD2 2.95Å; R203-D235 VanDerWaalsContact NH2-OD2 3.12Å; R203-V240 HydrophobicContact CB-CG1 4.34Å; R203-V240 HydrophobicContact CB-CG2 4.04Å
204V98.8Very high97.6Very high24 Ų2436.2 Ų36.215%0.14518%0.178CC..Hα-helixtrans-55.5-53.7174.51710000110.6S200 V202 A206 I207 E208 Q239 V240 A243S200-V204 WeakPolarHBondContact O-CG2 3.43Å; S200-V204 PolarHBondContact O-N 3.1Å; V202-V204 VanDerWaalsContact C-N 3.35Å; V202-V204 PolarHBondContact O-N 3.27Å; V204-A206 VanDerWaalsContact C-N 3.3Å; V204-A206 PolarHBondContact O-N 3.28Å; V204-I207 PolarHBondContact O-N 3.35Å; V204-I207 VanDerWaalsContact O-N 3.11Å; V204-E208 HydrophobicContact CG1-CG 4.48Å; V204-E208 WeakPolarHBondContact O-CG 3.48Å; V204-E208 PolarHBondContact O-N 3.22Å; V204-Q239 HydrophobicContact CG2-CB 4.16Å; V204-V240 HydrophobicContact CG2-CG2 3.88Å; V204-A243 HydrophobicContact CG1-CB 4.09Å; V204-A243 HydrophobicContact CG2-CB 4.42Å
205S98.6Very high97.5Very high21 Ų2137.5 Ų37.515%0.14718%0.184CC..Hα-helixtrans-60.9-39.2179.5-570000112.4C166 R201 V202 E208 A209C166-S205 WeakPolarHBondContact CB-O 3.31Å; R201-S205 PolarHBondContact O-N 3.47Å; R201-S205 PolarHBondContact O-OG 3.03Å; V202-S205 PolarHBondContact O-N 3.07Å; S205-E208 PolarHBondContact O-N 2.98Å; S205-A209 VanDerWaalsContact O-CB 3.31Å; S205-A209 WeakPolarHBondContact O-CB 3.33Å; S205-A209 PolarHBondContact O-N 2.62Å
206A98.6Very high97.3Very high0 Ų039.7 Ų39.70%019%0.194CC..Hα-helixtrans-65-37.3175.900000112.4T194 I195 V202 R203 V204 T210T194-A206 HydrophobicContact CG2-CB 4.12Å; I195-A206 HydrophobicContact CB-CB 4.41Å; V202-A206 WeakPolarHBondContact O-CB 3.38Å; V202-A206 PolarHBondContact O-N 3.16Å; R203-A206 PolarHBondContact O-N 2.95Å; V204-A206 VanDerWaalsContact C-N 3.3Å; V204-A206 PolarHBondContact O-N 3.28Å; A206-T210 VanDerWaalsContact O-CB 3.31Å; A206-T210 WeakPolarHBondContact O-CB 3.46Å; A206-T210 PolarHBondContact O-N 3.05Å; A206-T210 PolarHBondContact O-OG1 3.3Å
207I98.8Very high97.1Very high0 Ų037.6 Ų37.60%018%0.183CC..Hα-helixtrans-66.3-47.4175.6-70.7158.8000110.4I195 R203 V204 A209 T210 G211 L229 R232 V240 A243 V244 V247I195-I207 HydrophobicContact CD1-CG1 3.75Å; I195-I207 HydrophobicContact CG1-CG1 3.82Å; R203-I207 WeakPolarHBondContact O-CD1 3.03Å; R203-I207 VanDerWaalsContact O-CG1 3.26Å; R203-I207 WeakPolarHBondContact O-CG1 2.97Å; R203-I207 PolarHBondContact O-N 2.78Å; V204-I207 PolarHBondContact O-N 3.35Å; V204-I207 VanDerWaalsContact O-N 3.11Å; I207-A209 PolarHBondContact O-N 2.85Å; I207-T210 WeakPolarHBondContact O-CB 3.47Å; I207-T210 PolarHBondContact O-N 3.17Å; I207-G211 PolarHBondContact O-N 2.89Å; I207-L229 HydrophobicContact CG1-CD2 4.19Å; I207-L229 HydrophobicContact CG2-CD2 4.01Å; I207-R232 HydrophobicContact CD1-CB 4.24Å; I207-R232 HydrophobicContact CD1-CG 4.18Å; I207-V240 HydrophobicContact CD1-CG1 3.53Å; I207-A243 HydrophobicContact CB-CB 4.3Å; I207-A243 HydrophobicContact CD1-CB 4.44Å; I207-A243 HydrophobicContact CG2-CB 3.94Å; I207-V244 HydrophobicContact CD1-CG2 3.79Å; I207-V244 HydrophobicContact CG1-CG2 4.38Å; I207-V244 HydrophobicContact CG2-CG2 4.2Å; I207-V247 HydrophobicContact CG2-CB 4.37Å; I207-V247 HydrophobicContact CG2-CG2 3.91Å
208E98.6Very high96.5Very high97 Ų9738.7 Ų38.745%0.45319%0.194SC..Hα-helixtrans-61.1-44.1178.1-69.1172.1165.500111.9V170 V204 S205 G211 A212V170-E208 HydrophobicContact CG2-CB 4.46Å; V204-E208 HydrophobicContact CG1-CG 4.48Å; V204-E208 WeakPolarHBondContact O-CG 3.48Å; V204-E208 PolarHBondContact O-N 3.22Å; S205-E208 PolarHBondContact O-N 2.98Å; E208-G211 PolarHBondContact O-N 3.31Å; E208-A212 PolarHBondContact O-N 3.21Å
209A98.5Very high95.6Very high0 Ų032.1 Ų32.10%017%0.167CC..Hα-helixtrans-63.8-42.1174.300000112.2C166 T169 V170 L191 S205 I207 G211 A212 V213C166-A209 HydrophobicContact CB-CB 3.77Å; T169-A209 HydrophobicContact CG2-CB 4.37Å; V170-A209 HydrophobicContact CG2-CB 4.15Å; L191-A209 HydrophobicContact CD1-CB 4.46Å; L191-A209 HydrophobicContact CD2-CB 3.7Å; S205-A209 VanDerWaalsContact O-CB 3.31Å; S205-A209 WeakPolarHBondContact O-CB 3.33Å; S205-A209 PolarHBondContact O-N 2.62Å; I207-A209 PolarHBondContact O-N 2.85Å; A209-G211 VanDerWaalsContact C-N 3.28Å; A209-G211 PolarHBondContact O-N 3.12Å; A209-A212 PolarHBondContact O-N 3.33Å; A209-V213 WeakPolarHBondContact O-CB 3.38Å; A209-V213 VanDerWaalsContact O-CG2 3.29Å; A209-V213 WeakPolarHBondContact O-CG2 3.39Å; A209-V213 PolarHBondContact O-N 3.04Å
210T98.2Very high95.1Very high2 Ų235.2 Ų35.21%0.01218%0.18CC..Hα-helixtrans-57.3-45.1172.5-57.70000110.8M192 A206 I207 A212 V213 I214 V225M192-T210 HydrophobicContact CE-CG2 3.65Å; M192-T210 WeakPolarHBondContact CE-OG1 3.47Å; A206-T210 VanDerWaalsContact O-CB 3.31Å; A206-T210 WeakPolarHBondContact O-CB 3.46Å; A206-T210 PolarHBondContact O-N 3.05Å; A206-T210 PolarHBondContact O-OG1 3.3Å; I207-T210 WeakPolarHBondContact O-CB 3.47Å; I207-T210 PolarHBondContact O-N 3.17Å; T210-A212 PolarHBondContact O-N 3.35Å; T210-V213 PolarHBondContact O-N 3.33Å; T210-I214 HydrophobicContact CG2-CG1 4.43Å; T210-I214 WeakPolarHBondContact O-CG1 3.29Å; T210-I214 PolarHBondContact O-N 2.93Å; T210-V225 HydrophobicContact CG2-CB 3.94Å; T210-V225 HydrophobicContact CG2-CG1 3.86Å; T210-V225 HydrophobicContact CG2-CG2 4.23Å
211G97Very high94.9Very high3 Ų333.9 Ų33.93%0.03117%0.169CC..Hα-helixtrans-50.3-56.3174.100000112.4I207 E208 A209 V213 Q215 V247 W251I207-G211 PolarHBondContact O-N 2.89Å; E208-G211 PolarHBondContact O-N 3.31Å; A209-G211 VanDerWaalsContact C-N 3.28Å; A209-G211 PolarHBondContact O-N 3.12Å; G211-V213 PolarHBondContact O-N 3.17Å; G211-Q215 WeakPolarHBondContact O-CB 3.45Å; G211-Q215 PolarHBondContact O-N 3.4Å; G211-V247 VanDerWaalsContact CA-CG1 3.41Å; G211-W251 PolarHBondContact O-NE1 3.07Å
212A96.9Very high94.7Very high8 Ų825.1 Ų25.17%0.06614%0.136CC..Hα-helixtrans-64.3-39.1179.600000113.1V170 A173 E208 A209 T210 Q215 H216V170-A212 HydrophobicContact CB-CB 4.23Å; V170-A212 HydrophobicContact CG1-CB 4.19Å; V170-A212 HydrophobicContact CG2-CB 3.98Å; A173-A212 HydrophobicContact CB-CB 4.17Å; E208-A212 PolarHBondContact O-N 3.21Å; A209-A212 PolarHBondContact O-N 3.33Å; T210-A212 PolarHBondContact O-N 3.35Å; A212-Q215 PolarHBondContact O-N 2.88Å; A212-H216 PolarHBondContact O-CD2 3.43Å; A212-H216 PolarHBondContact O-N 3.34Å
213V96.9Very high94.4Very high2 Ų228.9 Ų28.91%0.01216%0.156CC..Hα-helixtrans-62.9-43.7-179.4165.60000111.8T169 F180 A184 L187 V188 L191 A209 T210 G211 G217T169-V213 HydrophobicContact CG2-CG2 3.61Å; F180-V213 HydrophobicContact CE1-CG2 4.25Å; F180-V213 HydrophobicContact CZ-CG2 4.04Å; A184-V213 HydrophobicContact CB-CG1 4.31Å; A184-V213 WeakPolarHBondContact O-CG1 3.49Å; L187-V213 HydrophobicContact CB-CG1 4.46Å; L187-V213 HydrophobicContact CB-CG2 4.2Å; L187-V213 HydrophobicContact CD1-CG2 3.98Å; V188-V213 HydrophobicContact CG2-CG1 4.16Å; L191-V213 HydrophobicContact CD1-CB 4.25Å; L191-V213 HydrophobicContact CD1-CG2 3.77Å; A209-V213 WeakPolarHBondContact O-CB 3.38Å; A209-V213 VanDerWaalsContact O-CG2 3.29Å; A209-V213 WeakPolarHBondContact O-CG2 3.39Å; A209-V213 PolarHBondContact O-N 3.04Å; T210-V213 PolarHBondContact O-N 3.33Å; G211-V213 PolarHBondContact O-N 3.17Å; V213-G217 VanDerWaalsContact O-CA 3.24Å; V213-G217 WeakPolarHBondContact O-CA 3.34Å; V213-G217 PolarHBondContact O-N 3.45Å
214I95.7Very high94.2Very high6 Ų631.5 Ų31.53%0.03117%0.172CC..Hα-helixtrans-72.5-44.4177.4-62-58.6000110.9T210 H216 G217 N221 V222 V225 W251 M255T210-I214 HydrophobicContact CG2-CG1 4.43Å; T210-I214 WeakPolarHBondContact O-CG1 3.29Å; T210-I214 PolarHBondContact O-N 2.93Å; I214-H216 VanDerWaalsContact C-N 3.31Å; I214-H216 PolarHBondContact O-N 2.99Å; I214-G217 PolarHBondContact O-N 2.97Å; I214-G217 VanDerWaalsContact O-N 3.14Å; I214-N221 HydrophobicContact CD1-CB 3.98Å; I214-V222 HydrophobicContact CG2-CG2 3.55Å; I214-V225 HydrophobicContact CD1-CG1 4.19Å; I214-V225 HydrophobicContact CD1-CG2 4.2Å; I214-V225 HydrophobicContact CG1-CG1 4.49Å; I214-V225 HydrophobicContact CG1-CG2 4.01Å; I214-W251 HydrophobicContact CB-CH2 4.22Å; I214-W251 HydrophobicContact CB-CZ2 3.47Å; I214-W251 VanDerWaalsContact CB-CZ2 3.47Å; I214-W251 HydrophobicContact CG1-CH2 4.07Å; I214-W251 HydrophobicContact CG1-CZ2 3.7Å; I214-W251 HydrophobicContact CG2-CH2 4.29Å; I214-W251 HydrophobicContact CG2-CZ2 3.79Å; I214-M255 HydrophobicContact CG2-SD 4.03Å
215Q94.6Very high94.1Very high29 Ų2930.3 Ų30.314%0.13617%0.165CC..Hα-helixtrans-56.5-41.8-178.8179.166.311.600112.8G211 A212 N254 M255G211-Q215 WeakPolarHBondContact O-CB 3.45Å; G211-Q215 PolarHBondContact O-N 3.4Å; A212-Q215 PolarHBondContact O-N 2.88Å; Q215-N254 VanDerWaalsContact NE2-CB 3.26Å; Q215-N254 PolarHBondContact NE2-O 2.94Å; Q215-M255 VanDerWaalsContact OE1-CA 3.23Å
216H93.8Very high93.9Very high46 Ų4630.2 Ų30.221%0.21316%0.163CC..THydrogen-bonded Turntrans-103.25.9179.7-61-70.7000113.4A173 F180 H181 A212 I214A173-H216 HydrophobicContact CB-CB 4.2Å; F180-H216 HydrophobicContact CD1-CB 3.91Å; H181-H216 PolarHBondContact N-O 3.43Å; A212-H216 PolarHBondContact O-CD2 3.43Å; A212-H216 PolarHBondContact O-N 3.34Å; I214-H216 VanDerWaalsContact C-N 3.31Å; I214-H216 PolarHBondContact O-N 2.99Å
217G91.8Very high93.7Very high21 Ų2133.2 Ų33.222%0.21618%0.184CC..SBendtrans-85.7-165.2178.900000113.1V213 I214 G219V213-G217 VanDerWaalsContact O-CA 3.24Å; V213-G217 WeakPolarHBondContact O-CA 3.34Å; V213-G217 PolarHBondContact O-N 3.45Å; I214-G217 PolarHBondContact O-N 2.97Å; I214-G217 VanDerWaalsContact O-N 3.14Å; G217-G219 VanDerWaalsContact C-N 3.26Å; G217-G219 PolarHBondContact O-N 2.92Å
218S85.5Confident93.6Very high57 Ų5735.6 Ų35.640%0.39920%0.195SC..  trans-80.7-3.1175.267.40000113.8K220S218-K220 PolarHBondContact O-N 3.22Å
219G77.2Confident93.5Very high14 Ų1431 Ų3114%0.14417%0.174CC..SBendtrans75.7-12.5-175.300000115.2G217 N221 V222 Y261G217-G219 VanDerWaalsContact C-N 3.26Å; G217-G219 PolarHBondContact O-N 2.92Å; G219-N221 VanDerWaalsContact C-N 3.32Å; G219-N221 PolarHBondContact O-N 3.04Å; G219-V222 VanDerWaalsContact O-CG2 3.25Å; G219-V222 WeakPolarHBondContact O-CG2 3.44Å; G219-V222 PolarHBondContact O-N 3.45Å; G219-Y261 PolarHBondContact O-OH 2.84Å; G219-Y261 VanDerWaalsContact O-OH 3.06Å
220K85.7Confident93.3Very high155 Ų15532.5 Ų32.567%0.67419%0.186SC*.THydrogen-bonded Turntrans-66.7-29.7-173.8-65.1-179.3-179178.20114.3S218 V222S218-K220 PolarHBondContact O-N 3.22Å; K220-V222 VanDerWaalsContact C-N 3.35Å; K220-V222 PolarHBondContact O-N 2.76Å
221N92.4Very high93.1Very high12 Ų1237.1 Ų37.16%0.06421%0.207CC..THydrogen-bonded Turntrans-92.814-173.3-53.8104.4000113.9E185 V188 I214 G219 D223 D224E185-N221 WeakPolarHBondContact CB-OD1 3.4Å; E185-N221 WeakPolarHBondContact CG-OD1 3.3Å; E185-N221 PolarHBondContact OE1-ND2 3.01Å; E185-N221 VanDerWaalsContact OE1-ND2 3.11Å; V188-N221 HydrophobicContact CG2-CB 3.89Å; I214-N221 HydrophobicContact CD1-CB 3.98Å; G219-N221 VanDerWaalsContact C-N 3.32Å; G219-N221 PolarHBondContact O-N 3.04Å; N221-D223 PolarHBondContact O-N 3.26Å; N221-D224 WeakPolarHBondContact CA-OD2 3.24Å; N221-D224 HydrophobicContact CB-CB 4.39Å; N221-D224 WeakPolarHBondContact CB-OD2 3.16Å; N221-D224 PolarHBondContact ND2-OD2 3.21Å; N221-D224 PolarHBondContact O-N 3.48Å
222V93.8Very high93.1Very high0 Ų038.7 Ų38.70%021%0.213CC..Hα-helixtrans-55.6-44.5174.7172.20000109.9I214 G219 K220 D224 V225 L226 M255 Y261I214-V222 HydrophobicContact CG2-CG2 3.55Å; G219-V222 VanDerWaalsContact O-CG2 3.25Å; G219-V222 WeakPolarHBondContact O-CG2 3.44Å; G219-V222 PolarHBondContact O-N 3.45Å; K220-V222 VanDerWaalsContact C-N 3.35Å; K220-V222 PolarHBondContact O-N 2.76Å; V222-D224 VanDerWaalsContact C-N 3.28Å; V222-D224 PolarHBondContact O-N 2.71Å; V222-V225 VanDerWaalsContact O-CG2 3.24Å; V222-V225 WeakPolarHBondContact O-CG2 3.11Å; V222-V225 PolarHBondContact O-N 2.87Å; V222-V225 VanDerWaalsContact O-N 3.16Å; V222-L226 HydrophobicContact CG1-CD1 3.71Å; V222-L226 HydrophobicContact CG1-CD2 4.3Å; V222-L226 HydrophobicContact CG1-CG 3.89Å; V222-L226 VanDerWaalsContact O-CG 3.25Å; V222-L226 WeakPolarHBondContact O-CG 3.16Å; V222-L226 PolarHBondContact O-N 2.98Å; V222-L226 VanDerWaalsContact O-N 3.13Å; V222-M255 HydrophobicContact CG2-CE 4.44Å; V222-M255 HydrophobicContact CG2-SD 4.11Å; V222-Y261 HydrophobicContact CB-CD1 3.92Å; V222-Y261 HydrophobicContact CB-CE1 3.72Å; V222-Y261 HydrophobicContact CB-CG 4.47Å; V222-Y261 HydrophobicContact CG1-CD1 3.59Å; V222-Y261 HydrophobicContact CG1-CE1 3.93Å; V222-Y261 HydrophobicContact CG1-CG 4.07Å; V222-Y261 HydrophobicContact CG2-CD1 4.3Å; V222-Y261 HydrophobicContact CG2-CD2 4.35Å; V222-Y261 HydrophobicContact CG2-CE1 4.14Å; V222-Y261 HydrophobicContact CG2-CE2 4.21Å; V222-Y261 HydrophobicContact CG2-CG 4.4Å
223D92.8Very high93Very high81 Ų8139.1 Ų39.143%0.43321%0.213SC..Hα-helixtrans-65-29.4-179.8-78.4-42.4000114.4N221 V225 K264N221-D223 PolarHBondContact O-N 3.26Å; D223-V225 PolarHBondContact O-N 3.45Å; D223-K264 WeakPolarHBondContact OD1-CD 3.34Å; D223-K264 WeakPolarHBondContact OD1-CE 3.11Å; D223-K264 IonicContact OD1-NZ 2.81Å; D223-K264 PolarHBondContact OD1-NZ 3.31Å; D223-K264 IonicContact OD2-NZ 3.72Å; D223-K264 PolarHBondContact OD2-NZ 2.94Å
224D94.6Very high92.9Very high83 Ų8342.9 Ų42.944%0.44423%0.23SC..Hα-helixtrans-70.7-20.5178.8-57.1-41.3000112.3V188 N221 V222V188-D224 HydrophobicContact CG1-CB 4.14Å; N221-D224 WeakPolarHBondContact CA-OD2 3.24Å; N221-D224 HydrophobicContact CB-CB 4.39Å; N221-D224 WeakPolarHBondContact CB-OD2 3.16Å; N221-D224 PolarHBondContact ND2-OD2 3.21Å; N221-D224 PolarHBondContact O-N 3.48Å; V222-D224 VanDerWaalsContact C-N 3.28Å; V222-D224 PolarHBondContact O-N 2.71Å
225V96.4Very high92.9Very high0 Ų043.2 Ų43.20%023%0.232CC..Hα-helixtrans-110.5-21.8-174.3-54.10000114.1V188 M192 T210 I214 V222 D223 S227 H228 L229 W251V188-V225 HydrophobicContact CG1-CG1 3.81Å; M192-V225 HydrophobicContact CE-CB 4.16Å; M192-V225 HydrophobicContact CE-CG1 3.82Å; M192-V225 HydrophobicContact CG-CG1 4.38Å; M192-V225 HydrophobicContact SD-CB 3.97Å; M192-V225 HydrophobicContact SD-CG1 3.82Å; T210-V225 HydrophobicContact CG2-CB 3.94Å; T210-V225 HydrophobicContact CG2-CG1 3.86Å; T210-V225 HydrophobicContact CG2-CG2 4.23Å; I214-V225 HydrophobicContact CD1-CG1 4.19Å; I214-V225 HydrophobicContact CD1-CG2 4.2Å; I214-V225 HydrophobicContact CG1-CG1 4.49Å; I214-V225 HydrophobicContact CG1-CG2 4.01Å; V222-V225 VanDerWaalsContact O-CG2 3.24Å; V222-V225 WeakPolarHBondContact O-CG2 3.11Å; V222-V225 PolarHBondContact O-N 2.87Å; V222-V225 VanDerWaalsContact O-N 3.16Å; D223-V225 PolarHBondContact O-N 3.45Å; V225-S227 PolarHBondContact O-N 3.49Å; V225-H228 PolarHBondContact O-N 2.92Å; V225-L229 HydrophobicContact CG2-CD1 4.41Å; V225-L229 PolarHBondContact O-N 3.42Å; V225-W251 HydrophobicContact CG2-CH2 3.84Å; V225-W251 HydrophobicContact CG2-CZ3 4.47Å
226L94.6Very high92.9Very high18 Ų1849.3 Ų49.39%0.09427%0.265CS..Hα-helixtrans-60-43.1-173.1-80.5170.1000113.4V222 H228 L229 A230 K264 L265 L268V222-L226 HydrophobicContact CG1-CD1 3.71Å; V222-L226 HydrophobicContact CG1-CD2 4.3Å; V222-L226 HydrophobicContact CG1-CG 3.89Å; V222-L226 VanDerWaalsContact O-CG 3.25Å; V222-L226 WeakPolarHBondContact O-CG 3.16Å; V222-L226 PolarHBondContact O-N 2.98Å; V222-L226 VanDerWaalsContact O-N 3.13Å; L226-H228 VanDerWaalsContact C-N 3.29Å; L226-H228 PolarHBondContact O-N 3.28Å; L226-L229 PolarHBondContact O-N 3.24Å; L226-A230 WeakPolarHBondContact O-CB 3.33Å; L226-A230 PolarHBondContact O-N 2.84Å; L226-K264 HydrophobicContact CD1-CB 3.59Å; L226-K264 HydrophobicContact CD1-CD 3.4Å; L226-K264 VanDerWaalsContact CD1-CD 3.4Å; L226-K264 HydrophobicContact CD1-CG 4.04Å; L226-K264 HydrophobicContact CD2-CB 4.45Å; L226-L265 HydrophobicContact CD2-CD2 3.94Å; L226-L268 HydrophobicContact CD2-CD1 3.43Å; L226-L268 VanDerWaalsContact CD2-CD1 3.43Å
227S93.4Very high93.1Very high64 Ų6448.1 Ų48.145%0.44826%0.262SS..Hα-helixtrans-63.1-37.8-18061.70000111.9V225 Q231V225-S227 PolarHBondContact O-N 3.49Å; S227-Q231 VanDerWaalsContact O-CG 3.29Å; S227-Q231 WeakPolarHBondContact O-CG 3.34Å; S227-Q231 PolarHBondContact O-N 3.22Å; S227-Q231 VanDerWaalsContact O-N 3.07Å
228H96.5Very high93.4Very high50 Ų5049.4 Ų49.423%0.23127%0.266CS..Hα-helixtrans-68.7-40.4176.2-67.3-69.7000112.1M192 I195 V225 L226 Q231 R232M192-H228 HydrophobicContact SD-CB 3.69Å; M192-H228 PolarHBondContact SD-CD2 3.37Å; I195-H228 HydrophobicContact CD1-CB 4.27Å; I195-H228 HydrophobicContact CG2-CB 4.15Å; V225-H228 PolarHBondContact O-N 2.92Å; L226-H228 VanDerWaalsContact C-N 3.29Å; L226-H228 PolarHBondContact O-N 3.28Å; H228-Q231 PolarHBondContact O-N 2.87Å; H228-R232 WeakPolarHBondContact O-CG 3.42Å; H228-R232 PolarHBondContact O-N 3.47Å
229L97.3Very high94Very high0 Ų051.6 Ų51.60%027%0.271CS..Hα-helixtrans-66.7-41.7174.7-69.1176.5000112I195 I207 V225 L226 Q231 R232 L233 V244 W251I195-L229 HydrophobicContact CD1-CD2 4.02Å; I207-L229 HydrophobicContact CG1-CD2 4.19Å; I207-L229 HydrophobicContact CG2-CD2 4.01Å; V225-L229 HydrophobicContact CG2-CD1 4.41Å; V225-L229 PolarHBondContact O-N 3.42Å; L226-L229 PolarHBondContact O-N 3.24Å; L229-Q231 VanDerWaalsContact C-N 3.32Å; L229-Q231 PolarHBondContact O-N 2.89Å; L229-R232 WeakPolarHBondContact O-CA 3.43Å; L229-R232 WeakPolarHBondContact O-CB 3.41Å; L229-R232 PolarHBondContact O-N 3.03Å; L229-L233 PolarHBondContact O-N 3.41Å; L229-V244 HydrophobicContact CB-CG1 4.14Å; L229-V244 HydrophobicContact CD2-CG1 4.4Å; L229-V244 HydrophobicContact CD2-CG2 4.22Å; L229-W251 HydrophobicContact CD1-CH2 3.41Å; L229-W251 VanDerWaalsContact CD1-CH2 3.41Å; L229-W251 HydrophobicContact CD1-CZ3 3.44Å; L229-W251 VanDerWaalsContact CD1-CZ3 3.44Å
230A94.8Very high95Very high31 Ų3151 Ų5126%0.25626%0.264SS..Hα-helixtrans-57.5-45.7175.100000111.4L226 R232 L233 F234 L268L226-A230 WeakPolarHBondContact O-CB 3.33Å; L226-A230 PolarHBondContact O-N 2.84Å; A230-R232 PolarHBondContact O-N 3.5Å; A230-L233 WeakPolarHBondContact O-CB 3.42Å; A230-L233 PolarHBondContact O-N 3.08Å; A230-L233 VanDerWaalsContact O-N 3.1Å; A230-F234 WeakPolarHBondContact O-CD2 3.31Å; A230-L268 HydrophobicContact CB-CD2 3.69Å
231Q94.1Very high95.6Very high99 Ų9944.4 Ų44.446%0.46324%0.235SC..Hα-helixtrans-60.6-29.4174.5-71.9170.611.500113S227 H228 L229 L233 F234S227-Q231 VanDerWaalsContact O-CG 3.29Å; S227-Q231 WeakPolarHBondContact O-CG 3.34Å; S227-Q231 PolarHBondContact O-N 3.22Å; S227-Q231 VanDerWaalsContact O-N 3.07Å; H228-Q231 PolarHBondContact O-N 2.87Å; L229-Q231 VanDerWaalsContact C-N 3.32Å; L229-Q231 PolarHBondContact O-N 2.89Å; Q231-L233 VanDerWaalsContact C-N 3.34Å; Q231-F234 PolarHBondContact O-N 3.5Å
232R96.8Very high95.9Very high37 Ų3746.6 Ų46.614%0.1424%0.244CC..Hα-helixtrans-80.7-10.3178.2-70.3-57.192.194.34.6114I195 S196 I207 H228 L229 A230 F234 D235 V240 V244I195-R232 HydrophobicContact CD1-CG 4.46Å; I195-R232 HydrophobicContact CG1-CG 4.15Å; I195-R232 PolarHBondContact O-NH1 2.81Å; S196-R232 VanDerWaalsContact CA-NH1 3.33Å; S196-R232 PolarHBondContact OG-NH1 3.36Å; I207-R232 HydrophobicContact CD1-CB 4.24Å; I207-R232 HydrophobicContact CD1-CG 4.18Å; H228-R232 WeakPolarHBondContact O-CG 3.42Å; H228-R232 PolarHBondContact O-N 3.47Å; L229-R232 WeakPolarHBondContact O-CA 3.43Å; L229-R232 WeakPolarHBondContact O-CB 3.41Å; L229-R232 PolarHBondContact O-N 3.03Å; A230-R232 PolarHBondContact O-N 3.5Å; R232-F234 PolarHBondContact O-N 3.15Å; R232-D235 WeakPolarHBondContact CD-OD2 3.49Å; R232-D235 IonicContact NE-OD2 2.58Å; R232-D235 VanDerWaalsContact O-CB 3.31Å; R232-D235 WeakPolarHBondContact O-CB 3.24Å; R232-D235 PolarHBondContact O-N 3.41Å; R232-V240 HydrophobicContact CB-CG1 4.11Å; R232-V240 HydrophobicContact CG-CG1 4.29Å; R232-V244 HydrophobicContact CB-CG2 3.55Å
233L94.9Very high96.1Very high16 Ų1647 Ų478%0.08425%0.247CC..THydrogen-bonded Turntrans-69.4-14.9165.3-65.7173.8000112.7L229 A230 Q231 R241 V244 L268L229-L233 PolarHBondContact O-N 3.41Å; A230-L233 WeakPolarHBondContact O-CB 3.42Å; A230-L233 PolarHBondContact O-N 3.08Å; A230-L233 VanDerWaalsContact O-N 3.1Å; Q231-L233 VanDerWaalsContact C-N 3.34Å; L233-R241 WeakPolarHBondContact O-CD 3.4Å; L233-V244 HydrophobicContact CD2-CB 4.04Å; L233-V244 HydrophobicContact CD2-CG1 3.68Å; L233-V244 HydrophobicContact CG-CG1 4.05Å; L233-L268 HydrophobicContact CD1-CB 4.35Å; L233-L268 HydrophobicContact CD1-CD2 3.82Å
234F93.6Very high96.4Very high82 Ų8243.2 Ų43.236%0.3623%0.227SC..THydrogen-bonded Turntrans-10310.7175.4-59.6-90.3000112.8A230 Q231 R232 A353 R357A230-F234 WeakPolarHBondContact O-CD2 3.31Å; Q231-F234 PolarHBondContact O-N 3.5Å; R232-F234 PolarHBondContact O-N 3.15Å; F234-A353 HydrophobicContact CD1-CB 3.95Å; F234-A353 HydrophobicContact CE1-CB 4.07Å; F234-A353 WeakPolarHBondContact CE1-O 3.31Å; F234-R357 HydrophobicContact CD1-CG 4.11Å; F234-R357 HydrophobicContact CE1-CB 3.85Å; F234-R357 HydrophobicContact CE1-CG 3.27Å; F234-R357 HydrophobicContact CZ-CB 3.92Å; F234-R357 HydrophobicContact CZ-CG 3.8Å
235D96.3Very high96.6Very high13 Ų1339.3 Ų39.37%0.0721%0.206CC..  trans-68137.4-177.9-162.4-73.6000111.5R203 R232 S237 V240 R241R203-D235 IonicContact CZ-OD1 3.05Å; R203-D235 IonicContact CZ-OD2 2.74Å; R203-D235 VanDerWaalsContact CZ-OD2 3.26Å; R203-D235 IonicContact NE-OD1 3.38Å; R203-D235 IonicContact NE-OD2 3.01Å; R203-D235 PolarHBondContact NE-OD2 3.44Å; R203-D235 VanDerWaalsContact NH2-CG 3.34Å; R203-D235 IonicContact NH2-OD1 2.93Å; R203-D235 PolarHBondContact NH2-OD1 2.8Å; R203-D235 IonicContact NH2-OD2 2.73Å; R203-D235 PolarHBondContact NH2-OD2 2.95Å; R203-D235 VanDerWaalsContact NH2-OD2 3.12Å; R232-D235 WeakPolarHBondContact CD-OD2 3.49Å; R232-D235 IonicContact NE-OD2 2.58Å; R232-D235 VanDerWaalsContact O-CB 3.31Å; R232-D235 WeakPolarHBondContact O-CB 3.24Å; R232-D235 PolarHBondContact O-N 3.41Å; D235-S237 PolarHBondContact O-N 3.32Å; D235-S237 VanDerWaalsContact OD1-CB 3.32Å; D235-S237 WeakPolarHBondContact OD1-CB 3.12Å; D235-S237 PolarHBondContact OD1-N 2.88Å; D235-V240 HydrophobicContact CB-CB 3.91Å; D235-V240 HydrophobicContact CB-CG1 3.7Å; D235-V240 WeakPolarHBondContact OD2-CG1 3.49Å; D235-R241 HydrophobicContact CB-CG 4.22Å; D235-R241 WeakPolarHBondContact O-CD 3.29Å; D235-R241 WeakPolarHBondContact O-CG 3.42Å; D235-R241 PolarHBondContact O-NH1 3.32Å
236D94.9Very high96.7Very high156 Ų15641.3 Ų41.383%0.83422%0.222SC*.SBendtrans-59.1-30.1178.5-61.9-41.1000112.5P238D236-P238 VanDerWaalsContact O-CD 3.29Å; D236-P238 WeakPolarHBondContact O-CD 3.15Å
237S97.5Very high96.9Very high22 Ų2241 Ų4115%0.15422%0.222CC..SBendtrans-83.9116-179.8172.70000111.1S200 D235 Q239 V240 R241S200-S237 WeakPolarHBondContact CB-OG 3.29Å; D235-S237 PolarHBondContact O-N 3.32Å; D235-S237 VanDerWaalsContact OD1-CB 3.32Å; D235-S237 WeakPolarHBondContact OD1-CB 3.12Å; D235-S237 PolarHBondContact OD1-N 2.88Å; S237-Q239 PolarHBondContact O-N 3.05Å; S237-Q239 VanDerWaalsContact O-N 3.11Å; S237-V240 WeakPolarHBondContact O-CB 3.35Å; S237-V240 PolarHBondContact O-N 2.98Å; S237-R241 PolarHBondContact O-N 2.71Å
238P97.8Very high97.1Very high47 Ų4738 Ų3831%0.30520%0.201SC..Hα-helixtrans-54.4-35.6176.2-30.439000114D236 V240 R241 K242 I277 I280D236-P238 VanDerWaalsContact O-CD 3.29Å; D236-P238 WeakPolarHBondContact O-CD 3.15Å; P238-V240 PolarHBondContact O-N 3.49Å; P238-R241 PolarHBondContact O-N 3.07Å; P238-K242 WeakPolarHBondContact O-CB 3.19Å; P238-K242 PolarHBondContact O-N 3.18Å; P238-I277 HydrophobicContact CB-CG1 3.96Å; P238-I277 HydrophobicContact CG-CD1 4.23Å; P238-I277 HydrophobicContact CG-CG1 3.94Å; P238-I280 HydrophobicContact CB-CD1 4.21Å; P238-I280 WeakPolarHBondContact O-CD1 3.35Å
239Q98.3Very high97.2Very high104 Ų10435.7 Ų35.749%0.48619%0.19SC..Hα-helixtrans-63.8-30.5179.4-61.8-59.5-30.100112.6V204 S237 A243V204-Q239 HydrophobicContact CG2-CB 4.16Å; S237-Q239 PolarHBondContact O-N 3.05Å; S237-Q239 VanDerWaalsContact O-N 3.11Å; Q239-A243 WeakPolarHBondContact O-CB 3.26Å; Q239-A243 PolarHBondContact O-N 3.25Å
240V98.6Very high97.2Very high0 Ų038.6 Ų38.60%021%0.205CC..Hα-helixtrans-72.8-47.6177.3176.70000109.5R203 V204 I207 R232 D235 S237 P238 K242 A243 V244R203-V240 HydrophobicContact CB-CG1 4.34Å; R203-V240 HydrophobicContact CB-CG2 4.04Å; V204-V240 HydrophobicContact CG2-CG2 3.88Å; I207-V240 HydrophobicContact CD1-CG1 3.53Å; R232-V240 HydrophobicContact CB-CG1 4.11Å; R232-V240 HydrophobicContact CG-CG1 4.29Å; D235-V240 HydrophobicContact CB-CB 3.91Å; D235-V240 HydrophobicContact CB-CG1 3.7Å; D235-V240 WeakPolarHBondContact OD2-CG1 3.49Å; S237-V240 WeakPolarHBondContact O-CB 3.35Å; S237-V240 PolarHBondContact O-N 2.98Å; P238-V240 PolarHBondContact O-N 3.49Å; V240-K242 VanDerWaalsContact C-N 3.34Å; V240-K242 PolarHBondContact O-N 2.98Å; V240-A243 WeakPolarHBondContact O-CB 3.45Å; V240-A243 PolarHBondContact O-N 3.05Å; V240-A243 VanDerWaalsContact O-N 3.16Å; V240-V244 PolarHBondContact O-N 3.17Å; V240-V244 VanDerWaalsContact O-N 3.1Å
241R98.2Very high97.3Very high17 Ų1737.1 Ų37.16%0.06419%0.193CC..Hα-helixtrans-58.6-45.6175.5-57.1-161.8-58-94.810.5111.6L233 D235 S237 P238 A243 V244 T245 D275 I280L233-R241 WeakPolarHBondContact O-CD 3.4Å; D235-R241 HydrophobicContact CB-CG 4.22Å; D235-R241 WeakPolarHBondContact O-CD 3.29Å; D235-R241 WeakPolarHBondContact O-CG 3.42Å; D235-R241 PolarHBondContact O-NH1 3.32Å; S237-R241 PolarHBondContact O-N 2.71Å; P238-R241 PolarHBondContact O-N 3.07Å; R241-A243 VanDerWaalsContact C-N 3.32Å; R241-A243 PolarHBondContact O-N 3.37Å; R241-V244 WeakPolarHBondContact O-CB 3.25Å; R241-V244 PolarHBondContact O-N 3.43Å; R241-V244 VanDerWaalsContact O-N 3.12Å; R241-T245 PolarHBondContact O-N 2.89Å; R241-T245 PolarHBondContact O-OG1 2.88Å; R241-T245 VanDerWaalsContact O-OG1 3.05Å; R241-D275 WeakPolarHBondContact CD-OD2 3.33Å; R241-D275 IonicContact CZ-OD1 2.81Å; R241-D275 IonicContact CZ-OD2 2.86Å; R241-D275 IonicContact NE-OD1 3.28Å; R241-D275 IonicContact NE-OD2 3.66Å; R241-D275 PolarHBondContact NE-OD2 2.81Å; R241-D275 IonicContact NH2-OD1 3.79Å; R241-D275 PolarHBondContact NH2-OD1 2.98Å; R241-D275 IonicContact NH2-OD2 2.64Å; R241-I280 HydrophobicContact CB-CD1 3.97Å
242K98.6Very high97.5Very high59 Ų5932.5 Ų32.526%0.25717%0.172SC..Hα-helixtrans-56.6-42.5174.8-171.4-177.5174.9-174.70112.4P238 V240 T245 A246 E279 I280 L283P238-K242 WeakPolarHBondContact O-CB 3.19Å; P238-K242 PolarHBondContact O-N 3.18Å; V240-K242 VanDerWaalsContact C-N 3.34Å; V240-K242 PolarHBondContact O-N 2.98Å; K242-T245 PolarHBondContact O-N 3.36Å; K242-A246 WeakPolarHBondContact O-CB 2.96Å; K242-A246 PolarHBondContact O-N 3.12Å; K242-E279 IonicContact NZ-OE1 3.33Å; K242-E279 PolarHBondContact NZ-OE1 2.74Å; K242-I280 HydrophobicContact CB-CD1 4.16Å; K242-I280 HydrophobicContact CB-CG1 4.01Å; K242-I280 HydrophobicContact CG-CG1 4.42Å; K242-L283 HydrophobicContact CG-CD2 3.76Å
243A98.6Very high97.5Very high9 Ų931.4 Ų31.47%0.07417%0.168CC..Hα-helixtrans-63.5-41.1177.200000111.8V204 I207 Q239 V240 R241 A246 V247V204-A243 HydrophobicContact CG1-CB 4.09Å; V204-A243 HydrophobicContact CG2-CB 4.42Å; I207-A243 HydrophobicContact CB-CB 4.3Å; I207-A243 HydrophobicContact CD1-CB 4.44Å; I207-A243 HydrophobicContact CG2-CB 3.94Å; Q239-A243 WeakPolarHBondContact O-CB 3.26Å; Q239-A243 PolarHBondContact O-N 3.25Å; V240-A243 WeakPolarHBondContact O-CB 3.45Å; V240-A243 PolarHBondContact O-N 3.05Å; V240-A243 VanDerWaalsContact O-N 3.16Å; R241-A243 VanDerWaalsContact C-N 3.32Å; R241-A243 PolarHBondContact O-N 3.37Å; A243-A246 PolarHBondContact O-N 2.83Å; A243-V247 WeakPolarHBondContact O-CB 3.27Å; A243-V247 WeakPolarHBondContact O-CG2 3.27Å; A243-V247 PolarHBondContact O-N 3.38Å
244V98.6Very high97.5Very high0 Ų034.8 Ų34.80%019%0.187CC..Hα-helixtrans-61.6-48.7173.8-179.10000110.6I207 L229 R232 L233 V240 R241 A246 V247 V248I207-V244 HydrophobicContact CD1-CG2 3.79Å; I207-V244 HydrophobicContact CG1-CG2 4.38Å; I207-V244 HydrophobicContact CG2-CG2 4.2Å; L229-V244 HydrophobicContact CB-CG1 4.14Å; L229-V244 HydrophobicContact CD2-CG1 4.4Å; L229-V244 HydrophobicContact CD2-CG2 4.22Å; R232-V244 HydrophobicContact CB-CG2 3.55Å; L233-V244 HydrophobicContact CD2-CB 4.04Å; L233-V244 HydrophobicContact CD2-CG1 3.68Å; L233-V244 HydrophobicContact CG-CG1 4.05Å; V240-V244 PolarHBondContact O-N 3.17Å; V240-V244 VanDerWaalsContact O-N 3.1Å; R241-V244 WeakPolarHBondContact O-CB 3.25Å; R241-V244 PolarHBondContact O-N 3.43Å; R241-V244 VanDerWaalsContact O-N 3.12Å; V244-A246 VanDerWaalsContact C-N 3.31Å; V244-A246 PolarHBondContact O-N 3.15Å; V244-V247 PolarHBondContact O-N 2.86Å; V244-V248 HydrophobicContact CG1-CG2 4.09Å; V244-V248 WeakPolarHBondContact O-CB 3.32Å; V244-V248 WeakPolarHBondContact O-CG2 3.21Å; V244-V248 PolarHBondContact O-N 3.24Å
245T98.6Very high97.5Very high1 Ų131.1 Ų31.11%0.00617%0.171CC..Hα-helixtrans-55.4-46.3178-52.20000111.5R241 K242 G249 L269 S272 L283 A284 L287R241-T245 PolarHBondContact O-N 2.89Å; R241-T245 PolarHBondContact O-OG1 2.88Å; R241-T245 VanDerWaalsContact O-OG1 3.05Å; K242-T245 PolarHBondContact O-N 3.36Å; T245-G249 PolarHBondContact O-N 3.23Å; T245-L269 HydrophobicContact CG2-CD1 3.86Å; T245-S272 WeakPolarHBondContact OG1-CB 3.48Å; T245-S272 PolarHBondContact OG1-OG 3.01Å; T245-L283 HydrophobicContact CG2-CD2 4.33Å; T245-L283 HydrophobicContact CG2-CG 4.29Å; T245-A284 HydrophobicContact CG2-CB 3.71Å; T245-L287 HydrophobicContact CG2-CD1 4.48Å
246A98.6Very high97.1Very high42 Ų4242.1 Ų42.135%0.34721%0.211SC..Hα-helixtrans-63.8-46.4179.100000112.4K242 A243 V244 G249 D250 L283K242-A246 WeakPolarHBondContact O-CB 2.96Å; K242-A246 PolarHBondContact O-N 3.12Å; A243-A246 PolarHBondContact O-N 2.83Å; V244-A246 VanDerWaalsContact C-N 3.31Å; V244-A246 PolarHBondContact O-N 3.15Å; A246-G249 PolarHBondContact O-N 2.98Å; A246-D250 WeakPolarHBondContact O-CB 3.4Å; A246-D250 PolarHBondContact O-N 2.68Å; A246-L283 HydrophobicContact CB-CD2 4.37Å
247V98.4Very high96.8Very high13 Ų1338.6 Ų38.68%0.07919%0.192CC..Hα-helixtrans-64.2-46.1179.5165.50000111.7I207 G211 A243 V244 G249 D250 W251I207-V247 HydrophobicContact CG2-CB 4.37Å; I207-V247 HydrophobicContact CG2-CG2 3.91Å; G211-V247 VanDerWaalsContact CA-CG1 3.41Å; A243-V247 WeakPolarHBondContact O-CB 3.27Å; A243-V247 WeakPolarHBondContact O-CG2 3.27Å; A243-V247 PolarHBondContact O-N 3.38Å; V244-V247 PolarHBondContact O-N 2.86Å; V247-G249 VanDerWaalsContact C-N 3.35Å; V247-G249 PolarHBondContact O-N 3.13Å; V247-D250 PolarHBondContact O-N 3.11Å; V247-W251 HydrophobicContact CG1-CD2 4.04Å; V247-W251 HydrophobicContact CG1-CE3 4.36Å; V247-W251 HydrophobicContact CG1-CH2 4.07Å; V247-W251 HydrophobicContact CG1-CZ2 3.67Å; V247-W251 HydrophobicContact CG1-CZ3 4.38Å; V247-W251 PolarHBondContact O-N 3.04Å
248V98.2Very high96.6Very high1 Ų138.9 Ų38.91%0.00619%0.19CC..Hα-helixtrans-65.9-39.6179.6174.20000111.1V244 W251 L252 L265 L268 L269V244-V248 HydrophobicContact CG1-CG2 4.09Å; V244-V248 WeakPolarHBondContact O-CB 3.32Å; V244-V248 WeakPolarHBondContact O-CG2 3.21Å; V244-V248 PolarHBondContact O-N 3.24Å; V248-W251 PolarHBondContact O-N 3.16Å; V248-L252 HydrophobicContact CG1-CD1 4.32Å; V248-L252 WeakPolarHBondContact O-CG 3.26Å; V248-L252 PolarHBondContact O-N 3.03Å; V248-L265 HydrophobicContact CG1-CB 4.28Å; V248-L265 HydrophobicContact CG1-CD2 4.4Å; V248-L265 WeakPolarHBondContact CG1-O 3.08Å; V248-L268 HydrophobicContact CG1-CB 4.01Å; V248-L268 HydrophobicContact CG2-CB 4.23Å; V248-L268 HydrophobicContact CG2-CD1 4.25Å; V248-L269 HydrophobicContact CG1-CB 4.03Å
249G98.1Very high96.4Very high0 Ų040.9 Ų40.90%019%0.192CC..Hα-helixtrans-64.4-41.1174.400000112.8T245 A246 V247 W251 L252 L253T245-G249 PolarHBondContact O-N 3.23Å; A246-G249 PolarHBondContact O-N 2.98Å; V247-G249 VanDerWaalsContact C-N 3.35Å; V247-G249 PolarHBondContact O-N 3.13Å; G249-W251 VanDerWaalsContact C-N 3.33Å; G249-W251 PolarHBondContact O-N 3.3Å; G249-L252 WeakPolarHBondContact O-CB 3.38Å; G249-L252 PolarHBondContact O-N 3.28Å; G249-L253 WeakPolarHBondContact O-CG 3.27Å; G249-L253 PolarHBondContact O-N 3.19Å; G249-L253 VanDerWaalsContact O-N 3.12Å
250D97.7Very high96.1Very high61 Ų6138.9 Ų38.933%0.32619%0.189SC..Hα-helixtrans-62-40.6174.1-171.951.2000111.6A246 V247 L252 L253 N254A246-D250 WeakPolarHBondContact O-CB 3.4Å; A246-D250 PolarHBondContact O-N 2.68Å; V247-D250 PolarHBondContact O-N 3.11Å; D250-L252 VanDerWaalsContact C-N 3.34Å; D250-L252 PolarHBondContact O-N 3.29Å; D250-L253 PolarHBondContact O-N 2.74Å; D250-L253 VanDerWaalsContact O-N 3.17Å; D250-N254 WeakPolarHBondContact O-CB 3.47Å; D250-N254 PolarHBondContact O-N 3.36Å; D250-N254 PolarHBondContact OD1-ND2 2.72Å
251W97.6Very high95.9Very high0 Ų040.4 Ų40.40%020%0.196CC..Hα-helixtrans-63.5-38.4173.9-68.6-15000112.8G211 I214 V225 L229 V247 V248 G249 L253 M255 R258 L265G211-W251 PolarHBondContact O-NE1 3.07Å; I214-W251 HydrophobicContact CB-CH2 4.22Å; I214-W251 HydrophobicContact CB-CZ2 3.47Å; I214-W251 VanDerWaalsContact CB-CZ2 3.47Å; I214-W251 HydrophobicContact CG1-CH2 4.07Å; I214-W251 HydrophobicContact CG1-CZ2 3.7Å; I214-W251 HydrophobicContact CG2-CH2 4.29Å; I214-W251 HydrophobicContact CG2-CZ2 3.79Å; V225-W251 HydrophobicContact CG2-CH2 3.84Å; V225-W251 HydrophobicContact CG2-CZ3 4.47Å; L229-W251 HydrophobicContact CD1-CH2 3.41Å; L229-W251 VanDerWaalsContact CD1-CH2 3.41Å; L229-W251 HydrophobicContact CD1-CZ3 3.44Å; L229-W251 VanDerWaalsContact CD1-CZ3 3.44Å; V247-W251 HydrophobicContact CG1-CD2 4.04Å; V247-W251 HydrophobicContact CG1-CE3 4.36Å; V247-W251 HydrophobicContact CG1-CH2 4.07Å; V247-W251 HydrophobicContact CG1-CZ2 3.67Å; V247-W251 HydrophobicContact CG1-CZ3 4.38Å; V247-W251 PolarHBondContact O-N 3.04Å; V248-W251 PolarHBondContact O-N 3.16Å; G249-W251 VanDerWaalsContact C-N 3.33Å; G249-W251 PolarHBondContact O-N 3.3Å; W251-L253 PolarHBondContact O-N 3.05Å; W251-M255 HydrophobicContact CB-CB 4.19Å; W251-M255 HydrophobicContact CB-SD 4.48Å; W251-M255 HydrophobicContact CG-SD 4.42Å; W251-M255 WeakPolarHBondContact O-CB 3.24Å; W251-M255 PolarHBondContact O-N 3.49Å; W251-R258 WeakPolarHBondContact O-CB 3.38Å; W251-L265 HydrophobicContact CB-CD1 3.94Å; W251-L265 HydrophobicContact CE3-CD2 3.7Å; W251-L265 HydrophobicContact CZ3-CD2 4.28Å
252L97.3Very high95.7Very high3 Ų340.1 Ų40.12%0.01620%0.195CC..Hα-helixtrans-66-22.6175.3-77.9168.6000113.5V248 G249 D250 R258 F262 L265 V266 L269 A291V248-L252 HydrophobicContact CG1-CD1 4.32Å; V248-L252 WeakPolarHBondContact O-CG 3.26Å; V248-L252 PolarHBondContact O-N 3.03Å; G249-L252 WeakPolarHBondContact O-CB 3.38Å; G249-L252 PolarHBondContact O-N 3.28Å; D250-L252 VanDerWaalsContact C-N 3.34Å; D250-L252 PolarHBondContact O-N 3.29Å; L252-R258 WeakPolarHBondContact O-CD 3.41Å; L252-F262 HydrophobicContact CD2-CD1 3.62Å; L252-F262 HydrophobicContact CD2-CE1 3.96Å; L252-L265 HydrophobicContact CD1-CB 4.41Å; L252-L265 HydrophobicContact CD2-CB 3.63Å; L252-L265 HydrophobicContact CD2-CD1 4.2Å; L252-L265 HydrophobicContact CG-CB 3.9Å; L252-L265 HydrophobicContact CG-CD1 4.36Å; L252-V266 HydrophobicContact CD2-CG2 4.32Å; L252-L269 HydrophobicContact CD1-CB 3.83Å; L252-L269 HydrophobicContact CD1-CD2 3.5Å; L252-L269 HydrophobicContact CD1-CG 4.25Å; L252-A291 HydrophobicContact CB-CB 4.18Å
253L96.8Very high95.5Very high13 Ų1338.2 Ų38.27%0.06819%0.187CC..Hα-helixtrans-95.5-47.8178.9-67.9167000111.8G249 D250 W251 R258 L287 Q290 A291 Q294G249-L253 WeakPolarHBondContact O-CG 3.27Å; G249-L253 PolarHBondContact O-N 3.19Å; G249-L253 VanDerWaalsContact O-N 3.12Å; D250-L253 PolarHBondContact O-N 2.74Å; D250-L253 VanDerWaalsContact O-N 3.17Å; W251-L253 PolarHBondContact O-N 3.05Å; L253-R258 VanDerWaalsContact O-CZ 3.31Å; L253-R258 PolarHBondContact O-NH1 3.34Å; L253-L287 HydrophobicContact CD1-CD2 3.97Å; L253-Q290 HydrophobicContact CD1-CB 4.4Å; L253-Q290 HydrophobicContact CD2-CB 3.78Å; L253-A291 HydrophobicContact CD2-CB 4.12Å; L253-Q294 VanDerWaalsContact CD2-OE1 3.25Å; L253-Q294 PolarHBondContact O-NE2 2.9Å; L253-Q294 PolarHBondContact O-OE1 3.23Å; L253-Q294 VanDerWaalsContact O-OE1 3.11Å
254N94.8Very high95.3Very high87 Ų8740.6 Ų40.647%0.46520%0.195SC..Hα-helixtrans-118.6-13.8-158.2-63.4-47.4000113.7Q215 D250 R256Q215-N254 VanDerWaalsContact NE2-CB 3.26Å; Q215-N254 PolarHBondContact NE2-O 2.94Å; D250-N254 WeakPolarHBondContact O-CB 3.47Å; D250-N254 PolarHBondContact O-N 3.36Å; D250-N254 PolarHBondContact OD1-ND2 2.72Å; N254-R256 PolarHBondContact O-N 3.07Å
255M93.5Very high95.2Very high5 Ų540.6 Ų40.63%0.02520%0.195CC..  trans-66.8137.2-178.8-173.4176.670.100110.4I214 Q215 V222 W251 D257 R258 Y261 L265I214-M255 HydrophobicContact CG2-SD 4.03Å; Q215-M255 VanDerWaalsContact OE1-CA 3.23Å; V222-M255 HydrophobicContact CG2-CE 4.44Å; V222-M255 HydrophobicContact CG2-SD 4.11Å; W251-M255 HydrophobicContact CB-CB 4.19Å; W251-M255 HydrophobicContact CB-SD 4.48Å; W251-M255 HydrophobicContact CG-SD 4.42Å; W251-M255 WeakPolarHBondContact O-CB 3.24Å; W251-M255 PolarHBondContact O-N 3.49Å; M255-D257 PolarHBondContact O-N 3.12Å; M255-R258 HydrophobicContact CB-CB 4.11Å; M255-R258 HydrophobicContact CE-CB 4.16Å; M255-R258 WeakPolarHBondContact O-CB 3.33Å; M255-R258 WeakPolarHBondContact O-CG 3.45Å; M255-R258 PolarHBondContact O-N 3.32Å; M255-R258 PolarHBondContact O-NH1 3.42Å; M255-Y261 HydrophobicContact CE-CD2 3.58Å; M255-Y261 HydrophobicContact CE-CE2 4.43Å; M255-Y261 HydrophobicContact CE-CG 4.09Å; M255-L265 HydrophobicContact CE-CD1 4.01Å
256R88.3Confident95.1Very high244 Ų24440.5 Ų40.592%0.92120%0.195SC*.THydrogen-bonded Turntrans-59.9-45.1-170.5-126.8-180-173.8170.71.9113.6N254N254-R256 PolarHBondContact O-N 3.07Å
257D89.2Confident95Very high82 Ų8239.7 Ų39.744%0.43919%0.186SC..THydrogen-bonded Turntrans-109.639178.9-172.722.9000111.7M255 Y259 S260 Y261M255-D257 PolarHBondContact O-N 3.12Å; D257-Y259 PolarHBondContact O-N 2.82Å; D257-S260 VanDerWaalsContact CG-OG 3.28Å; D257-S260 PolarHBondContact O-N 3.46Å; D257-S260 WeakPolarHBondContact OD1-CB 3.47Å; D257-S260 PolarHBondContact OD1-OG 3.06Å; D257-S260 PolarHBondContact OD2-OG 3.31Å; D257-Y261 VanDerWaalsContact O-CD2 3.31Å; D257-Y261 WeakPolarHBondContact O-CD2 3.4Å
258R92.6Very high94.8Very high28 Ų2840 Ų4011%0.10619%0.187CC..Hα-helixtrans-59.2-29.9-175.861.6-180179.6-83.9-4.8114.6W251 L252 L253 M255 S260 Y261 F262 E298W251-R258 WeakPolarHBondContact O-CB 3.38Å; L252-R258 WeakPolarHBondContact O-CD 3.41Å; L253-R258 VanDerWaalsContact O-CZ 3.31Å; L253-R258 PolarHBondContact O-NH1 3.34Å; M255-R258 HydrophobicContact CB-CB 4.11Å; M255-R258 HydrophobicContact CE-CB 4.16Å; M255-R258 WeakPolarHBondContact O-CB 3.33Å; M255-R258 WeakPolarHBondContact O-CG 3.45Å; M255-R258 PolarHBondContact O-N 3.32Å; M255-R258 PolarHBondContact O-NH1 3.42Å; R258-S260 VanDerWaalsContact C-N 3.28Å; R258-S260 PolarHBondContact O-N 2.91Å; R258-Y261 CarbonylContact O-C 3.59Å; R258-Y261 PolarHBondContact O-N 3.3Å; R258-F262 HydrophobicContact CB-CD1 4.47Å; R258-F262 HydrophobicContact CB-CE1 3.82Å; R258-F262 HydrophobicContact CB-CZ 4.4Å; R258-F262 HydrophobicContact CG-CE1 3.68Å; R258-F262 HydrophobicContact CG-CZ 3.8Å; R258-F262 WeakPolarHBondContact O-CD1 3.41Å; R258-F262 PolarHBondContact O-N 3.11Å; R258-F262 VanDerWaalsContact O-N 3.1Å; R258-E298 IonicContact CZ-OE1 2.77Å; R258-E298 IonicContact CZ-OE2 3.65Å; R258-E298 IonicContact NH2-OE1 3.95Å; R258-E298 PolarHBondContact NH2-OE1 2.83Å; R258-E298 IonicContact NH2-OE2 2.74Å; R258-E298 PolarHBondContact NH2-OE2 3.48Å
259Y93.6Very high94.8Very high90 Ų9040 Ų4035%0.35319%0.187SC..Hα-helixtrans-60.1-39.6-178.4-81.4-122000111.9D257 Y261 F262 W295 E298 N299D257-Y259 PolarHBondContact O-N 2.82Å; Y259-Y261 PolarHBondContact O-N 2.61Å; Y259-F262 AromaticContact CD1-CE2 3.84Å; Y259-F262 HydrophobicContact CD1-CE2 3.84Å; Y259-F262 AromaticContact CD2-CE2 3.62Å; Y259-F262 HydrophobicContact CD2-CE2 3.62Å; Y259-F262 AromaticContact CD2-CZ 3.62Å; Y259-F262 HydrophobicContact CD2-CZ 3.62Å; Y259-F262 HydrophobicContact CE1-CE2 4.2Å; Y259-F262 AromaticContact CE2-CE2 3.96Å; Y259-F262 HydrophobicContact CE2-CE2 3.96Å; Y259-F262 AromaticContact CE2-CZ 3.86Å; Y259-F262 HydrophobicContact CE2-CZ 3.86Å; Y259-F262 HydrophobicContact CG-CD2 4.28Å; Y259-F262 AromaticContact CG-CE2 3.55Å; Y259-F262 HydrophobicContact CG-CE2 3.55Å; Y259-F262 HydrophobicContact CG-CZ 4.03Å; Y259-F262 PolarHBondContact O-N 3.48Å; Y259-W295 AromaticContact CE1-NE1 3.71Å; Y259-W295 AromaticContact CZ-CD1 3.82Å; Y259-E298 WeakPolarHBondContact OH-CB 3.48Å; Y259-E298 PolarHBondContact OH-OE2 3.29Å; Y259-E298 VanDerWaalsContact OH-OE2 3.14Å; Y259-N299 PolarHBondContact OH-ND2 3.21Å
260S92.8Very high94.7Very high61 Ų6140 Ų4043%0.42719%0.187SC..Hα-helixtrans-62.6-23.9177.4-63.50000112.9D257 R258 H263D257-S260 VanDerWaalsContact CG-OG 3.28Å; D257-S260 PolarHBondContact O-N 3.46Å; D257-S260 WeakPolarHBondContact OD1-CB 3.47Å; D257-S260 PolarHBondContact OD1-OG 3.06Å; D257-S260 PolarHBondContact OD2-OG 3.31Å; R258-S260 VanDerWaalsContact C-N 3.28Å; R258-S260 PolarHBondContact O-N 2.91Å; S260-H263 PolarHBondContact O-CE1 3.34Å; S260-H263 PolarHBondContact O-ND1 2.9Å
261Y93.9Very high94.6Very high33 Ų3338.4 Ų38.413%0.12918%0.181CC..Hα-helixtrans-113.11.6-173.3-60.3-79000114.5G219 V222 M255 D257 R258 Y259 H263 K264 L265G219-Y261 PolarHBondContact O-OH 2.84Å; G219-Y261 VanDerWaalsContact O-OH 3.06Å; V222-Y261 HydrophobicContact CB-CD1 3.92Å; V222-Y261 HydrophobicContact CB-CE1 3.72Å; V222-Y261 HydrophobicContact CB-CG 4.47Å; V222-Y261 HydrophobicContact CG1-CD1 3.59Å; V222-Y261 HydrophobicContact CG1-CE1 3.93Å; V222-Y261 HydrophobicContact CG1-CG 4.07Å; V222-Y261 HydrophobicContact CG2-CD1 4.3Å; V222-Y261 HydrophobicContact CG2-CD2 4.35Å; V222-Y261 HydrophobicContact CG2-CE1 4.14Å; V222-Y261 HydrophobicContact CG2-CE2 4.21Å; V222-Y261 HydrophobicContact CG2-CG 4.4Å; M255-Y261 HydrophobicContact CE-CD2 3.58Å; M255-Y261 HydrophobicContact CE-CE2 4.43Å; M255-Y261 HydrophobicContact CE-CG 4.09Å; D257-Y261 VanDerWaalsContact O-CD2 3.31Å; D257-Y261 WeakPolarHBondContact O-CD2 3.4Å; R258-Y261 CarbonylContact O-C 3.59Å; R258-Y261 PolarHBondContact O-N 3.3Å; Y259-Y261 PolarHBondContact O-N 2.61Å; Y261-H263 VanDerWaalsContact C-N 3.33Å; Y261-H263 PolarHBondContact O-N 3.31Å; Y261-K264 HydrophobicContact CD1-CD 4.43Å; Y261-K264 WeakPolarHBondContact O-CA 3.39Å; Y261-K264 PolarHBondContact O-N 2.7Å; Y261-L265 WeakPolarHBondContact O-CG 3.13Å; Y261-L265 PolarHBondContact O-N 2.85Å
262F94.9Very high94.6Very high10 Ų1038.5 Ų38.54%0.04418%0.181CC..Hα-helixtrans-52.2-46.7-179.6-73.1-26.8000113.3L252 R258 Y259 K264 L265 V266 W295 L331L252-F262 HydrophobicContact CD2-CD1 3.62Å; L252-F262 HydrophobicContact CD2-CE1 3.96Å; R258-F262 HydrophobicContact CB-CD1 4.47Å; R258-F262 HydrophobicContact CB-CE1 3.82Å; R258-F262 HydrophobicContact CB-CZ 4.4Å; R258-F262 HydrophobicContact CG-CE1 3.68Å; R258-F262 HydrophobicContact CG-CZ 3.8Å; R258-F262 WeakPolarHBondContact O-CD1 3.41Å; R258-F262 PolarHBondContact O-N 3.11Å; R258-F262 VanDerWaalsContact O-N 3.1Å; Y259-F262 AromaticContact CD1-CE2 3.84Å; Y259-F262 HydrophobicContact CD1-CE2 3.84Å; Y259-F262 AromaticContact CD2-CE2 3.62Å; Y259-F262 HydrophobicContact CD2-CE2 3.62Å; Y259-F262 AromaticContact CD2-CZ 3.62Å; Y259-F262 HydrophobicContact CD2-CZ 3.62Å; Y259-F262 HydrophobicContact CE1-CE2 4.2Å; Y259-F262 AromaticContact CE2-CE2 3.96Å; Y259-F262 HydrophobicContact CE2-CE2 3.96Å; Y259-F262 AromaticContact CE2-CZ 3.86Å; Y259-F262 HydrophobicContact CE2-CZ 3.86Å; Y259-F262 HydrophobicContact CG-CD2 4.28Å; Y259-F262 AromaticContact CG-CE2 3.55Å; Y259-F262 HydrophobicContact CG-CE2 3.55Å; Y259-F262 HydrophobicContact CG-CZ 4.03Å; Y259-F262 PolarHBondContact O-N 3.48Å; F262-K264 PolarHBondContact O-N 3.25Å; F262-L265 PolarHBondContact O-N 3.15Å; F262-L265 VanDerWaalsContact O-N 3.15Å; F262-V266 HydrophobicContact CB-CG2 4.33Å; F262-V266 VanDerWaalsContact O-CB 3.26Å; F262-V266 WeakPolarHBondContact O-CB 3.22Å; F262-V266 WeakPolarHBondContact O-CG2 3.37Å; F262-V266 PolarHBondContact O-N 3.29Å; F262-W295 AromaticContact CE2-CD1 3.82Å; F262-L331 HydrophobicContact CD1-CD2 4.48Å; F262-L331 HydrophobicContact CD2-CD2 3.45Å; F262-L331 VanDerWaalsContact CD2-CD2 3.45Å; F262-L331 HydrophobicContact CE2-CD2 3.53Å; F262-L331 HydrophobicContact CG-CD2 3.97Å; F262-L331 HydrophobicContact CZ-CD2 4.09Å
263H93.3Very high94.4Very high20 Ų2040.4 Ų40.49%0.09319%0.191CC..Hα-helixtrans-56.8-19.2175.467.4-72.3000115.3S260 Y261 P267 N335 R338 L339S260-H263 PolarHBondContact O-CE1 3.34Å; S260-H263 PolarHBondContact O-ND1 2.9Å; Y261-H263 VanDerWaalsContact C-N 3.33Å; Y261-H263 PolarHBondContact O-N 3.31Å; H263-P267 WeakPolarHBondContact O-CD 3.42Å; H263-N335 HydrophobicContact CB-CB 4.03Å; H263-N335 WeakPolarHBondContact CB-OD1 3.33Å; H263-N335 PolarHBondContact N-OD1 3.5Å; H263-R338 HydrophobicContact CB-CB 4.36Å; H263-R338 PolarHBondContact CD2-NE 2.72Å; H263-R338 PolarHBondContact CD2-NH2 3.19Å; H263-R338 VanDerWaalsContact CD2-NH2 3.31Å; H263-R338 PolarHBondContact CE1-NH1 3.26Å; H263-R338 PolarHBondContact CE1-NH2 3.37Å; H263-R338 VanDerWaalsContact CG-CZ 3.46Å; H263-R338 PolarHBondContact ND1-NH1 2.74Å; H263-R338 VanDerWaalsContact ND1-NH1 3.12Å; H263-R338 PolarHBondContact NE2-NH1 2.89Å; H263-R338 PolarHBondContact NE2-NH2 2.87Å; H263-L339 VanDerWaalsContact O-CD2 3.27Å; H263-L339 WeakPolarHBondContact O-CD2 3.4Å
264K94.3Very high94.2Very high58 Ų5841.5 Ų41.525%0.25220%0.2SC..Hα-helixtrans-98.8-35.1175.5-53.2-172.8-174.5177.20112.3D223 L226 Y261 F262 P267D223-K264 WeakPolarHBondContact OD1-CD 3.34Å; D223-K264 WeakPolarHBondContact OD1-CE 3.11Å; D223-K264 IonicContact OD1-NZ 2.81Å; D223-K264 PolarHBondContact OD1-NZ 3.31Å; D223-K264 IonicContact OD2-NZ 3.72Å; D223-K264 PolarHBondContact OD2-NZ 2.94Å; L226-K264 HydrophobicContact CD1-CB 3.59Å; L226-K264 HydrophobicContact CD1-CD 3.4Å; L226-K264 VanDerWaalsContact CD1-CD 3.4Å; L226-K264 HydrophobicContact CD1-CG 4.04Å; L226-K264 HydrophobicContact CD2-CB 4.45Å; Y261-K264 HydrophobicContact CD1-CD 4.43Å; Y261-K264 WeakPolarHBondContact O-CA 3.39Å; Y261-K264 PolarHBondContact O-N 2.7Å; F262-K264 PolarHBondContact O-N 3.25Å; K264-P267 WeakPolarHBondContact O-CG 3.48Å
265L96.3Very high94.3Very high0 Ų037.6 Ų37.60%018%0.179CC..Hα-helixtrans-81.6-40.4-176.4-61.9-178.1000113.1L226 V248 W251 L252 M255 Y261 F262 L268 L269L226-L265 HydrophobicContact CD2-CD2 3.94Å; V248-L265 HydrophobicContact CG1-CB 4.28Å; V248-L265 HydrophobicContact CG1-CD2 4.4Å; V248-L265 WeakPolarHBondContact CG1-O 3.08Å; W251-L265 HydrophobicContact CB-CD1 3.94Å; W251-L265 HydrophobicContact CE3-CD2 3.7Å; W251-L265 HydrophobicContact CZ3-CD2 4.28Å; L252-L265 HydrophobicContact CD1-CB 4.41Å; L252-L265 HydrophobicContact CD2-CB 3.63Å; L252-L265 HydrophobicContact CD2-CD1 4.2Å; L252-L265 HydrophobicContact CG-CB 3.9Å; L252-L265 HydrophobicContact CG-CD1 4.36Å; M255-L265 HydrophobicContact CE-CD1 4.01Å; Y261-L265 WeakPolarHBondContact O-CG 3.13Å; Y261-L265 PolarHBondContact O-N 2.85Å; F262-L265 PolarHBondContact O-N 3.15Å; F262-L265 VanDerWaalsContact O-N 3.15Å; L265-L268 PolarHBondContact O-N 3.11Å; L265-L269 PolarHBondContact O-N 2.85Å; L265-L269 VanDerWaalsContact O-N 3.07Å
266V97Very high94.3Very high0 Ų044.5 Ų44.50%021%0.211CC..Hα-helixtrans-52.4-52.8177.81710000112.1L252 F262 L268 L269 L270 W288 V332L252-V266 HydrophobicContact CD2-CG2 4.32Å; F262-V266 HydrophobicContact CB-CG2 4.33Å; F262-V266 VanDerWaalsContact O-CB 3.26Å; F262-V266 WeakPolarHBondContact O-CB 3.22Å; F262-V266 WeakPolarHBondContact O-CG2 3.37Å; F262-V266 PolarHBondContact O-N 3.29Å; V266-L268 VanDerWaalsContact C-N 3.28Å; V266-L268 PolarHBondContact O-N 3.3Å; V266-L269 PolarHBondContact O-N 3.07Å; V266-L270 HydrophobicContact CG1-CD1 3.54Å; V266-L270 HydrophobicContact CG1-CG 4.07Å; V266-L270 WeakPolarHBondContact O-CB 3.47Å; V266-L270 VanDerWaalsContact O-CG 3.31Å; V266-L270 WeakPolarHBondContact O-CG 3.44Å; V266-L270 PolarHBondContact O-N 3.09Å; V266-W288 HydrophobicContact CB-CH2 4.5Å; V266-W288 HydrophobicContact CG1-CH2 3.85Å; V266-W288 HydrophobicContact CG1-CZ3 4.28Å; V266-W288 HydrophobicContact CG2-CH2 3.92Å; V266-W288 HydrophobicContact CG2-CZ3 3.89Å; V266-V332 HydrophobicContact CG1-CG2 4.23Å
267P95.5Very high94.7Very high25 Ų2535.6 Ų35.616%0.16218%0.181CC..Hα-helixtrans-63.7-31.8-179.323.9-34.2000113.2H263 K264 S271 L339 L361H263-P267 WeakPolarHBondContact O-CD 3.42Å; K264-P267 WeakPolarHBondContact O-CG 3.48Å; P267-S271 WeakPolarHBondContact O-CB 3.4Å; P267-S271 PolarHBondContact O-N 3.17Å; P267-S271 PolarHBondContact O-OG 3.07Å; P267-L339 HydrophobicContact CB-CD2 4.13Å; P267-L339 HydrophobicContact CG-CD2 3.73Å; P267-L361 HydrophobicContact CB-CD2 3.87Å
268L95.8Very high95.1Very high19 Ų1935 Ų3510%0.09918%0.182CC..Hα-helixtrans-67.9-44.1176.6-65.9-178.6000112.2L226 A230 L233 V248 L265 V266L226-L268 HydrophobicContact CD2-CD1 3.43Å; L226-L268 VanDerWaalsContact CD2-CD1 3.43Å; A230-L268 HydrophobicContact CB-CD2 3.69Å; L233-L268 HydrophobicContact CD1-CB 4.35Å; L233-L268 HydrophobicContact CD1-CD2 3.82Å; V248-L268 HydrophobicContact CG1-CB 4.01Å; V248-L268 HydrophobicContact CG2-CB 4.23Å; V248-L268 HydrophobicContact CG2-CD1 4.25Å; L265-L268 PolarHBondContact O-N 3.11Å; V266-L268 VanDerWaalsContact C-N 3.28Å; V266-L268 PolarHBondContact O-N 3.3Å
269L97.9Very high95.3Very high0 Ų038.4 Ų38.40%020%0.199CC..Hα-helixtrans-67.9-48.4176.8-174.269.3000111T245 V248 L252 L265 V266 S271 S272 A284 L287 W288T245-L269 HydrophobicContact CG2-CD1 3.86Å; V248-L269 HydrophobicContact CG1-CB 4.03Å; L252-L269 HydrophobicContact CD1-CB 3.83Å; L252-L269 HydrophobicContact CD1-CD2 3.5Å; L252-L269 HydrophobicContact CD1-CG 4.25Å; L265-L269 PolarHBondContact O-N 2.85Å; L265-L269 VanDerWaalsContact O-N 3.07Å; V266-L269 PolarHBondContact O-N 3.07Å; L269-S271 PolarHBondContact O-N 3.23Å; L269-S272 VanDerWaalsContact O-CB 3.24Å; L269-S272 WeakPolarHBondContact O-CB 3.44Å; L269-S272 PolarHBondContact O-N 3.33Å; L269-A284 HydrophobicContact CD1-CB 4.36Å; L269-L287 HydrophobicContact CD1-CB 4.39Å; L269-L287 HydrophobicContact CD2-CB 4.37Å; L269-W288 HydrophobicContact CD2-CB 3.83Å; L269-W288 HydrophobicContact CD2-CD2 4.49Å; L269-W288 HydrophobicContact CD2-CE3 3.92Å
270L96.8Very high95.5Very high0 Ų034.1 Ų34.10%018%0.183CC..Hα-helixtrans-64.8-28.4-177-67.8-175.4000112.8V266 S272 I273 W288 V332 L361 V364 L365V266-L270 HydrophobicContact CG1-CD1 3.54Å; V266-L270 HydrophobicContact CG1-CG 4.07Å; V266-L270 WeakPolarHBondContact O-CB 3.47Å; V266-L270 VanDerWaalsContact O-CG 3.31Å; V266-L270 WeakPolarHBondContact O-CG 3.44Å; V266-L270 PolarHBondContact O-N 3.09Å; L270-S272 PolarHBondContact O-N 2.89Å; L270-I273 HydrophobicContact CD2-CD1 3.43Å; L270-I273 VanDerWaalsContact CD2-CD1 3.43Å; L270-I273 HydrophobicContact CD2-CG1 4.48Å; L270-I273 WeakPolarHBondContact O-CB 3.26Å; L270-I273 PolarHBondContact O-N 3.41Å; L270-I273 VanDerWaalsContact O-N 3.13Å; L270-W288 HydrophobicContact CD1-CZ2 4.31Å; L270-W288 HydrophobicContact CD2-CD2 3.78Å; L270-W288 HydrophobicContact CD2-CE3 4.42Å; L270-W288 HydrophobicContact CD2-CG 3.91Å; L270-W288 HydrophobicContact CD2-CZ2 4.15Å; L270-V332 HydrophobicContact CD1-CG2 4Å; L270-L361 HydrophobicContact CB-CD1 3.55Å; L270-V364 HydrophobicContact CB-CG1 4.29Å; L270-V364 HydrophobicContact CD1-CG1 4.26Å; L270-V364 HydrophobicContact CD2-CG1 4.17Å; L270-V364 HydrophobicContact CG-CG1 4.48Å; L270-L365 HydrophobicContact CD1-CD2 3.66Å
271S95.1Very high95.7Very high28 Ų2835.6 Ų35.620%0.19618%0.179CC..Hα-helixtrans-60.7-27.5171.5-64.40000112.6P267 L269 I273P267-S271 WeakPolarHBondContact O-CB 3.4Å; P267-S271 PolarHBondContact O-N 3.17Å; P267-S271 PolarHBondContact O-OG 3.07Å; L269-S271 PolarHBondContact O-N 3.23Å; S271-I273 VanDerWaalsContact C-N 3.32Å
272S96.7Very high95.9Very high2 Ų239.9 Ų39.91%0.01420%0.203CC..G310 helixtrans-77.5-14.6178.4-550000113.3T245 L269 L270 S274 D275T245-S272 WeakPolarHBondContact OG1-CB 3.48Å; T245-S272 PolarHBondContact OG1-OG 3.01Å; L269-S272 VanDerWaalsContact O-CB 3.24Å; L269-S272 WeakPolarHBondContact O-CB 3.44Å; L269-S272 PolarHBondContact O-N 3.33Å; L270-S272 PolarHBondContact O-N 2.89Å; S272-S274 PolarHBondContact O-N 3.36Å; S272-D275 WeakPolarHBondContact O-CB 3.19Å; S272-D275 PolarHBondContact O-N 3.29Å
273I94.3Very high96.1Very high43 Ų4341.6 Ų41.622%0.22121%0.213CC..G310 helixtrans-66.9-25.5177.6-66.3-179.5000111.5L270 S271 R281 A284 V364L270-I273 HydrophobicContact CD2-CD1 3.43Å; L270-I273 VanDerWaalsContact CD2-CD1 3.43Å; L270-I273 HydrophobicContact CD2-CG1 4.48Å; L270-I273 WeakPolarHBondContact O-CB 3.26Å; L270-I273 PolarHBondContact O-N 3.41Å; L270-I273 VanDerWaalsContact O-N 3.13Å; S271-I273 VanDerWaalsContact C-N 3.32Å; I273-R281 WeakPolarHBondContact O-CD 3.28Å; I273-R281 WeakPolarHBondContact O-CG 3.31Å; I273-A284 HydrophobicContact CG1-CB 4Å; I273-V364 HydrophobicContact CD1-CG1 4.41Å
274S91.9Very high96.3Very high37 Ų3740.7 Ų40.726%0.25921%0.208SC..G310 helixtrans-100.116.3177.1-57.30000112.8S272 R357S272-S274 PolarHBondContact O-N 3.36Å; S274-R357 PolarHBondContact O-NH1 3.24Å
275D95.9Very high96.4Very high5 Ų540.1 Ų40.13%0.02721%0.214CC..  trans-60.3148.6177-160.8-71.6000111.2R241 S272 I277 I280 R281R241-D275 WeakPolarHBondContact CD-OD2 3.33Å; R241-D275 IonicContact CZ-OD1 2.81Å; R241-D275 IonicContact CZ-OD2 2.86Å; R241-D275 IonicContact NE-OD1 3.28Å; R241-D275 IonicContact NE-OD2 3.66Å; R241-D275 PolarHBondContact NE-OD2 2.81Å; R241-D275 IonicContact NH2-OD1 3.79Å; R241-D275 PolarHBondContact NH2-OD1 2.98Å; R241-D275 IonicContact NH2-OD2 2.64Å; S272-D275 WeakPolarHBondContact O-CB 3.19Å; S272-D275 PolarHBondContact O-N 3.29Å; D275-I277 PolarHBondContact O-N 3.16Å; D275-I277 PolarHBondContact OD1-N 3.2Å; D275-I280 HydrophobicContact CB-CB 3.97Å; D275-I280 HydrophobicContact CB-CG2 3.78Å; D275-R281 HydrophobicContact CB-CG 4.18Å; D275-R281 WeakPolarHBondContact O-CD 3.48Å; D275-R281 WeakPolarHBondContact O-CG 3.48Å; D275-R281 PolarHBondContact O-NH1 3.1Å
276E93.6Very high96.5Very high150 Ų15044 Ų4470%0.70124%0.235SC*.SBendtrans-66.3-30.3178.7-64174.9-175.600111.6P278 R281E276-P278 WeakPolarHBondContact O-CD 3.45Å; E276-R281 VanDerWaalsContact C-NH1 3.3Å; E276-R281 PolarHBondContact O-NH1 3.36Å
277I97.4Very high96.6Very high56 Ų5644.9 Ų44.929%0.28724%0.24SC..SBendtrans-86.9119.2-177.4-57.1-61.1000110.5P238 D275 E279 I280 R281P238-I277 HydrophobicContact CB-CG1 3.96Å; P238-I277 HydrophobicContact CG-CD1 4.23Å; P238-I277 HydrophobicContact CG-CG1 3.94Å; D275-I277 PolarHBondContact O-N 3.16Å; D275-I277 PolarHBondContact OD1-N 3.2Å; I277-E279 VanDerWaalsContact C-N 3.27Å; I277-E279 HydrophobicContact CG2-CB 4.14Å; I277-E279 PolarHBondContact O-N 3.18Å; I277-I280 HydrophobicContact CB-CD1 4.02Å; I277-I280 HydrophobicContact CB-CG1 4.11Å; I277-I280 HydrophobicContact CG1-CD1 4.47Å; I277-I280 HydrophobicContact CG2-CD1 4.41Å; I277-I280 HydrophobicContact CG2-CG1 4.16Å; I277-I280 PolarHBondContact O-N 2.93Å; I277-I280 VanDerWaalsContact O-N 3.07Å; I277-R281 PolarHBondContact O-N 2.96Å
278P97.1Very high96.7Very high71 Ų7144.2 Ų44.246%0.46123%0.234SC..Hα-helixtrans-57.1-37.1-177.1-23.831.3000114.2E276 I280 R281 L282E276-P278 WeakPolarHBondContact O-CD 3.45Å; P278-I280 VanDerWaalsContact C-N 3.28Å; P278-I280 PolarHBondContact O-N 2.71Å; P278-R281 PolarHBondContact O-N 3.37Å; P278-L282 WeakPolarHBondContact O-CG 3.4Å; P278-L282 PolarHBondContact O-N 3.17Å
279E97.8Very high96.8Very high98 Ų9848.9 Ų48.946%0.45825%0.254SS..Hα-helixtrans-59.4-38.5178.5-171.2-175.2179.600112.2K242 I277 L283K242-E279 IonicContact NZ-OE1 3.33Å; K242-E279 PolarHBondContact NZ-OE1 2.74Å; I277-E279 VanDerWaalsContact C-N 3.27Å; I277-E279 HydrophobicContact CG2-CB 4.14Å; I277-E279 PolarHBondContact O-N 3.18Å; E279-L283 WeakPolarHBondContact O-CB 3.39Å; E279-L283 PolarHBondContact O-N 3.32Å
280I98.2Very high96.8Very high1 Ų152.8 Ų52.81%0.00527%0.272CS..Hα-helixtrans-72.5-42.4179.1-58.9179.8000110.2P238 R241 K242 D275 I277 P278 L282 L283 A284P238-I280 HydrophobicContact CB-CD1 4.21Å; P238-I280 WeakPolarHBondContact O-CD1 3.35Å; R241-I280 HydrophobicContact CB-CD1 3.97Å; K242-I280 HydrophobicContact CB-CD1 4.16Å; K242-I280 HydrophobicContact CB-CG1 4.01Å; K242-I280 HydrophobicContact CG-CG1 4.42Å; D275-I280 HydrophobicContact CB-CB 3.97Å; D275-I280 HydrophobicContact CB-CG2 3.78Å; I277-I280 HydrophobicContact CB-CD1 4.02Å; I277-I280 HydrophobicContact CB-CG1 4.11Å; I277-I280 HydrophobicContact CG1-CD1 4.47Å; I277-I280 HydrophobicContact CG2-CD1 4.41Å; I277-I280 HydrophobicContact CG2-CG1 4.16Å; I277-I280 PolarHBondContact O-N 2.93Å; I277-I280 VanDerWaalsContact O-N 3.07Å; P278-I280 VanDerWaalsContact C-N 3.28Å; P278-I280 PolarHBondContact O-N 2.71Å; I280-L282 VanDerWaalsContact C-N 3.34Å; I280-L282 PolarHBondContact O-N 3.16Å; I280-L283 PolarHBondContact O-N 2.96Å; I280-A284 WeakPolarHBondContact O-CB 3.24Å; I280-A284 PolarHBondContact O-N 3.27Å
281R96.9Very high96.9Very high91 Ų9153 Ų5334%0.34327%0.274SS..Hα-helixtrans-58.9-46.1175.8-62.9-162.8-64.2-84.85.2111.9I273 D275 E276 I277 P278 A284 A285I273-R281 WeakPolarHBondContact O-CD 3.28Å; I273-R281 WeakPolarHBondContact O-CG 3.31Å; D275-R281 HydrophobicContact CB-CG 4.18Å; D275-R281 WeakPolarHBondContact O-CD 3.48Å; D275-R281 WeakPolarHBondContact O-CG 3.48Å; D275-R281 PolarHBondContact O-NH1 3.1Å; E276-R281 VanDerWaalsContact C-NH1 3.3Å; E276-R281 PolarHBondContact O-NH1 3.36Å; I277-R281 PolarHBondContact O-N 2.96Å; P278-R281 PolarHBondContact O-N 3.37Å; R281-A284 PolarHBondContact O-N 3.05Å; R281-A285 WeakPolarHBondContact O-CB 3.41Å; R281-A285 PolarHBondContact O-N 3.12Å
282L97.3Very high97Very high124 Ų12451.7 Ų51.765%0.64926%0.264SS*.Hα-helixtrans-65.5-42.4179.3-69.9173.5000111.6P278 I280 A285 D286P278-L282 WeakPolarHBondContact O-CG 3.4Å; P278-L282 PolarHBondContact O-N 3.17Å; I280-L282 VanDerWaalsContact C-N 3.34Å; I280-L282 PolarHBondContact O-N 3.16Å; L282-A285 PolarHBondContact O-N 3.44Å; L282-D286 WeakPolarHBondContact O-CB 3.31Å; L282-D286 PolarHBondContact O-N 2.91Å
283L98.6Very high97Very high46 Ų4655.9 Ų55.924%0.24129%0.286CS..Hα-helixtrans-60.8-46.3174.717863000111.6K242 T245 A246 E279 I280 D286 L287K242-L283 HydrophobicContact CG-CD2 3.76Å; T245-L283 HydrophobicContact CG2-CD2 4.33Å; T245-L283 HydrophobicContact CG2-CG 4.29Å; A246-L283 HydrophobicContact CB-CD2 4.37Å; E279-L283 WeakPolarHBondContact O-CB 3.39Å; E279-L283 PolarHBondContact O-N 3.32Å; I280-L283 PolarHBondContact O-N 2.96Å; L283-D286 PolarHBondContact O-N 3.31Å; L283-L287 HydrophobicContact CD1-CD1 3.73Å; L283-L287 HydrophobicContact CD1-CG 4.12Å; L283-L287 HydrophobicContact CG-CD1 3.78Å; L283-L287 WeakPolarHBondContact O-CB 3.16Å; L283-L287 VanDerWaalsContact O-CG 3.31Å; L283-L287 WeakPolarHBondContact O-CG 3.34Å; L283-L287 PolarHBondContact O-N 3.34Å
284A98.2Very high97.1Very high0 Ų056.3 Ų56.30%029%0.287CS..Hα-helixtrans-62.3-44.4178.400000111.9T245 L269 I273 I280 R281 W288T245-A284 HydrophobicContact CG2-CB 3.71Å; L269-A284 HydrophobicContact CD1-CB 4.36Å; I273-A284 HydrophobicContact CG1-CB 4Å; I280-A284 WeakPolarHBondContact O-CB 3.24Å; I280-A284 PolarHBondContact O-N 3.27Å; R281-A284 PolarHBondContact O-N 3.05Å; A284-W288 WeakPolarHBondContact O-CB 3.33Å; A284-W288 PolarHBondContact O-N 2.9Å
285A97Very high97.3Very high46 Ų4654.7 Ų54.738%0.3828%0.276SS..Hα-helixtrans-63.9-42.4178.400000112.3R281 L282 W288 K289R281-A285 WeakPolarHBondContact O-CB 3.41Å; R281-A285 PolarHBondContact O-N 3.12Å; L282-A285 PolarHBondContact O-N 3.44Å; A285-W288 PolarHBondContact O-N 3.14Å; A285-K289 WeakPolarHBondContact O-CB 3.32Å; A285-K289 PolarHBondContact O-N 3.11Å
286D98Very high97.2Very high82 Ų8256 Ų5644%0.43928%0.281SS..Hα-helixtrans-66.2-48.9177.9-175.966.5000111.9L282 L283 W288 K289 Q290L282-D286 WeakPolarHBondContact O-CB 3.31Å; L282-D286 PolarHBondContact O-N 2.91Å; L283-D286 PolarHBondContact O-N 3.31Å; D286-W288 VanDerWaalsContact C-N 3.28Å; D286-W288 PolarHBondContact O-N 2.91Å; D286-K289 PolarHBondContact O-N 3.29Å; D286-Q290 WeakPolarHBondContact O-CG 3.22Å; D286-Q290 PolarHBondContact O-N 2.79Å; D286-Q290 PolarHBondContact OD2-NE2 3.11Å
287L98.6Very high97.3Very high19 Ų1957 Ų5710%0.09928%0.283CS..Hα-helixtrans-59.8-39.9175.9-72166.6000111.8T245 L253 L269 L283 Q290 A291T245-L287 HydrophobicContact CG2-CD1 4.48Å; L253-L287 HydrophobicContact CD1-CD2 3.97Å; L269-L287 HydrophobicContact CD1-CB 4.39Å; L269-L287 HydrophobicContact CD2-CB 4.37Å; L283-L287 HydrophobicContact CD1-CD1 3.73Å; L283-L287 HydrophobicContact CD1-CG 4.12Å; L283-L287 HydrophobicContact CG-CD1 3.78Å; L283-L287 WeakPolarHBondContact O-CB 3.16Å; L283-L287 VanDerWaalsContact O-CG 3.31Å; L283-L287 WeakPolarHBondContact O-CG 3.34Å; L283-L287 PolarHBondContact O-N 3.34Å; L287-Q290 PolarHBondContact O-N 3.47Å; L287-A291 WeakPolarHBondContact O-CB 3.5Å; L287-A291 PolarHBondContact O-N 3.48Å
288W98Very high97.1Very high10 Ų1058.3 Ų58.34%0.03829%0.288CS..Hα-helixtrans-65.3-44.3177.4-177.8-126.4000112.1V266 L269 L270 A284 A285 D286 Q290 A291 G292 C328 L331 V332 H368V266-W288 HydrophobicContact CB-CH2 4.5Å; V266-W288 HydrophobicContact CG1-CH2 3.85Å; V266-W288 HydrophobicContact CG1-CZ3 4.28Å; V266-W288 HydrophobicContact CG2-CH2 3.92Å; V266-W288 HydrophobicContact CG2-CZ3 3.89Å; L269-W288 HydrophobicContact CD2-CB 3.83Å; L269-W288 HydrophobicContact CD2-CD2 4.49Å; L269-W288 HydrophobicContact CD2-CE3 3.92Å; L270-W288 HydrophobicContact CD1-CZ2 4.31Å; L270-W288 HydrophobicContact CD2-CD2 3.78Å; L270-W288 HydrophobicContact CD2-CE3 4.42Å; L270-W288 HydrophobicContact CD2-CG 3.91Å; L270-W288 HydrophobicContact CD2-CZ2 4.15Å; A284-W288 WeakPolarHBondContact O-CB 3.33Å; A284-W288 PolarHBondContact O-N 2.9Å; A285-W288 PolarHBondContact O-N 3.14Å; D286-W288 VanDerWaalsContact C-N 3.28Å; D286-W288 PolarHBondContact O-N 2.91Å; W288-Q290 VanDerWaalsContact C-N 3.34Å; W288-Q290 PolarHBondContact O-N 3.16Å; W288-A291 HydrophobicContact CE3-CB 4.42Å; W288-A291 PolarHBondContact O-N 3.29Å; W288-G292 PolarHBondContact O-N 3.13Å; W288-C328 HydrophobicContact CZ2-CB 3.84Å; W288-C328 WeakPolarHBondContact CZ2-O 2.94Å; W288-C328 PolarHBondContact O-SG 3.49Å; W288-L331 HydrophobicContact CH2-CB 3.78Å; W288-L331 HydrophobicContact CH2-CD1 3.96Å; W288-L331 HydrophobicContact CZ2-CB 4.49Å; W288-L331 HydrophobicContact CZ3-CD1 4.01Å; W288-V332 HydrophobicContact CH2-CG2 4.32Å; W288-V332 HydrophobicContact CZ2-CG2 3.92Å; W288-H368 AromaticContact CD1-NE2 3.76Å; W288-H368 AromaticContact CE2-NE2 3.84Å; W288-H368 AromaticContact NE1-CD2 3.53Å; W288-H368 AromaticContact NE1-CE1 3.93Å; W288-H368 AromaticContact NE1-NE2 2.88Å; W288-H368 PolarHBondContact NE1-NE2 3.32Å
289K97.5Very high97Very high117 Ų11755.8 Ų55.851%0.50927%0.271SS..Hα-helixtrans-59.5-44.8174.8-177.9175.3-1781690111.6A285 D286 G292 L293A285-K289 WeakPolarHBondContact O-CB 3.32Å; A285-K289 PolarHBondContact O-N 3.11Å; D286-K289 PolarHBondContact O-N 3.29Å; K289-G292 PolarHBondContact O-N 3.25Å; K289-L293 HydrophobicContact CG-CD1 4.18Å; K289-L293 WeakPolarHBondContact O-CG 3.33Å; K289-L293 PolarHBondContact O-N 2.65Å
290Q98.4Very high96.7Very high83 Ų8356.1 Ų56.139%0.38827%0.273SS..Hα-helixtrans-61.3-44.4175.8-68.7-177.247.800111.6L253 D286 L287 W288 G292 L293 Q294L253-Q290 HydrophobicContact CD1-CB 4.4Å; L253-Q290 HydrophobicContact CD2-CB 3.78Å; D286-Q290 WeakPolarHBondContact O-CG 3.22Å; D286-Q290 PolarHBondContact O-N 2.79Å; D286-Q290 PolarHBondContact OD2-NE2 3.11Å; L287-Q290 PolarHBondContact O-N 3.47Å; W288-Q290 VanDerWaalsContact C-N 3.34Å; W288-Q290 PolarHBondContact O-N 3.16Å; Q290-G292 VanDerWaalsContact C-N 3.35Å; Q290-G292 PolarHBondContact O-N 2.93Å; Q290-L293 PolarHBondContact O-N 3.33Å; Q290-Q294 WeakPolarHBondContact O-CB 3.37Å; Q290-Q294 PolarHBondContact O-N 3.1Å
291A98.1Very high96.3Very high4 Ų463.3 Ų63.33%0.03331%0.311CS..Hα-helixtrans-62.7-41.4178.900000111.9L252 L253 L287 W288 W295L252-A291 HydrophobicContact CB-CB 4.18Å; L253-A291 HydrophobicContact CD2-CB 4.12Å; L287-A291 WeakPolarHBondContact O-CB 3.5Å; L287-A291 PolarHBondContact O-N 3.48Å; W288-A291 HydrophobicContact CE3-CB 4.42Å; W288-A291 PolarHBondContact O-N 3.29Å; A291-W295 WeakPolarHBondContact O-CB 3.49Å; A291-W295 PolarHBondContact O-N 2.99Å
292G96.9Very high95.8Very high0 Ų064.3 Ų64.30%032%0.323CS..Hα-helixtrans-62.2-47.5173.700000113W288 K289 Q290 Q294 W295 E296W288-G292 PolarHBondContact O-N 3.13Å; K289-G292 PolarHBondContact O-N 3.25Å; Q290-G292 VanDerWaalsContact C-N 3.35Å; Q290-G292 PolarHBondContact O-N 2.93Å; G292-Q294 VanDerWaalsContact C-N 3.34Å; G292-Q294 PolarHBondContact O-N 3.28Å; G292-W295 PolarHBondContact O-N 3.28Å; G292-E296 WeakPolarHBondContact O-CG 3.45Å; G292-E296 PolarHBondContact O-N 3.45Å
293L96.6Very high95.5Very high91 Ų9158.5 Ų58.548%0.47629%0.293SS..Hα-helixtrans-63.4-39.6178.4-72.6171000112.4K289 Q290 E296 K297K289-L293 HydrophobicContact CG-CD1 4.18Å; K289-L293 WeakPolarHBondContact O-CG 3.33Å; K289-L293 PolarHBondContact O-N 2.65Å; Q290-L293 PolarHBondContact O-N 3.33Å; L293-E296 PolarHBondContact O-N 3.18Å; L293-K297 PolarHBondContact O-N 2.82Å; L293-K297 VanDerWaalsContact O-N 3.11Å
294Q97.4Very high94.9Very high51 Ų5162.2 Ų62.224%0.23831%0.307CS..Hα-helixtrans-64.5-45175.7-178.2174.8-2.200110.9L253 Q290 G292 K297 E298L253-Q294 VanDerWaalsContact CD2-OE1 3.25Å; L253-Q294 PolarHBondContact O-NE2 2.9Å; L253-Q294 PolarHBondContact O-OE1 3.23Å; L253-Q294 VanDerWaalsContact O-OE1 3.11Å; Q290-Q294 WeakPolarHBondContact O-CB 3.37Å; Q290-Q294 PolarHBondContact O-N 3.1Å; G292-Q294 VanDerWaalsContact C-N 3.34Å; G292-Q294 PolarHBondContact O-N 3.28Å; Q294-K297 PolarHBondContact O-N 3.21Å; Q294-E298 HydrophobicContact CG-CG 4.47Å; Q294-E298 VanDerWaalsContact CG-OE1 3.31Å; Q294-E298 WeakPolarHBondContact CG-OE1 3.39Å; Q294-E298 PolarHBondContact NE2-OE1 3.09Å; Q294-E298 WeakPolarHBondContact O-CB 3.21Å; Q294-E298 VanDerWaalsContact O-CG 3.27Å; Q294-E298 WeakPolarHBondContact O-CG 3.33Å; Q294-E298 PolarHBondContact O-N 3.35Å
295W95.9Very high94.2Very high4 Ų468 Ų682%0.01534%0.338CS..Hα-helixtrans-63-41.9176.9-17389.6000111.9Y259 F262 A291 G292 K297 E298 N299 I303 E330 L331Y259-W295 AromaticContact CE1-NE1 3.71Å; Y259-W295 AromaticContact CZ-CD1 3.82Å; F262-W295 AromaticContact CE2-CD1 3.82Å; A291-W295 WeakPolarHBondContact O-CB 3.49Å; A291-W295 PolarHBondContact O-N 2.99Å; G292-W295 PolarHBondContact O-N 3.28Å; W295-K297 VanDerWaalsContact C-N 3.33Å; W295-K297 PolarHBondContact O-N 2.77Å; W295-E298 PolarHBondContact O-N 3.24Å; W295-N299 HydrophobicContact CH2-CB 4.12Å; W295-N299 HydrophobicContact CZ2-CB 4.05Å; W295-N299 HydrophobicContact CZ3-CB 4.38Å; W295-N299 PolarHBondContact NE1-ND2 3.15Å; W295-N299 PolarHBondContact O-N 3.29Å; W295-N299 PolarHBondContact O-ND2 3.36Å; W295-I303 HydrophobicContact CH2-CG2 3.88Å; W295-I303 HydrophobicContact CZ3-CD1 4.08Å; W295-I303 HydrophobicContact CZ3-CG2 3.99Å; W295-E330 HydrophobicContact CE3-CB 4.14Å; W295-E330 HydrophobicContact CH2-CB 3.59Å; W295-E330 HydrophobicContact CH2-CG 4.03Å; W295-E330 HydrophobicContact CZ2-CB 4.4Å; W295-E330 HydrophobicContact CZ3-CB 3.42Å; W295-E330 VanDerWaalsContact CZ3-CB 3.42Å; W295-E330 HydrophobicContact CZ3-CG 3.76Å; W295-L331 HydrophobicContact CB-CD1 4.14Å; W295-L331 HydrophobicContact CB-CG 4.36Å; W295-L331 HydrophobicContact CD2-CD2 4.42Å; W295-L331 HydrophobicContact CD2-CG 4.33Å; W295-L331 HydrophobicContact CG-CD1 4.33Å; W295-L331 HydrophobicContact CG-CD2 3.93Å; W295-L331 HydrophobicContact CG-CG 4.01Å
296E94.1Very high93.7Very high31 Ų3168.7 Ų68.715%0.14533%0.333CS..Hα-helixtrans-55.2-49.1174.4-75.8172.2-158.600111.2G292 L293 E298 N299 E300 I303 L326 G327G292-E296 WeakPolarHBondContact O-CG 3.45Å; G292-E296 PolarHBondContact O-N 3.45Å; L293-E296 PolarHBondContact O-N 3.18Å; E296-E298 VanDerWaalsContact C-N 3.29Å; E296-E298 PolarHBondContact O-N 3.46Å; E296-N299 CarbonylContact O-C 3.39Å; E296-N299 PolarHBondContact O-N 3.49Å; E296-E300 WeakPolarHBondContact O-CA 3.35Å; E296-E300 PolarHBondContact O-N 3.46Å; E296-I303 HydrophobicContact CB-CD1 4.24Å; E296-I303 HydrophobicContact CG-CD1 4.07Å; E296-L326 HydrophobicContact CG-CB 4.46Å; E296-L326 WeakPolarHBondContact OE1-CA 3.35Å; E296-L326 WeakPolarHBondContact OE1-CB 3.36Å; E296-L326 PolarHBondContact OE1-N 3.16Å; E296-G327 VanDerWaalsContact CG-N 3.34Å; E296-G327 PolarHBondContact OE1-N 3.31Å
297K94.4Very high93Very high172 Ų17267.4 Ų67.475%0.74833%0.325SS*.Hα-helixtrans-62.7-35.4179.7-175.4179.8177.9-176.90112.8L293 Q294 W295L293-K297 PolarHBondContact O-N 2.82Å; L293-K297 VanDerWaalsContact O-N 3.11Å; Q294-K297 PolarHBondContact O-N 3.21Å; W295-K297 VanDerWaalsContact C-N 3.33Å; W295-K297 PolarHBondContact O-N 2.77Å
298E94.9Very high92.2Very high84 Ų8471.5 Ų71.539%0.39335%0.347SS..Hα-helixtrans-79.8-18.3-178.3-71.7168.117100113.5R258 Y259 Q294 W295 E296R258-E298 IonicContact CZ-OE1 2.77Å; R258-E298 IonicContact CZ-OE2 3.65Å; R258-E298 IonicContact NH2-OE1 3.95Å; R258-E298 PolarHBondContact NH2-OE1 2.83Å; R258-E298 IonicContact NH2-OE2 2.74Å; R258-E298 PolarHBondContact NH2-OE2 3.48Å; Y259-E298 WeakPolarHBondContact OH-CB 3.48Å; Y259-E298 PolarHBondContact OH-OE2 3.29Å; Y259-E298 VanDerWaalsContact OH-OE2 3.14Å; Q294-E298 HydrophobicContact CG-CG 4.47Å; Q294-E298 VanDerWaalsContact CG-OE1 3.31Å; Q294-E298 WeakPolarHBondContact CG-OE1 3.39Å; Q294-E298 PolarHBondContact NE2-OE1 3.09Å; Q294-E298 WeakPolarHBondContact O-CB 3.21Å; Q294-E298 VanDerWaalsContact O-CG 3.27Å; Q294-E298 WeakPolarHBondContact O-CG 3.33Å; Q294-E298 PolarHBondContact O-N 3.35Å; W295-E298 PolarHBondContact O-N 3.24Å; E296-E298 VanDerWaalsContact C-N 3.29Å; E296-E298 PolarHBondContact O-N 3.46Å
299N94.4Very high91.3Very high18 Ų1878.9 Ų78.910%0.09638%0.379CS..SBendtrans-124.522.7-176.9-54.7-103.3000112.1Y259 W295 E296 D301 D302 I303Y259-N299 PolarHBondContact OH-ND2 3.21Å; W295-N299 HydrophobicContact CH2-CB 4.12Å; W295-N299 HydrophobicContact CZ2-CB 4.05Å; W295-N299 HydrophobicContact CZ3-CB 4.38Å; W295-N299 PolarHBondContact NE1-ND2 3.15Å; W295-N299 PolarHBondContact O-N 3.29Å; W295-N299 PolarHBondContact O-ND2 3.36Å; E296-N299 CarbonylContact O-C 3.39Å; E296-N299 PolarHBondContact O-N 3.49Å; N299-D301 PolarHBondContact O-N 2.88Å; N299-D301 VanDerWaalsContact O-N 3.16Å; N299-D302 HydrophobicContact CB-CB 4.47Å; N299-D302 WeakPolarHBondContact O-CB 3.24Å; N299-D302 PolarHBondContact O-N 3.27Å; N299-I303 WeakPolarHBondContact O-CG1 3.24Å; N299-I303 PolarHBondContact O-N 3.48Å
300E91.4Very high90.3Very high105 Ų10577.5 Ų77.549%0.49138%0.377SS..Hα-helixtrans-50.3-43.3-174-174.7178.7163.600112.6E296 D302 I303 K304 M307E296-E300 WeakPolarHBondContact O-CA 3.35Å; E296-E300 PolarHBondContact O-N 3.46Å; E300-D302 VanDerWaalsContact C-N 3.28Å; E300-D302 PolarHBondContact O-N 3.27Å; E300-I303 PolarHBondContact O-N 3.38Å; E300-K304 PolarHBondContact O-N 2.93Å; E300-M307 HydrophobicContact CG-CE 4.46Å; E300-M307 HydrophobicContact CG-SD 4.01Å
301D89.1Confident89.2Confident151 Ų15178.8 Ų78.881%0.80739%0.386SS*.Hα-helixtrans-62.3-33179.7-68.2-37000113.1N299N299-D301 PolarHBondContact O-N 2.88Å; N299-D301 VanDerWaalsContact O-N 3.16Å
302D88Confident88.4Confident113 Ų11383.3 Ų83.360%0.60442%0.417SS*.Hα-helixtrans-79.7-24.4-178.7-72.8-11.6000112.9N299 E300N299-D302 HydrophobicContact CB-CB 4.47Å; N299-D302 WeakPolarHBondContact O-CB 3.24Å; N299-D302 PolarHBondContact O-N 3.27Å; E300-D302 VanDerWaalsContact C-N 3.28Å; E300-D302 PolarHBondContact O-N 3.27Å
303I89.7Confident87.8Confident2 Ų286.8 Ų86.81%0.0144%0.44CS..Hα-helixtrans-118.69.4-172.462.5161.4000113.8W295 E296 N299 E300 D305 K306 M307 L326 E330W295-I303 HydrophobicContact CH2-CG2 3.88Å; W295-I303 HydrophobicContact CZ3-CD1 4.08Å; W295-I303 HydrophobicContact CZ3-CG2 3.99Å; E296-I303 HydrophobicContact CB-CD1 4.24Å; E296-I303 HydrophobicContact CG-CD1 4.07Å; N299-I303 WeakPolarHBondContact O-CG1 3.24Å; N299-I303 PolarHBondContact O-N 3.48Å; E300-I303 PolarHBondContact O-N 3.38Å; I303-D305 VanDerWaalsContact C-N 3.33Å; I303-D305 PolarHBondContact O-N 3.03Å; I303-K306 HydrophobicContact CB-CB 4.49Å; I303-K306 CarbonylContact O-C 3.57Å; I303-K306 WeakPolarHBondContact O-CA 3.34Å; I303-K306 WeakPolarHBondContact O-CB 3.48Å; I303-K306 PolarHBondContact O-N 3.3Å; I303-M307 HydrophobicContact CD1-CG 3.93Å; I303-M307 HydrophobicContact CD1-SD 3.9Å; I303-M307 HydrophobicContact CG1-CG 4.09Å; I303-M307 HydrophobicContact CG1-SD 3.93Å; I303-M307 PolarHBondContact O-N 3.46Å; I303-L326 HydrophobicContact CD1-CD2 3.95Å; I303-L326 HydrophobicContact CD1-CG 4.42Å; I303-E330 HydrophobicContact CG2-CG 4.48Å
304K86.3Confident87.2Confident123 Ų12384.5 Ų84.554%0.53543%0.43SS..Hα-helixtrans-49.3-49.5-175.7-171172-175.21700113.6E300 K306 M307 D308E300-K304 PolarHBondContact O-N 2.93Å; K304-K306 VanDerWaalsContact C-N 3.26Å; K304-K306 PolarHBondContact O-N 3.3Å; K304-M307 WeakPolarHBondContact O-CB 3.39Å; K304-M307 PolarHBondContact O-N 2.89Å; K304-M307 VanDerWaalsContact O-N 3.08Å; K304-D308 PolarHBondContact O-N 3.09Å
305D84.3Confident86.3Confident123 Ų12388 Ų8866%0.65846%0.457SS*.Hα-helixtrans-60.7-36.3177.6-65.1-22.4000112I303 D308 F309I303-D305 VanDerWaalsContact C-N 3.33Å; I303-D305 PolarHBondContact O-N 3.03Å; D305-D308 PolarHBondContact O-N 3.11Å; D305-F309 WeakPolarHBondContact O-CD2 3.41Å; D305-F309 PolarHBondContact O-N 3.05Å; D305-F309 VanDerWaalsContact O-N 3.15Å
306K85Confident85.7Confident60 Ų6091.5 Ų91.526%0.26147%0.474SS..Hα-helixtrans-70.7-35.8176.7-57.7-172.6175-177.80111.6I303 K304 D308 L310 L326 E330I303-K306 HydrophobicContact CB-CB 4.49Å; I303-K306 CarbonylContact O-C 3.57Å; I303-K306 WeakPolarHBondContact O-CA 3.34Å; I303-K306 WeakPolarHBondContact O-CB 3.48Å; I303-K306 PolarHBondContact O-N 3.3Å; K304-K306 VanDerWaalsContact C-N 3.26Å; K304-K306 PolarHBondContact O-N 3.3Å; K306-D308 VanDerWaalsContact C-N 3.33Å; K306-L310 HydrophobicContact CB-CD1 4.03Å; K306-L310 HydrophobicContact CD-CD1 4.44Å; K306-L310 HydrophobicContact CG-CD1 3.89Å; K306-L310 WeakPolarHBondContact O-CA 3.19Å; K306-L310 WeakPolarHBondContact O-CB 3.3Å; K306-L310 PolarHBondContact O-N 2.66Å; K306-L326 HydrophobicContact CB-CD1 4.19Å; K306-L326 HydrophobicContact CB-CD2 4.03Å; K306-E330 WeakPolarHBondContact CD-OE1 3.42Å; K306-E330 IonicContact NZ-OE1 3.57Å; K306-E330 PolarHBondContact NZ-OE1 3.15Å; K306-E330 IonicContact NZ-OE2 3.18Å; K306-E330 PolarHBondContact NZ-OE2 3.01Å
307M83.8Confident85.5Confident55 Ų5591.5 Ų91.527%0.27147%0.473SS..Hα-helixtrans-65.6-36.9175.3-67.317868.100111.7E300 I303 K304 L311 L326E300-M307 HydrophobicContact CG-CE 4.46Å; E300-M307 HydrophobicContact CG-SD 4.01Å; I303-M307 HydrophobicContact CD1-CG 3.93Å; I303-M307 HydrophobicContact CD1-SD 3.9Å; I303-M307 HydrophobicContact CG1-CG 4.09Å; I303-M307 HydrophobicContact CG1-SD 3.93Å; I303-M307 PolarHBondContact O-N 3.46Å; K304-M307 WeakPolarHBondContact O-CB 3.39Å; K304-M307 PolarHBondContact O-N 2.89Å; K304-M307 VanDerWaalsContact O-N 3.08Å; M307-L311 WeakPolarHBondContact O-CD1 3.21Å; M307-L311 VanDerWaalsContact O-CG 3.24Å; M307-L311 WeakPolarHBondContact O-CG 3.42Å; M307-L326 HydrophobicContact CB-CD2 4.46Å; M307-L326 HydrophobicContact CG-CD2 3.66Å
308D81.5Confident85.3Confident105 Ų10584.6 Ų84.656%0.56145%0.445SS*.Hα-helixtrans-76.4-32.4-179.1-70.2-23.4000112.7K304 D305 K306K304-D308 PolarHBondContact O-N 3.09Å; D305-D308 PolarHBondContact O-N 3.11Å; K306-D308 VanDerWaalsContact C-N 3.33Å
309F78.8Confident84.9Confident165 Ų16586.7 Ų86.772%0.72447%0.467SS*.Hα-helixtrans-121.9-15.5-167.7-58.9-69.9000116.7D305D305-F309 WeakPolarHBondContact O-CD2 3.41Å; D305-F309 PolarHBondContact O-N 3.05Å; D305-F309 VanDerWaalsContact O-N 3.15Å
310L76.9Confident84.5Confident87 Ų8790.3 Ų90.346%0.45551%0.508SS..SBendtrans-117.918.6-169.3-59.9178.8000115.6K306 R323 R329K306-L310 HydrophobicContact CB-CD1 4.03Å; K306-L310 HydrophobicContact CD-CD1 4.44Å; K306-L310 HydrophobicContact CG-CD1 3.89Å; K306-L310 WeakPolarHBondContact O-CA 3.19Å; K306-L310 WeakPolarHBondContact O-CB 3.3Å; K306-L310 PolarHBondContact O-N 2.66Å; L310-R323 PolarHBondContact O-NH1 3Å; L310-R329 PolarHBondContact O-NH2 2.89Å
311L75.3Confident84.4Confident110 Ų11088.4 Ų88.458%0.57650%0.503SS*.  trans-74.7-33.4179.8-62.2177.8000113.3M307 R323M307-L311 WeakPolarHBondContact O-CD1 3.21Å; M307-L311 VanDerWaalsContact O-CG 3.24Å; M307-L311 WeakPolarHBondContact O-CG 3.42Å; L311-R323 PolarHBondContact O-NH1 3.43Å
312S81.1Confident84.3Confident99 Ų9988.7 Ų88.769%0.69250%0.5SS*.SBendtrans-72.4136.6-178.7-64.40000111.5R323S312-R323 PolarHBondContact O-NH1 2.83Å
313P83.9Confident84.5Confident74 Ų7485.1 Ų85.148%0.48148%0.478SS..PPolyproline II helixtrans-55.5145.3173.6-23.532.7000112.2Y317 R323P313-Y317 HydrophobicContact CB-CG 4.22Å; P313-R323 HydrophobicContact CG-CB 4.46Å
314P84.1Confident84.6Confident42 Ų4286 Ų8627%0.27348%0.484SS..PPolyproline II helixtrans-52.2148.9169-26.132.4000111.8H316 Y317P314-H316 PolarHBondContact O-N 2.7Å; P314-Y317 HydrophobicContact CG-CD2 4.36Å; P314-Y317 PolarHBondContact O-N 2.96Å; P314-Y317 VanDerWaalsContact O-N 3.08Å
315P79.7Confident84.9Confident125 Ų12582 Ų8281%0.81248%0.478SS*.THydrogen-bonded Turntrans-55.2-21.5-177.6-27.934.7000115.7
316H83.8Confident85.4Confident77 Ų7776.4 Ų76.436%0.35645%0.448SS..THydrogen-bonded Turntrans-116.827.9-176.5-54.2-47.5000112.6P314 T408 S447P314-H316 PolarHBondContact O-N 2.7Å; H316-T408 WeakPolarHBondContact O-CG2 3.46Å; H316-S447 PolarHBondContact CD2-OG 3.35Å; H316-S447 PolarHBondContact CE1-OG 2.96Å; H316-S447 PolarHBondContact NE2-OG 3.31Å
317Y90.1Very high85.9Confident31 Ų3173.6 Ų73.612%0.12244%0.435CS..PPolyproline II helixtrans-60.3143.4177.6-153.9-98.8000111.8P313 P314 V321 R323 P324 L367 F409P313-Y317 HydrophobicContact CB-CG 4.22Å; P314-Y317 HydrophobicContact CG-CD2 4.36Å; P314-Y317 PolarHBondContact O-N 2.96Å; P314-Y317 VanDerWaalsContact O-N 3.08Å; Y317-V321 HydrophobicContact CE1-CB 4.22Å; Y317-V321 HydrophobicContact CE1-CG1 4.18Å; Y317-R323 HydrophobicContact CE1-CB 3.88Å; Y317-R323 HydrophobicContact CE1-CG 4.39Å; Y317-R323 HydrophobicContact CE2-CB 4.24Å; Y317-R323 HydrophobicContact CE2-CG 3.85Å; Y317-R323 WeakPolarHBondContact OH-CA 3.33Å; Y317-P324 VanDerWaalsContact OH-CD 3.27Å; Y317-P324 WeakPolarHBondContact OH-CD 3.25Å; Y317-L367 HydrophobicContact CE1-CD1 4.28Å; Y317-L367 HydrophobicContact CE2-CD1 4.41Å; Y317-L367 WeakPolarHBondContact OH-CD1 3.34Å; Y317-L367 WeakPolarHBondContact OH-CG 3.39Å; Y317-F409 AromaticContact CD2-CE1 3.72Å; Y317-F409 HydrophobicContact CD2-CE1 3.72Å; Y317-F409 AromaticContact CD2-CZ 3.93Å; Y317-F409 HydrophobicContact CD2-CZ 3.93Å; Y317-F409 AromaticContact CE2-CE1 3.79Å; Y317-F409 HydrophobicContact CE2-CE1 3.79Å; Y317-F409 AromaticContact CE2-CZ 3.62Å; Y317-F409 HydrophobicContact CE2-CZ 3.62Å
318P89.9Confident86.4Confident27 Ų2771.2 Ų71.218%0.17542%0.424CS..PPolyproline II helixtrans-56.5134.1-178.2-27.436.3000113V321 L367 L405 T408P318-V321 HydrophobicContact CB-CB 4.23Å; P318-V321 HydrophobicContact CB-CG2 3.87Å; P318-V321 PolarHBondContact O-N 3.27Å; P318-L367 HydrophobicContact CG-CD1 4.48Å; P318-L405 HydrophobicContact CG-CD2 3.84Å; P318-T408 HydrophobicContact CG-CG2 4.33Å
319P86.6Confident87.1Confident129 Ų12967 Ų6784%0.83840%0.4SS*.THydrogen-bonded Turntrans-68136.8-176.327.9-34.5000111.3V321P319-V321 PolarHBondContact O-N 3.05Å
320G85.6Confident87.9Confident94 Ų9459.7 Ų59.797%0.96937%0.368SS*.THydrogen-bonded Turntrans74.96.7177.900000115.2
321V88.6Confident88.8Confident64 Ų6455.6 Ų55.639%0.38835%0.347SS..PPolyproline II helixtrans-102.9126.8177.2-176.60000109.7Y317 P318 P319 R323 L367Y317-V321 HydrophobicContact CE1-CB 4.22Å; Y317-V321 HydrophobicContact CE1-CG1 4.18Å; P318-V321 HydrophobicContact CB-CB 4.23Å; P318-V321 HydrophobicContact CB-CG2 3.87Å; P318-V321 PolarHBondContact O-N 3.27Å; P319-V321 PolarHBondContact O-N 3.05Å; V321-R323 PolarHBondContact O-N 3.15Å; V321-L367 HydrophobicContact CG1-CD1 4.02Å; V321-L367 HydrophobicContact CG1-CD2 3.61Å; V321-L367 HydrophobicContact CG1-CG 4.44Å
322E88.2Confident89.8Confident158 Ų15850.4 Ų50.474%0.73832%0.32SS*.PPolyproline II helixtrans-71.7127.6174.2-173177.5178.100109.9
323R91.4Very high90.5Very high38 Ų3846.9 Ų46.914%0.14329%0.294CS..PPolyproline II helixtrans-73.7127.5177.1-173.8-179.3-172.3-148.813.4110.3L310 L311 S312 P313 Y317 V321 R329 E370L310-R323 PolarHBondContact O-NH1 3Å; L311-R323 PolarHBondContact O-NH1 3.43Å; S312-R323 PolarHBondContact O-NH1 2.83Å; P313-R323 HydrophobicContact CG-CB 4.46Å; Y317-R323 HydrophobicContact CE1-CB 3.88Å; Y317-R323 HydrophobicContact CE1-CG 4.39Å; Y317-R323 HydrophobicContact CE2-CB 4.24Å; Y317-R323 HydrophobicContact CE2-CG 3.85Å; Y317-R323 WeakPolarHBondContact OH-CA 3.33Å; V321-R323 PolarHBondContact O-N 3.15Å; R323-R329 VanDerWaalsContact CZ-CZ 3.46Å; R323-R329 VanDerWaalsContact NH2-CZ 3.33Å; R323-E370 IonicContact CZ-OE1 3.76Å; R323-E370 IonicContact CZ-OE2 3.31Å; R323-E370 IonicContact NE-OE1 3.14Å; R323-E370 PolarHBondContact NE-OE1 3.37Å; R323-E370 IonicContact NE-OE2 2.95Å; R323-E370 IonicContact NH2-OE1 3.82Å; R323-E370 PolarHBondContact NH2-OE1 3.47Å; R323-E370 IonicContact NH2-OE2 2.65Å; R323-E370 PolarHBondContact NH2-OE2 3.13Å
324P92.6Very high90.9Very high21 Ų2149.3 Ų49.314%0.13629%0.294CS..PPolyproline II helixtrans-59.6146175.3-22.532.7000112.9Y317 C328 R329 H368Y317-P324 VanDerWaalsContact OH-CD 3.27Å; Y317-P324 WeakPolarHBondContact OH-CD 3.25Å; P324-C328 HydrophobicContact CB-CB 4.1Å; P324-R329 HydrophobicContact CB-CG 4.03Å; P324-R329 PolarHBondContact O-NE 3.36Å; P324-H368 VanDerWaalsContact CB-CD2 3.49Å; P324-H368 WeakPolarHBondContact CB-CD2 3.27Å; P324-H368 WeakPolarHBondContact CB-NE2 3.42Å; P324-H368 WeakPolarHBondContact CG-NE2 3.42Å
325G92.8Very high91.4Very high39 Ų3948.2 Ų48.240%0.40229%0.285SS..PPolyproline II helixtrans-56.8158.9174.800000112.6G327 C328 R329G325-G327 PolarHBondContact O-N 3.34Å; G325-C328 WeakPolarHBondContact O-CB 3.4Å; G325-C328 PolarHBondContact O-N 2.79Å; G325-R329 PolarHBondContact O-N 3.43Å
326L93.4Very high92Very high5 Ų542.4 Ų42.43%0.02625%0.248CC..Hα-helixtrans-59-45.1-173.2175.462000112.1E296 I303 K306 M307 C328 R329 E330E296-L326 HydrophobicContact CG-CB 4.46Å; E296-L326 WeakPolarHBondContact OE1-CA 3.35Å; E296-L326 WeakPolarHBondContact OE1-CB 3.36Å; E296-L326 PolarHBondContact OE1-N 3.16Å; I303-L326 HydrophobicContact CD1-CD2 3.95Å; I303-L326 HydrophobicContact CD1-CG 4.42Å; K306-L326 HydrophobicContact CB-CD1 4.19Å; K306-L326 HydrophobicContact CB-CD2 4.03Å; M307-L326 HydrophobicContact CB-CD2 4.46Å; M307-L326 HydrophobicContact CG-CD2 3.66Å; L326-C328 VanDerWaalsContact C-N 3.34Å; L326-C328 PolarHBondContact O-N 3.18Å; L326-R329 WeakPolarHBondContact O-CB 3.46Å; L326-R329 PolarHBondContact O-N 3.09Å; L326-R329 VanDerWaalsContact O-N 3.15Å; L326-E330 HydrophobicContact CD1-CG 4.15Å; L326-E330 HydrophobicContact CG-CG 4.43Å; L326-E330 WeakPolarHBondContact O-CG 3.47Å; L326-E330 PolarHBondContact O-N 3.25Å
327G95.1Very high92.5Very high0 Ų042 Ų420%025%0.254CS..Hα-helixtrans-66.5-35.2178.900000112.9E296 G325 R329 E330 L331E296-G327 VanDerWaalsContact CG-N 3.34Å; E296-G327 PolarHBondContact OE1-N 3.31Å; G325-G327 PolarHBondContact O-N 3.34Å; G327-R329 VanDerWaalsContact C-N 3.32Å; G327-R329 PolarHBondContact O-N 2.77Å; G327-E330 PolarHBondContact O-N 3.09Å; G327-L331 VanDerWaalsContact O-CB 3.29Å; G327-L331 WeakPolarHBondContact O-CB 3.4Å; G327-L331 WeakPolarHBondContact O-CG 3.37Å; G327-L331 PolarHBondContact O-N 3.23Å
328C96.1Very high92.5Very high5 Ų547.2 Ų47.23%0.03427%0.273CS..Hα-helixtrans-61-44.6172.2-66.70000110.7W288 P324 G325 L326 V332W288-C328 HydrophobicContact CZ2-CB 3.84Å; W288-C328 WeakPolarHBondContact CZ2-O 2.94Å; W288-C328 PolarHBondContact O-SG 3.49Å; P324-C328 HydrophobicContact CB-CB 4.1Å; G325-C328 WeakPolarHBondContact O-CB 3.4Å; G325-C328 PolarHBondContact O-N 2.79Å; L326-C328 VanDerWaalsContact C-N 3.34Å; L326-C328 PolarHBondContact O-N 3.18Å; C328-V332 PolarHBondContact O-N 3.48Å
329R95.3Very high92.7Very high18 Ų1846.3 Ų46.37%0.06827%0.266CS..Hα-helixtrans-64.6-49.4177.3-66.4-172.7-73.3127.82.5111.3L310 R323 P324 G325 L326 G327 L331 V332 V333 H368 E370L310-R329 PolarHBondContact O-NH2 2.89Å; R323-R329 VanDerWaalsContact CZ-CZ 3.46Å; R323-R329 VanDerWaalsContact NH2-CZ 3.33Å; P324-R329 HydrophobicContact CB-CG 4.03Å; P324-R329 PolarHBondContact O-NE 3.36Å; G325-R329 PolarHBondContact O-N 3.43Å; L326-R329 WeakPolarHBondContact O-CB 3.46Å; L326-R329 PolarHBondContact O-N 3.09Å; L326-R329 VanDerWaalsContact O-N 3.15Å; G327-R329 VanDerWaalsContact C-N 3.32Å; G327-R329 PolarHBondContact O-N 2.77Å; R329-L331 VanDerWaalsContact C-N 3.33Å; R329-L331 PolarHBondContact O-N 3.14Å; R329-V332 PolarHBondContact O-N 2.95Å; R329-V332 VanDerWaalsContact O-N 3.09Å; R329-V333 VanDerWaalsContact O-CG2 3.31Å; R329-V333 WeakPolarHBondContact O-CG2 3.34Å; R329-V333 PolarHBondContact O-N 3.15Å; R329-H368 WeakPolarHBondContact CB-O 3.43Å; R329-H368 WeakPolarHBondContact CG-O 3.4Å; R329-E370 IonicContact CZ-OE2 3.26Å; R329-E370 IonicContact NH1-OE2 3.12Å; R329-E370 PolarHBondContact NH1-OE2 2.91Å
330E95.1Very high92.9Very high10 Ų1040.5 Ų40.55%0.04723%0.229CC..Hα-helixtrans-60-40.3178.5-69.8-63.3128.800112.6W295 I303 K306 L326 G327 V332 V333 R334W295-E330 HydrophobicContact CE3-CB 4.14Å; W295-E330 HydrophobicContact CH2-CB 3.59Å; W295-E330 HydrophobicContact CH2-CG 4.03Å; W295-E330 HydrophobicContact CZ2-CB 4.4Å; W295-E330 HydrophobicContact CZ3-CB 3.42Å; W295-E330 VanDerWaalsContact CZ3-CB 3.42Å; W295-E330 HydrophobicContact CZ3-CG 3.76Å; I303-E330 HydrophobicContact CG2-CG 4.48Å; K306-E330 WeakPolarHBondContact CD-OE1 3.42Å; K306-E330 IonicContact NZ-OE1 3.57Å; K306-E330 PolarHBondContact NZ-OE1 3.15Å; K306-E330 IonicContact NZ-OE2 3.18Å; K306-E330 PolarHBondContact NZ-OE2 3.01Å; L326-E330 HydrophobicContact CD1-CG 4.15Å; L326-E330 HydrophobicContact CG-CG 4.43Å; L326-E330 WeakPolarHBondContact O-CG 3.47Å; L326-E330 PolarHBondContact O-N 3.25Å; G327-E330 PolarHBondContact O-N 3.09Å; E330-V332 VanDerWaalsContact C-N 3.32Å; E330-V332 PolarHBondContact O-N 3.41Å; E330-V333 PolarHBondContact O-N 3.16Å; E330-R334 WeakPolarHBondContact O-CB 3.28Å; E330-R334 VanDerWaalsContact O-CG 3.28Å; E330-R334 WeakPolarHBondContact O-CG 3.48Å; E330-R334 PolarHBondContact O-N 2.94Å
331L96.1Very high93.2Very high2 Ų240.1 Ų40.11%0.0121%0.209CC..Hα-helixtrans-60.2-40.6174.9-79170.5000111.8F262 W288 W295 G327 R329 N335F262-L331 HydrophobicContact CD1-CD2 4.48Å; F262-L331 HydrophobicContact CD2-CD2 3.45Å; F262-L331 VanDerWaalsContact CD2-CD2 3.45Å; F262-L331 HydrophobicContact CE2-CD2 3.53Å; F262-L331 HydrophobicContact CG-CD2 3.97Å; F262-L331 HydrophobicContact CZ-CD2 4.09Å; W288-L331 HydrophobicContact CH2-CB 3.78Å; W288-L331 HydrophobicContact CH2-CD1 3.96Å; W288-L331 HydrophobicContact CZ2-CB 4.49Å; W288-L331 HydrophobicContact CZ3-CD1 4.01Å; W295-L331 HydrophobicContact CB-CD1 4.14Å; W295-L331 HydrophobicContact CB-CG 4.36Å; W295-L331 HydrophobicContact CD2-CD2 4.42Å; W295-L331 HydrophobicContact CD2-CG 4.33Å; W295-L331 HydrophobicContact CG-CD1 4.33Å; W295-L331 HydrophobicContact CG-CD2 3.93Å; W295-L331 HydrophobicContact CG-CG 4.01Å; G327-L331 VanDerWaalsContact O-CB 3.29Å; G327-L331 WeakPolarHBondContact O-CB 3.4Å; G327-L331 WeakPolarHBondContact O-CG 3.37Å; G327-L331 PolarHBondContact O-N 3.23Å; R329-L331 VanDerWaalsContact C-N 3.33Å; R329-L331 PolarHBondContact O-N 3.14Å; L331-N335 PolarHBondContact O-ND2 3.11Å
332V96.7Very high93.3Very high0 Ų039.4 Ų39.40%021%0.21CC..Hα-helixtrans-70.4-50.5175.5171.10000110.9V266 L270 W288 C328 R329 E330 R334 N335 L336 L365 H368V266-V332 HydrophobicContact CG1-CG2 4.23Å; L270-V332 HydrophobicContact CD1-CG2 4Å; W288-V332 HydrophobicContact CH2-CG2 4.32Å; W288-V332 HydrophobicContact CZ2-CG2 3.92Å; C328-V332 PolarHBondContact O-N 3.48Å; R329-V332 PolarHBondContact O-N 2.95Å; R329-V332 VanDerWaalsContact O-N 3.09Å; E330-V332 VanDerWaalsContact C-N 3.32Å; E330-V332 PolarHBondContact O-N 3.41Å; V332-R334 VanDerWaalsContact C-N 3.35Å; V332-R334 PolarHBondContact O-N 2.82Å; V332-N335 CarbonylContact O-C 3.52Å; V332-N335 PolarHBondContact O-N 3.36Å; V332-L336 PolarHBondContact O-N 3.31Å; V332-L365 HydrophobicContact CG1-CB 4.43Å; V332-L365 HydrophobicContact CG1-CD2 3.79Å; V332-L365 HydrophobicContact CG2-CD2 4.04Å; V332-H368 HydrophobicContact CB-CB 3.73Å; V332-H368 HydrophobicContact CG1-CB 3.88Å; V332-H368 HydrophobicContact CG2-CB 3.66Å
333V95.1Very high93.6Very high26 Ų2632.2 Ų32.216%0.15818%0.176CC..Hα-helixtrans-54.5-48.9-177.9167.30000111.5R329 E330 N335 L336 H372R329-V333 VanDerWaalsContact O-CG2 3.31Å; R329-V333 WeakPolarHBondContact O-CG2 3.34Å; R329-V333 PolarHBondContact O-N 3.15Å; E330-V333 PolarHBondContact O-N 3.16Å; V333-N335 PolarHBondContact O-N 2.79Å; V333-L336 PolarHBondContact O-N 2.54Å; V333-H372 HydrophobicContact CG1-CB 4.03Å; V333-H372 WeakPolarHBondContact CG1-CD2 3.43Å; V333-H372 HydrophobicContact CG2-CB 3.88Å
334R93.7Very high93.6Very high125 Ų12531.4 Ų31.447%0.47218%0.18SC..Hα-helixtrans-64.3-23-178.8-72.1179.5174.5-140.84.3113.4E330 V332E330-R334 WeakPolarHBondContact O-CB 3.28Å; E330-R334 VanDerWaalsContact O-CG 3.28Å; E330-R334 WeakPolarHBondContact O-CG 3.48Å; E330-R334 PolarHBondContact O-N 2.94Å; V332-R334 VanDerWaalsContact C-N 3.35Å; V332-R334 PolarHBondContact O-N 2.82Å
335N94.3Very high93.6Very high18 Ų1836.2 Ų36.210%0.09620%0.2CC..Hα-helixtrans-106.3-5.9-178-67.3-71.7000113.4H263 L331 V332 V333 S337 R338 L339H263-N335 HydrophobicContact CB-CB 4.03Å; H263-N335 WeakPolarHBondContact CB-OD1 3.33Å; H263-N335 PolarHBondContact N-OD1 3.5Å; L331-N335 PolarHBondContact O-ND2 3.11Å; V332-N335 CarbonylContact O-C 3.52Å; V332-N335 PolarHBondContact O-N 3.36Å; V333-N335 PolarHBondContact O-N 2.79Å; N335-S337 VanDerWaalsContact C-N 3.31Å; N335-S337 PolarHBondContact O-N 3.38Å; N335-R338 PolarHBondContact O-N 3.11Å; N335-L339 HydrophobicContact CB-CD1 4.24Å; N335-L339 HydrophobicContact CB-CG 4.47Å; N335-L339 WeakPolarHBondContact O-CG 3.43Å; N335-L339 PolarHBondContact O-N 3.21Å; N335-L339 VanDerWaalsContact O-N 3.16Å
336L92.7Very high93.7Very high4 Ų437.2 Ų37.22%0.02120%0.196CC..Hα-helixtrans-58.7-39.3-170.3-169.457.9000113.1V332 V333 R338 L339 V340 A369 H376V332-L336 PolarHBondContact O-N 3.31Å; V333-L336 PolarHBondContact O-N 2.54Å; L336-R338 PolarHBondContact O-N 3.02Å; L336-R338 VanDerWaalsContact O-N 3.15Å; L336-L339 PolarHBondContact O-N 3.45Å; L336-L339 VanDerWaalsContact O-N 3.09Å; L336-V340 HydrophobicContact CD1-CG2 3.96Å; L336-V340 HydrophobicContact CG-CG2 4.09Å; L336-V340 WeakPolarHBondContact O-CG2 3.47Å; L336-V340 PolarHBondContact O-N 3.37Å; L336-A369 HydrophobicContact CD2-CB 3.66Å; L336-H376 VanDerWaalsContact CD2-CD2 3.48Å; L336-H376 WeakPolarHBondContact CD2-CD2 3.4Å
337S92.6Very high93.7Very high69 Ų6937 Ų3748%0.48320%0.195SC..Hα-helixtrans-57.4-29177.163.80000114.1N335 P341 H376N335-S337 VanDerWaalsContact C-N 3.31Å; N335-S337 PolarHBondContact O-N 3.38Å; S337-P341 WeakPolarHBondContact O-CD 3.32Å; S337-H376 VanDerWaalsContact CA-CE1 3.47Å; S337-H376 WeakPolarHBondContact CA-CE1 3.38Å
338R91.8Very high93.5Very high140 Ų14039 Ų3953%0.52821%0.207SC..Hα-helixtrans-91.3-29.4178.1-57.4179.671.2172.25.2112.2H263 N335 L336H263-R338 HydrophobicContact CB-CB 4.36Å; H263-R338 PolarHBondContact CD2-NE 2.72Å; H263-R338 PolarHBondContact CD2-NH2 3.19Å; H263-R338 VanDerWaalsContact CD2-NH2 3.31Å; H263-R338 PolarHBondContact CE1-NH1 3.26Å; H263-R338 PolarHBondContact CE1-NH2 3.37Å; H263-R338 VanDerWaalsContact CG-CZ 3.46Å; H263-R338 PolarHBondContact ND1-NH1 2.74Å; H263-R338 VanDerWaalsContact ND1-NH1 3.12Å; H263-R338 PolarHBondContact NE2-NH1 2.89Å; H263-R338 PolarHBondContact NE2-NH2 2.87Å; N335-R338 PolarHBondContact O-N 3.11Å; L336-R338 PolarHBondContact O-N 3.02Å; L336-R338 VanDerWaalsContact O-N 3.15Å
339L92.7Very high93.5Very high7 Ų740.2 Ų40.24%0.03721%0.214CC..Hα-helixtrans-75.1-42.4180-64.8175.3000111.8H263 P267 N335 L336 A342 I343 L365H263-L339 VanDerWaalsContact O-CD2 3.27Å; H263-L339 WeakPolarHBondContact O-CD2 3.4Å; P267-L339 HydrophobicContact CB-CD2 4.13Å; P267-L339 HydrophobicContact CG-CD2 3.73Å; N335-L339 HydrophobicContact CB-CD1 4.24Å; N335-L339 HydrophobicContact CB-CG 4.47Å; N335-L339 WeakPolarHBondContact O-CG 3.43Å; N335-L339 PolarHBondContact O-N 3.21Å; N335-L339 VanDerWaalsContact O-N 3.16Å; L336-L339 PolarHBondContact O-N 3.45Å; L336-L339 VanDerWaalsContact O-N 3.09Å; L339-A342 WeakPolarHBondContact O-CB 3.29Å; L339-A342 PolarHBondContact O-N 2.76Å; L339-A342 VanDerWaalsContact O-N 3.09Å; L339-I343 HydrophobicContact CB-CD1 4.32Å; L339-I343 VanDerWaalsContact O-CG1 3.28Å; L339-I343 WeakPolarHBondContact O-CG1 3.33Å; L339-I343 PolarHBondContact O-N 2.74Å; L339-L365 HydrophobicContact CD1-CD1 4.35Å; L339-L365 HydrophobicContact CD1-CD2 3.93Å
340V91.8Very high93.4Very high8 Ų849.2 Ų49.25%0.04825%0.248CC..Hα-helixtrans-53.1-49.8-177.1158.70000113.3L336 A342 I343 G344 H376 P379 M380L336-V340 HydrophobicContact CD1-CG2 3.96Å; L336-V340 HydrophobicContact CG-CG2 4.09Å; L336-V340 WeakPolarHBondContact O-CG2 3.47Å; L336-V340 PolarHBondContact O-N 3.37Å; V340-A342 VanDerWaalsContact C-N 3.33Å; V340-A342 PolarHBondContact O-N 3.38Å; V340-I343 PolarHBondContact O-N 3.12Å; V340-G344 PolarHBondContact O-N 3.26Å; V340-H376 HydrophobicContact CG2-CB 4.23Å; V340-P379 HydrophobicContact CG1-CB 3.93Å; V340-P379 HydrophobicContact CG1-CG 4.13Å; V340-M380 HydrophobicContact CB-CE 3.76Å; V340-M380 HydrophobicContact CG1-CE 3.38Å; V340-M380 HydrophobicContact CG2-CE 3.38Å; V340-M380 HydrophobicContact CG2-CG 4.47Å; V340-M380 HydrophobicContact CG2-SD 4Å
341P91.5Very high93.4Very high86 Ų8652.2 Ų52.256%0.55826%0.264SS*.Hα-helixtrans-62.3-38.1177.6-24.235.1000113.5S337 G344 H345S337-P341 WeakPolarHBondContact O-CD 3.32Å; P341-G344 PolarHBondContact O-N 3.18Å; P341-H345 PolarHBondContact O-N 3.26Å; P341-H345 VanDerWaalsContact O-N 3.1Å
342A91.1Very high93.4Very high48 Ų4855 Ų5540%0.39728%0.281SS..Hα-helixtrans-66.4-44.9179.300000111.5L339 V340 G344 H345 D346L339-A342 WeakPolarHBondContact O-CB 3.29Å; L339-A342 PolarHBondContact O-N 2.76Å; L339-A342 VanDerWaalsContact O-N 3.09Å; V340-A342 VanDerWaalsContact C-N 3.33Å; V340-A342 PolarHBondContact O-N 3.38Å; A342-G344 VanDerWaalsContact C-N 3.27Å; A342-G344 PolarHBondContact O-N 3.19Å; A342-H345 WeakPolarHBondContact O-CB 3.47Å; A342-H345 PolarHBondContact O-N 2.92Å; A342-H345 VanDerWaalsContact O-N 3.17Å; A342-D346 PolarHBondContact O-N 2.82Å
343I93.6Very high93.2Very high8 Ų857.6 Ų57.64%0.04130%0.302CS..Hα-helixtrans-60.8-40.5174.4-59.2161.4000110.2L339 V340 H345 D346 V347 T358 L362 L365 L383L339-I343 HydrophobicContact CB-CD1 4.32Å; L339-I343 VanDerWaalsContact O-CG1 3.28Å; L339-I343 WeakPolarHBondContact O-CG1 3.33Å; L339-I343 PolarHBondContact O-N 2.74Å; V340-I343 PolarHBondContact O-N 3.12Å; I343-H345 VanDerWaalsContact C-N 3.27Å; I343-H345 PolarHBondContact O-N 3.27Å; I343-D346 PolarHBondContact O-N 3.18Å; I343-V347 WeakPolarHBondContact O-CB 3.03Å; I343-V347 WeakPolarHBondContact O-CG1 3.45Å; I343-V347 PolarHBondContact O-N 3.06Å; I343-T358 HydrophobicContact CB-CG2 4.16Å; I343-T358 HydrophobicContact CG2-CG2 3.53Å; I343-L362 HydrophobicContact CG2-CB 4.27Å; I343-L362 HydrophobicContact CG2-CD1 4.37Å; I343-L365 HydrophobicContact CD1-CD1 3.29Å; I343-L365 HydrophobicContact CG1-CD1 4.34Å; I343-L383 HydrophobicContact CB-CD1 4.15Å; I343-L383 HydrophobicContact CG2-CD1 3.74Å
344G92.3Very high93.1Very high21 Ų2157.5 Ų57.522%0.21630%0.302CS..Hα-helixtrans-61.7-34.2177.900000113.6V340 P341 A342 T348V340-G344 PolarHBondContact O-N 3.26Å; P341-G344 PolarHBondContact O-N 3.18Å; A342-G344 VanDerWaalsContact C-N 3.27Å; A342-G344 PolarHBondContact O-N 3.19Å; G344-T348 PolarHBondContact O-OG1 3.37Å
345H92.4Very high93.2Very high122 Ų12252.7 Ų52.757%0.56528%0.284SS*.Hα-helixtrans-69.8-53.9171.4177.7-87.4000110.7P341 A342 I343 V347 T348P341-H345 PolarHBondContact O-N 3.26Å; P341-H345 VanDerWaalsContact O-N 3.1Å; A342-H345 WeakPolarHBondContact O-CB 3.47Å; A342-H345 PolarHBondContact O-N 2.92Å; A342-H345 VanDerWaalsContact O-N 3.17Å; I343-H345 VanDerWaalsContact C-N 3.27Å; I343-H345 PolarHBondContact O-N 3.27Å; H345-V347 PolarHBondContact O-N 2.78Å; H345-T348 PolarHBondContact O-N 3.3Å; H345-T348 VanDerWaalsContact O-N 3.1Å; H345-T348 PolarHBondContact O-OG1 2.71Å
346D93.6Very high93.3Very high59 Ų5953 Ų5332%0.31629%0.286SS..Hα-helixtrans-73.4-26.4-168.5-66.1-7.1000113.9A342 I343 T348 D349 T354 T358A342-D346 PolarHBondContact O-N 2.82Å; I343-D346 PolarHBondContact O-N 3.18Å; D346-T348 PolarHBondContact O-N 2.72Å; D346-D349 VanDerWaalsContact O-CB 3.29Å; D346-D349 WeakPolarHBondContact O-CB 3.25Å; D346-D349 PolarHBondContact O-N 2.85Å; D346-T354 HydrophobicContact CB-CG2 4.2Å; D346-T358 HydrophobicContact CB-CG2 3.85Å; D346-T358 WeakPolarHBondContact CB-OG1 3.38Å
347V94Very high93.3Very high1 Ų154.7 Ų54.71%0.00629%0.292CS..THydrogen-bonded Turntrans-70.2-10.8174.381.70000112.1I343 H345 R355 T358 L383 A387 V395I343-V347 WeakPolarHBondContact O-CB 3.03Å; I343-V347 WeakPolarHBondContact O-CG1 3.45Å; I343-V347 PolarHBondContact O-N 3.06Å; H345-V347 PolarHBondContact O-N 2.78Å; V347-R355 WeakPolarHBondContact O-CD 3.17Å; V347-R355 WeakPolarHBondContact O-CG 3.45Å; V347-T358 HydrophobicContact CB-CG2 4.02Å; V347-L383 HydrophobicContact CG1-CD1 4.39Å; V347-L383 HydrophobicContact CG1-CD2 3.91Å; V347-L383 HydrophobicContact CG1-CG 3.86Å; V347-A387 HydrophobicContact CG1-CB 4.44Å; V347-A387 HydrophobicContact CG2-CB 3.95Å; V347-V395 HydrophobicContact CG2-CG1 4.18Å
348T91.4Very high93.4Very high41 Ų4152 Ų5225%0.25227%0.272SS..THydrogen-bonded Turntrans-114.913.4176.963.80000112.5G344 H345 D346 R386G344-T348 PolarHBondContact O-OG1 3.37Å; H345-T348 PolarHBondContact O-N 3.3Å; H345-T348 VanDerWaalsContact O-N 3.1Å; H345-T348 PolarHBondContact O-OG1 2.71Å; D346-T348 PolarHBondContact O-N 2.72Å; T348-R386 HydrophobicContact CG2-CG 3.79Å; T348-R386 VanDerWaalsContact CG2-CZ 3.42Å; T348-R386 PolarHBondContact OG1-NH1 3.07Å
349D95Very high93.7Very high32 Ų3245.3 Ų45.317%0.17125%0.247CC..  trans-64149.8179.6-168.5-92.2000111.6D346 L351 T354 R355D346-D349 VanDerWaalsContact O-CB 3.29Å; D346-D349 WeakPolarHBondContact O-CB 3.25Å; D346-D349 PolarHBondContact O-N 2.85Å; D349-L351 PolarHBondContact O-N 3.07Å; D349-L351 VanDerWaalsContact OD1-CB 3.25Å; D349-L351 WeakPolarHBondContact OD1-CB 3.41Å; D349-L351 PolarHBondContact OD1-N 3.11Å; D349-T354 HydrophobicContact CB-CG2 3.91Å; D349-R355 HydrophobicContact CB-CG 4.37Å; D349-R355 WeakPolarHBondContact O-CD 3.32Å; D349-R355 WeakPolarHBondContact O-CG 3.23Å; D349-R355 PolarHBondContact O-NH1 3.34Å
350W94.6Very high93.8Very high206 Ų20647.1 Ų47.178%0.7826%0.256SS*.SBendtrans-65.3-25.3-179.965.9-80.2000112.5R355W350-R355 PolarHBondContact O-NH1 3.1Å
351L94.4Very high94Very high73 Ų7347.3 Ų47.338%0.38226%0.256SS..  trans-81.2119.9175.5-67.1169000111.8D349 A353 T354 R355D349-L351 PolarHBondContact O-N 3.07Å; D349-L351 VanDerWaalsContact OD1-CB 3.25Å; D349-L351 WeakPolarHBondContact OD1-CB 3.41Å; D349-L351 PolarHBondContact OD1-N 3.11Å; L351-A353 VanDerWaalsContact C-N 3.33Å; L351-A353 PolarHBondContact O-N 3.3Å; L351-T354 WeakPolarHBondContact CB-OG1 3.47Å; L351-T354 WeakPolarHBondContact O-CB 3.46Å; L351-T354 PolarHBondContact O-N 3.49Å; L351-R355 PolarHBondContact O-N 3.05Å
352V95.3Very high94.2Very high61 Ų6143.2 Ų43.237%0.3723%0.23SC..Hα-helixtrans-55.1-46.4176.7171.20000112T354 R355 V356 E392V352-T354 VanDerWaalsContact C-N 3.29Å; V352-T354 PolarHBondContact O-N 2.73Å; V352-R355 PolarHBondContact O-N 3.14Å; V352-R355 VanDerWaalsContact O-N 3.16Å; V352-V356 HydrophobicContact CG1-CG2 4.19Å; V352-V356 WeakPolarHBondContact O-CG2 3.21Å; V352-V356 PolarHBondContact O-N 3.24Å; V352-E392 HydrophobicContact CG1-CG 3.79Å; V352-E392 HydrophobicContact CG2-CG 4.08Å
353A92.9Very high94.4Very high55 Ų5542.1 Ų42.146%0.45522%0.219SC..Hα-helixtrans-58.8-41.9-178.200000111.9F234 L351 V356 R357F234-A353 HydrophobicContact CD1-CB 3.95Å; F234-A353 HydrophobicContact CE1-CB 4.07Å; F234-A353 WeakPolarHBondContact CE1-O 3.31Å; L351-A353 VanDerWaalsContact C-N 3.33Å; L351-A353 PolarHBondContact O-N 3.3Å; A353-V356 PolarHBondContact O-N 2.98Å; A353-R357 WeakPolarHBondContact O-CG 2.85Å; A353-R357 PolarHBondContact O-N 2.85Å
354T93.8Very high94.5Very high24 Ų2442.7 Ų42.715%0.14722%0.223CC..Hα-helixtrans-60.8-50.7175.5-53.70000110.6D346 D349 L351 V352 V356 R357 T358D346-T354 HydrophobicContact CB-CG2 4.2Å; D349-T354 HydrophobicContact CB-CG2 3.91Å; L351-T354 WeakPolarHBondContact CB-OG1 3.47Å; L351-T354 WeakPolarHBondContact O-CB 3.46Å; L351-T354 PolarHBondContact O-N 3.49Å; V352-T354 VanDerWaalsContact C-N 3.29Å; V352-T354 PolarHBondContact O-N 2.73Å; T354-V356 VanDerWaalsContact C-N 3.34Å; T354-V356 PolarHBondContact O-N 3.22Å; T354-R357 PolarHBondContact O-N 2.93Å; T354-T358 WeakPolarHBondContact O-CB 3.29Å; T354-T358 PolarHBondContact O-N 3.34Å; T354-T358 PolarHBondContact O-OG1 3.08Å
355R95.9Very high94.7Very high24 Ų2441.7 Ų41.79%0.09121%0.213CC..Hα-helixtrans-58.4-44.6179.5-60.1-161.8-58.1-81.16.4112.3V347 D349 W350 L351 V352 T358 S359 D390 V395V347-R355 WeakPolarHBondContact O-CD 3.17Å; V347-R355 WeakPolarHBondContact O-CG 3.45Å; D349-R355 HydrophobicContact CB-CG 4.37Å; D349-R355 WeakPolarHBondContact O-CD 3.32Å; D349-R355 WeakPolarHBondContact O-CG 3.23Å; D349-R355 PolarHBondContact O-NH1 3.34Å; W350-R355 PolarHBondContact O-NH1 3.1Å; L351-R355 PolarHBondContact O-N 3.05Å; V352-R355 PolarHBondContact O-N 3.14Å; V352-R355 VanDerWaalsContact O-N 3.16Å; R355-T358 PolarHBondContact O-N 3.44Å; R355-S359 WeakPolarHBondContact O-CB 3.49Å; R355-S359 PolarHBondContact O-N 3.29Å; R355-S359 PolarHBondContact O-OG 3.12Å; R355-D390 VanDerWaalsContact CD-OD2 3.23Å; R355-D390 WeakPolarHBondContact CD-OD2 3.19Å; R355-D390 IonicContact CZ-OD1 3.69Å; R355-D390 IonicContact CZ-OD2 2.93Å; R355-D390 IonicContact NE-OD1 2.87Å; R355-D390 IonicContact NE-OD2 3.75Å; R355-D390 PolarHBondContact NE-OD2 2.95Å; R355-D390 IonicContact NH2-OD1 2.62Å; R355-D390 PolarHBondContact NH2-OD1 3.24Å; R355-D390 IonicContact NH2-OD2 3.61Å; R355-V395 HydrophobicContact CB-CG2 3.83Å
356V95.4Very high94.8Very high23 Ų2336 Ų3614%0.13919%0.186CC..Hα-helixtrans-61.8-51.8178173.90000110.8V352 A353 T354 T358 S359 Q360 D394 V395V352-V356 HydrophobicContact CG1-CG2 4.19Å; V352-V356 WeakPolarHBondContact O-CG2 3.21Å; V352-V356 PolarHBondContact O-N 3.24Å; A353-V356 PolarHBondContact O-N 2.98Å; T354-V356 VanDerWaalsContact C-N 3.34Å; T354-V356 PolarHBondContact O-N 3.22Å; V356-T358 VanDerWaalsContact C-N 3.34Å; V356-T358 PolarHBondContact O-N 3.42Å; V356-S359 PolarHBondContact O-N 3.07Å; V356-S359 PolarHBondContact O-OG 3.31Å; V356-Q360 WeakPolarHBondContact O-CG 3.43Å; V356-Q360 PolarHBondContact O-N 3.47Å; V356-Q360 VanDerWaalsContact O-N 3.08Å; V356-D394 HydrophobicContact CG1-CB 4.44Å; V356-D394 HydrophobicContact CG2-CB 4.3Å; V356-V395 HydrophobicContact CG2-CG2 3.8Å
357R93.4Very high94.8Very high41 Ų4134.5 Ų34.516%0.15518%0.178CC..Hα-helixtrans-61-41.7178.6-72.6-59.5-170.1-170-2112.5F234 S274 A353 T354 S359 Q360 L361F234-R357 HydrophobicContact CD1-CG 4.11Å; F234-R357 HydrophobicContact CE1-CB 3.85Å; F234-R357 HydrophobicContact CE1-CG 3.27Å; F234-R357 HydrophobicContact CZ-CB 3.92Å; F234-R357 HydrophobicContact CZ-CG 3.8Å; S274-R357 PolarHBondContact O-NH1 3.24Å; A353-R357 WeakPolarHBondContact O-CG 2.85Å; A353-R357 PolarHBondContact O-N 2.85Å; T354-R357 PolarHBondContact O-N 2.93Å; R357-S359 PolarHBondContact O-N 2.94Å; R357-Q360 WeakPolarHBondContact O-CB 3.37Å; R357-Q360 PolarHBondContact O-N 3.17Å; R357-L361 PolarHBondContact O-N 3.17Å
358T95.3Very high94.9Very high11 Ų1134.9 Ų34.97%0.06718%0.18CC..Hα-helixtrans-64.4-40.2178.1-62.20000111.8I343 D346 V347 T354 R355 V356 Q360 L361 L362I343-T358 HydrophobicContact CB-CG2 4.16Å; I343-T358 HydrophobicContact CG2-CG2 3.53Å; D346-T358 HydrophobicContact CB-CG2 3.85Å; D346-T358 WeakPolarHBondContact CB-OG1 3.38Å; V347-T358 HydrophobicContact CB-CG2 4.02Å; T354-T358 WeakPolarHBondContact O-CB 3.29Å; T354-T358 PolarHBondContact O-N 3.34Å; T354-T358 PolarHBondContact O-OG1 3.08Å; R355-T358 PolarHBondContact O-N 3.44Å; V356-T358 VanDerWaalsContact C-N 3.34Å; V356-T358 PolarHBondContact O-N 3.42Å; T358-Q360 VanDerWaalsContact C-N 3.35Å; T358-Q360 PolarHBondContact O-N 3.06Å; T358-L361 PolarHBondContact O-N 3.08Å; T358-L362 PolarHBondContact O-N 2.86Å
359S96.6Very high95.1Very high0 Ų032.9 Ų32.90%017%0.168CC..Hα-helixtrans-65.2-35.3175.571.80000112.9R355 V356 R357 N398R355-S359 WeakPolarHBondContact O-CB 3.49Å; R355-S359 PolarHBondContact O-N 3.29Å; R355-S359 PolarHBondContact O-OG 3.12Å; V356-S359 PolarHBondContact O-N 3.07Å; V356-S359 PolarHBondContact O-OG 3.31Å; R357-S359 PolarHBondContact O-N 2.94Å; S359-N398 VanDerWaalsContact OG-CB 3.28Å; S359-N398 WeakPolarHBondContact OG-CB 3.48Å; S359-N398 PolarHBondContact OG-ND2 2.98Å
360Q95.7Very high95Very high45 Ų4531.8 Ų31.821%0.2116%0.161CC..Hα-helixtrans-66.1-46.8172.4-67.5172.6-18.100111.1V356 R357 T358 L362 S363 V364 N398V356-Q360 WeakPolarHBondContact O-CG 3.43Å; V356-Q360 PolarHBondContact O-N 3.47Å; V356-Q360 VanDerWaalsContact O-N 3.08Å; R357-Q360 WeakPolarHBondContact O-CB 3.37Å; R357-Q360 PolarHBondContact O-N 3.17Å; T358-Q360 VanDerWaalsContact C-N 3.35Å; T358-Q360 PolarHBondContact O-N 3.06Å; Q360-L362 VanDerWaalsContact C-N 3.26Å; Q360-L362 PolarHBondContact O-N 3.41Å; Q360-S363 PolarHBondContact O-N 3.13Å; Q360-V364 PolarHBondContact O-N 3.3Å; Q360-N398 WeakPolarHBondContact CG-ND2 3.48Å
361L96.1Very high94.9Very high12 Ų1226 Ų266%0.06315%0.146CC..Hα-helixtrans-58-39.4177.4176.262.7000111.6P267 L270 R357 T358 S363 V364 L365P267-L361 HydrophobicContact CB-CD2 3.87Å; L270-L361 HydrophobicContact CB-CD1 3.55Å; R357-L361 PolarHBondContact O-N 3.17Å; T358-L361 PolarHBondContact O-N 3.08Å; L361-S363 VanDerWaalsContact C-N 3.32Å; L361-S363 PolarHBondContact O-N 2.94Å; L361-V364 WeakPolarHBondContact O-CB 3.46Å; L361-V364 PolarHBondContact O-N 3.13Å; L361-V364 VanDerWaalsContact O-N 3.15Å; L361-L365 HydrophobicContact CD1-CD1 4.13Å; L361-L365 HydrophobicContact CD1-CD2 4.41Å; L361-L365 HydrophobicContact CD1-CG 3.99Å; L361-L365 HydrophobicContact CD2-CD1 4.35Å; L361-L365 HydrophobicContact CG-CD1 3.82Å; L361-L365 HydrophobicContact CG-CG 4.15Å; L361-L365 WeakPolarHBondContact O-CG 3.32Å; L361-L365 PolarHBondContact O-N 3.42Å
362L96.3Very high94.8Very high1 Ų125 Ų251%0.00514%0.139CC..Hα-helixtrans-56.3-45.3177177.861.6000112I343 T358 Q360 V364 L365 L366 M380 L383 L384 A402I343-L362 HydrophobicContact CG2-CB 4.27Å; I343-L362 HydrophobicContact CG2-CD1 4.37Å; T358-L362 PolarHBondContact O-N 2.86Å; Q360-L362 VanDerWaalsContact C-N 3.26Å; Q360-L362 PolarHBondContact O-N 3.41Å; L362-V364 VanDerWaalsContact C-N 3.34Å; L362-V364 PolarHBondContact O-N 2.92Å; L362-L365 PolarHBondContact O-N 3.05Å; L362-L366 HydrophobicContact CD1-CD1 4.3Å; L362-L366 HydrophobicContact CD1-CG 4.13Å; L362-L366 HydrophobicContact CG-CD1 4.43Å; L362-L366 WeakPolarHBondContact O-CG 3.37Å; L362-L366 PolarHBondContact O-N 2.91Å; L362-M380 HydrophobicContact CD1-CE 4.25Å; L362-M380 HydrophobicContact CD1-SD 3.71Å; L362-L383 HydrophobicContact CD2-CD2 3.83Å; L362-L384 HydrophobicContact CD2-CD2 4Å; L362-A402 HydrophobicContact CD2-CB 3.91Å; L362-A402 HydrophobicContact CG-CB 3.83Å
363S94.4Very high94.8Very high25 Ų2522.2 Ų22.218%0.17512%0.122CC..Hα-helixtrans-61.8-42.3177.1-67.80000111.9Q360 L361 L366 L367 N398 A402 L405Q360-S363 PolarHBondContact O-N 3.13Å; L361-S363 VanDerWaalsContact C-N 3.32Å; L361-S363 PolarHBondContact O-N 2.94Å; S363-L366 PolarHBondContact O-N 3.22Å; S363-L367 WeakPolarHBondContact O-CB 3.38Å; S363-L367 PolarHBondContact O-N 3.46Å; S363-L367 VanDerWaalsContact O-N 3.09Å; S363-N398 PolarHBondContact OG-O 3.14Å; S363-N398 VanDerWaalsContact OG-O 3.13Å; S363-A402 PolarHBondContact OG-N 3.4Å; S363-L405 WeakPolarHBondContact O-CD1 3.37Å
364V95.3Very high94.8Very high19 Ų1921.9 Ų21.912%0.11511%0.114CC..Hα-helixtrans-60.8-47.4175.8179.20000110.2L270 I273 Q360 L361 L362 L366 L367 H368L270-V364 HydrophobicContact CB-CG1 4.29Å; L270-V364 HydrophobicContact CD1-CG1 4.26Å; L270-V364 HydrophobicContact CD2-CG1 4.17Å; L270-V364 HydrophobicContact CG-CG1 4.48Å; I273-V364 HydrophobicContact CD1-CG1 4.41Å; Q360-V364 PolarHBondContact O-N 3.3Å; L361-V364 WeakPolarHBondContact O-CB 3.46Å; L361-V364 PolarHBondContact O-N 3.13Å; L361-V364 VanDerWaalsContact O-N 3.15Å; L362-V364 VanDerWaalsContact C-N 3.34Å; L362-V364 PolarHBondContact O-N 2.92Å; V364-L366 PolarHBondContact O-N 3.26Å; V364-L367 WeakPolarHBondContact O-CB 3.48Å; V364-L367 PolarHBondContact O-N 3.12Å; V364-H368 PolarHBondContact O-N 3.28Å; V364-H368 PolarHBondContact O-ND1 3.4Å
365L96.1Very high94.8Very high1 Ų128.1 Ų28.11%0.00514%0.142CC..Hα-helixtrans-64.3-41.3-178.4-68.6172.4000112.7L270 V332 L339 I343 L361 L362 L367 H368 A369L270-L365 HydrophobicContact CD1-CD2 3.66Å; V332-L365 HydrophobicContact CG1-CB 4.43Å; V332-L365 HydrophobicContact CG1-CD2 3.79Å; V332-L365 HydrophobicContact CG2-CD2 4.04Å; L339-L365 HydrophobicContact CD1-CD1 4.35Å; L339-L365 HydrophobicContact CD1-CD2 3.93Å; I343-L365 HydrophobicContact CD1-CD1 3.29Å; I343-L365 HydrophobicContact CG1-CD1 4.34Å; L361-L365 HydrophobicContact CD1-CD1 4.13Å; L361-L365 HydrophobicContact CD1-CD2 4.41Å; L361-L365 HydrophobicContact CD1-CG 3.99Å; L361-L365 HydrophobicContact CD2-CD1 4.35Å; L361-L365 HydrophobicContact CG-CD1 3.82Å; L361-L365 HydrophobicContact CG-CG 4.15Å; L361-L365 WeakPolarHBondContact O-CG 3.32Å; L361-L365 PolarHBondContact O-N 3.42Å; L362-L365 PolarHBondContact O-N 3.05Å; L365-L367 VanDerWaalsContact C-N 3.33Å; L365-L367 PolarHBondContact O-N 2.95Å; L365-H368 PolarHBondContact O-N 3.29Å; L365-A369 WeakPolarHBondContact O-CB 3.49Å; L365-A369 PolarHBondContact O-N 2.84Å
366L95.4Very high94.7Very high1 Ų128.5 Ų28.51%0.00515%0.145CC..Hα-helixtrans-67-34.3177.4-67.1-173.5000112.6L362 S363 V364 H368 A369 E370 T373 M380 A402 L405 I406L362-L366 HydrophobicContact CD1-CD1 4.3Å; L362-L366 HydrophobicContact CD1-CG 4.13Å; L362-L366 HydrophobicContact CG-CD1 4.43Å; L362-L366 WeakPolarHBondContact O-CG 3.37Å; L362-L366 PolarHBondContact O-N 2.91Å; S363-L366 PolarHBondContact O-N 3.22Å; V364-L366 PolarHBondContact O-N 3.26Å; L366-H368 PolarHBondContact O-N 2.97Å; L366-A369 PolarHBondContact O-N 3.42Å; L366-E370 PolarHBondContact O-N 3.34Å; L366-T373 HydrophobicContact CD2-CG2 3.63Å; L366-M380 HydrophobicContact CD2-SD 4.16Å; L366-A402 HydrophobicContact CD1-CB 3.79Å; L366-A402 VanDerWaalsContact CD1-O 3.29Å; L366-A402 WeakPolarHBondContact CD1-O 3.21Å; L366-L405 HydrophobicContact CB-CB 4.12Å; L366-L405 HydrophobicContact CB-CD1 4.03Å; L366-I406 HydrophobicContact CD1-CD1 4.36Å; L366-I406 HydrophobicContact CD1-CG1 3.89Å
367L94.6Very high94.7Very high28 Ų2827.5 Ų27.515%0.14714%0.139CC..Hα-helixtrans-62.5-33.4173.3-17170.9000112.2Y317 P318 V321 S363 V364 L365 L405 F409Y317-L367 HydrophobicContact CE1-CD1 4.28Å; Y317-L367 HydrophobicContact CE2-CD1 4.41Å; Y317-L367 WeakPolarHBondContact OH-CD1 3.34Å; Y317-L367 WeakPolarHBondContact OH-CG 3.39Å; P318-L367 HydrophobicContact CG-CD1 4.48Å; V321-L367 HydrophobicContact CG1-CD1 4.02Å; V321-L367 HydrophobicContact CG1-CD2 3.61Å; V321-L367 HydrophobicContact CG1-CG 4.44Å; S363-L367 WeakPolarHBondContact O-CB 3.38Å; S363-L367 PolarHBondContact O-N 3.46Å; S363-L367 VanDerWaalsContact O-N 3.09Å; V364-L367 WeakPolarHBondContact O-CB 3.48Å; V364-L367 PolarHBondContact O-N 3.12Å; L365-L367 VanDerWaalsContact C-N 3.33Å; L365-L367 PolarHBondContact O-N 2.95Å; L367-L405 HydrophobicContact CB-CD1 4.12Å; L367-L405 HydrophobicContact CD1-CD2 4.07Å; L367-F409 HydrophobicContact CD1-CE2 4.34Å; L367-F409 HydrophobicContact CD1-CZ 4.22Å
368H95.2Very high94.8Very high9 Ų932.1 Ų32.14%0.04216%0.162CC..Hα-helixtrans-82.4-35.7176.9-70.971.9000112.8W288 P324 R329 V332 V364 L365 L366 E370W288-H368 AromaticContact CD1-NE2 3.76Å; W288-H368 AromaticContact CE2-NE2 3.84Å; W288-H368 AromaticContact NE1-CD2 3.53Å; W288-H368 AromaticContact NE1-CE1 3.93Å; W288-H368 AromaticContact NE1-NE2 2.88Å; W288-H368 PolarHBondContact NE1-NE2 3.32Å; P324-H368 VanDerWaalsContact CB-CD2 3.49Å; P324-H368 WeakPolarHBondContact CB-CD2 3.27Å; P324-H368 WeakPolarHBondContact CB-NE2 3.42Å; P324-H368 WeakPolarHBondContact CG-NE2 3.42Å; R329-H368 WeakPolarHBondContact CB-O 3.43Å; R329-H368 WeakPolarHBondContact CG-O 3.4Å; V332-H368 HydrophobicContact CB-CB 3.73Å; V332-H368 HydrophobicContact CG1-CB 3.88Å; V332-H368 HydrophobicContact CG2-CB 3.66Å; V364-H368 PolarHBondContact O-N 3.28Å; V364-H368 PolarHBondContact O-ND1 3.4Å; L365-H368 PolarHBondContact O-N 3.29Å; L366-H368 PolarHBondContact O-N 2.97Å; H368-E370 VanDerWaalsContact C-N 3.35Å
369A94.7Very high94.8Very high0 Ų034.7 Ų34.70%018%0.179CC..Hα-helixtrans-72.1-29.5-178.500000112.7L336 L365 L366 D371 H372L336-A369 HydrophobicContact CD2-CB 3.66Å; L365-A369 WeakPolarHBondContact O-CB 3.49Å; L365-A369 PolarHBondContact O-N 2.84Å; L366-A369 PolarHBondContact O-N 3.42Å; A369-D371 PolarHBondContact O-N 3.13Å; A369-H372 VanDerWaalsContact O-CB 3.27Å; A369-H372 WeakPolarHBondContact O-CB 3.26Å; A369-H372 PolarHBondContact O-N 2.96Å; A369-H372 PolarHBondContact O-ND1 2.94Å
370E93.7Very high94.7Very high8 Ų834.8 Ų34.84%0.03718%0.18CC..G310 helixtrans49.3-128.6-178.3-57.8-176.5150.700110.9R323 R329 L366 H368 H372 T373 F409R323-E370 IonicContact CZ-OE1 3.76Å; R323-E370 IonicContact CZ-OE2 3.31Å; R323-E370 IonicContact NE-OE1 3.14Å; R323-E370 PolarHBondContact NE-OE1 3.37Å; R323-E370 IonicContact NE-OE2 2.95Å; R323-E370 IonicContact NH2-OE1 3.82Å; R323-E370 PolarHBondContact NH2-OE1 3.47Å; R323-E370 IonicContact NH2-OE2 2.65Å; R323-E370 PolarHBondContact NH2-OE2 3.13Å; R329-E370 IonicContact CZ-OE2 3.26Å; R329-E370 IonicContact NH1-OE2 3.12Å; R329-E370 PolarHBondContact NH1-OE2 2.91Å; L366-E370 PolarHBondContact O-N 3.34Å; H368-E370 VanDerWaalsContact C-N 3.35Å; E370-H372 PolarHBondContact O-N 3.31Å; E370-T373 VanDerWaalsContact O-CB 3.28Å; E370-T373 WeakPolarHBondContact O-CB 3.31Å; E370-T373 PolarHBondContact O-N 3.48Å; E370-T373 PolarHBondContact O-OG1 3.26Å; E370-F409 HydrophobicContact CB-CD1 4.13Å; E370-F409 HydrophobicContact CB-CE1 4.44Å; E370-F409 HydrophobicContact CB-CG 4.21Å; E370-F409 HydrophobicContact CG-CD1 4.41Å; E370-F409 HydrophobicContact CG-CE1 4.22Å; E370-F409 HydrophobicContact CG-CZ 4.33Å; E370-F409 WeakPolarHBondContact O-CB 3.28Å
371D91.9Very high94.7Very high85 Ų8532.8 Ų32.846%0.45517%0.17SC..G310 helixtrans-65.5-21.3-17865.5-35.7000113.6A369 T373 T374A369-D371 PolarHBondContact O-N 3.13Å; D371-T373 PolarHBondContact O-N 3.17Å; D371-T373 VanDerWaalsContact O-N 3.16Å; D371-T374 WeakPolarHBondContact O-CB 3.27Å; D371-T374 PolarHBondContact O-N 2.97Å; D371-T374 PolarHBondContact O-OG1 3.33Å
372H93.3Very high94.6Very high53 Ų5335.1 Ų35.125%0.24519%0.191CC..G310 helixtrans-67.4-15.6177.7-62.167.8000112.5V333 A369 E370 T374 Q375V333-H372 HydrophobicContact CG1-CB 4.03Å; V333-H372 WeakPolarHBondContact CG1-CD2 3.43Å; V333-H372 HydrophobicContact CG2-CB 3.88Å; A369-H372 VanDerWaalsContact O-CB 3.27Å; A369-H372 WeakPolarHBondContact O-CB 3.26Å; A369-H372 PolarHBondContact O-N 2.96Å; A369-H372 PolarHBondContact O-ND1 2.94Å; E370-H372 PolarHBondContact O-N 3.31Å; H372-T374 PolarHBondContact O-N 3.05Å; H372-T374 VanDerWaalsContact O-N 3.09Å; H372-Q375 PolarHBondContact O-N 3.4Å
373T94Very high94.5Very high1 Ų135.7 Ų35.71%0.00619%0.194CC..G310 helixtrans-52.2-29.1168-54.70000112.1L366 E370 D371 Q375 H376 L377 I406 V410L366-T373 HydrophobicContact CD2-CG2 3.63Å; E370-T373 VanDerWaalsContact O-CB 3.28Å; E370-T373 WeakPolarHBondContact O-CB 3.31Å; E370-T373 PolarHBondContact O-N 3.48Å; E370-T373 PolarHBondContact O-OG1 3.26Å; D371-T373 PolarHBondContact O-N 3.17Å; D371-T373 VanDerWaalsContact O-N 3.16Å; T373-Q375 PolarHBondContact O-N 3.27Å; T373-Q375 VanDerWaalsContact O-N 3.15Å; T373-H376 CarbonylContact O-C 3.57Å; T373-H376 PolarHBondContact O-N 3.49Å; T373-L377 PolarHBondContact O-N 2.85Å; T373-L377 VanDerWaalsContact O-N 3.14Å; T373-I406 HydrophobicContact CG2-CG1 4.21Å; T373-V410 HydrophobicContact CG2-CG2 4.03Å
374T94.6Very high94.6Very high48 Ų4834.5 Ų34.529%0.29419%0.186SC..G310 helixtrans-50.3-39.9178.6-60.90000112.9D371 H372 H376 V414D371-T374 WeakPolarHBondContact O-CB 3.27Å; D371-T374 PolarHBondContact O-N 2.97Å; D371-T374 PolarHBondContact O-OG1 3.33Å; H372-T374 PolarHBondContact O-N 3.05Å; H372-T374 VanDerWaalsContact O-N 3.09Å; T374-H376 VanDerWaalsContact C-N 3.27Å; T374-H376 PolarHBondContact O-N 3.21Å; T374-V414 HydrophobicContact CG2-CG1 4.12Å; T374-V414 HydrophobicContact CG2-CG2 4.4Å
375Q93.4Very high94.7Very high156 Ų15634.3 Ų34.373%0.72918%0.183SC*.G310 helixtrans-72.2-20.8-178-61.9-178.2-0.100113.3H372 T373H372-Q375 PolarHBondContact O-N 3.4Å; T373-Q375 PolarHBondContact O-N 3.27Å; T373-Q375 VanDerWaalsContact O-N 3.15Å
376H94.1Very high94.6Very high31 Ų3141.5 Ų41.514%0.14421%0.21CC..G310 helixtrans-112.712.7-177.3-60.3-68.1000112.7L336 S337 V340 T373 T374 Q378 P379 M380L336-H376 VanDerWaalsContact CD2-CD2 3.48Å; L336-H376 WeakPolarHBondContact CD2-CD2 3.4Å; S337-H376 VanDerWaalsContact CA-CE1 3.47Å; S337-H376 WeakPolarHBondContact CA-CE1 3.38Å; V340-H376 HydrophobicContact CG2-CB 4.23Å; T373-H376 CarbonylContact O-C 3.57Å; T373-H376 PolarHBondContact O-N 3.49Å; T374-H376 VanDerWaalsContact C-N 3.27Å; T374-H376 PolarHBondContact O-N 3.21Å; H376-Q378 PolarHBondContact O-N 3.36Å; H376-P379 WeakPolarHBondContact O-CD 3.34Å; H376-P379 VanDerWaalsContact O-CG 3.24Å; H376-P379 WeakPolarHBondContact O-CG 3.33Å; H376-M380 HydrophobicContact CB-CG 4.29Å; H376-M380 WeakPolarHBondContact O-CB 3.39Å; H376-M380 WeakPolarHBondContact O-CG 3.47Å; H376-M380 PolarHBondContact O-N 3.3Å
377L95.3Very high94.5Very high3 Ų341.5 Ų41.52%0.01621%0.21CC..Hα-helixtrans-61.6-44.1-169.8-175.460.3000113.1T373 M380 L381 I406 V410 V414 F415 L418T373-L377 PolarHBondContact O-N 2.85Å; T373-L377 VanDerWaalsContact O-N 3.14Å; L377-M380 WeakPolarHBondContact O-CB 3.12Å; L377-M380 PolarHBondContact O-N 3.29Å; L377-L381 HydrophobicContact CD1-CD1 4.21Å; L377-L381 HydrophobicContact CD1-CD2 4.34Å; L377-L381 HydrophobicContact CD1-CG 4.02Å; L377-L381 HydrophobicContact CG-CD1 3.99Å; L377-L381 HydrophobicContact CG-CG 4.24Å; L377-L381 VanDerWaalsContact O-CG 3.3Å; L377-L381 WeakPolarHBondContact O-CG 3.48Å; L377-L381 PolarHBondContact O-N 3.23Å; L377-I406 HydrophobicContact CD1-CD1 4.25Å; L377-I406 HydrophobicContact CD1-CG2 3.59Å; L377-V410 HydrophobicContact CD2-CG1 4Å; L377-V414 HydrophobicContact CD2-CB 4.46Å; L377-V414 HydrophobicContact CD2-CG1 3.73Å; L377-F415 HydrophobicContact CD2-CB 3.9Å; L377-L418 HydrophobicContact CB-CD1 4.28Å; L377-L418 HydrophobicContact CD2-CD1 3.8Å; L377-L418 HydrophobicContact CG-CD1 3.9Å
378Q94.9Very high94.5Very high137 Ų13740.5 Ų40.564%0.6421%0.205SC*.Hα-helixtrans-60.6-52.4-179.2-173.7173.50.900113.4H376 M380 L381 A382 L418H376-Q378 PolarHBondContact O-N 3.36Å; Q378-M380 VanDerWaalsContact C-N 3.29Å; Q378-M380 PolarHBondContact O-N 3.41Å; Q378-L381 PolarHBondContact O-N 3.1Å; Q378-A382 PolarHBondContact O-N 3.29Å; Q378-A382 VanDerWaalsContact O-N 3.11Å; Q378-L418 HydrophobicContact CB-CD1 4.31Å
379P94.6Very high94.5Very high65 Ų6542.6 Ų42.642%0.42222%0.219SC..Hα-helixtrans-65.6-30.3174.623.6-32.2000113V340 H376 L383V340-P379 HydrophobicContact CG1-CB 3.93Å; V340-P379 HydrophobicContact CG1-CG 4.13Å; H376-P379 WeakPolarHBondContact O-CD 3.34Å; H376-P379 VanDerWaalsContact O-CG 3.24Å; H376-P379 WeakPolarHBondContact O-CG 3.33Å; P379-L383 WeakPolarHBondContact O-CB 3.44Å; P379-L383 PolarHBondContact O-N 3.1Å
380M94.9Very high94.6Very high3 Ų344.1 Ų44.12%0.01523%0.227CC..Hα-helixtrans-64.8-44.1173.3-71.6-75.487.600112.7V340 L362 L366 H376 L377 Q378 L383 L384V340-M380 HydrophobicContact CB-CE 3.76Å; V340-M380 HydrophobicContact CG1-CE 3.38Å; V340-M380 HydrophobicContact CG2-CE 3.38Å; V340-M380 HydrophobicContact CG2-CG 4.47Å; V340-M380 HydrophobicContact CG2-SD 4Å; L362-M380 HydrophobicContact CD1-CE 4.25Å; L362-M380 HydrophobicContact CD1-SD 3.71Å; L366-M380 HydrophobicContact CD2-SD 4.16Å; H376-M380 HydrophobicContact CB-CG 4.29Å; H376-M380 WeakPolarHBondContact O-CB 3.39Å; H376-M380 WeakPolarHBondContact O-CG 3.47Å; H376-M380 PolarHBondContact O-N 3.3Å; L377-M380 WeakPolarHBondContact O-CB 3.12Å; L377-M380 PolarHBondContact O-N 3.29Å; Q378-M380 VanDerWaalsContact C-N 3.29Å; Q378-M380 PolarHBondContact O-N 3.41Å; M380-L383 HydrophobicContact CE-CD1 3.85Å; M380-L383 WeakPolarHBondContact O-CB 3.41Å; M380-L383 PolarHBondContact O-N 3.1Å; M380-L384 VanDerWaalsContact O-CG 3.29Å; M380-L384 WeakPolarHBondContact O-CG 3.42Å; M380-L384 PolarHBondContact O-N 3.17Å
381L95.8Very high94.7Very high2 Ų249.5 Ų49.51%0.0126%0.261CS..Hα-helixtrans-64.1-43.3176.8-69.7175.2000111.4L377 Q378 L383 L384 Y385 L418 I419 V438L377-L381 HydrophobicContact CD1-CD1 4.21Å; L377-L381 HydrophobicContact CD1-CD2 4.34Å; L377-L381 HydrophobicContact CD1-CG 4.02Å; L377-L381 HydrophobicContact CG-CD1 3.99Å; L377-L381 HydrophobicContact CG-CG 4.24Å; L377-L381 VanDerWaalsContact O-CG 3.3Å; L377-L381 WeakPolarHBondContact O-CG 3.48Å; L377-L381 PolarHBondContact O-N 3.23Å; Q378-L381 PolarHBondContact O-N 3.1Å; L381-L383 VanDerWaalsContact C-N 3.29Å; L381-L383 PolarHBondContact O-N 3.16Å; L381-L384 PolarHBondContact O-N 3.36Å; L381-Y385 HydrophobicContact CB-CE2 4.08Å; L381-Y385 VanDerWaalsContact O-CD2 3.26Å; L381-Y385 WeakPolarHBondContact O-CD2 3.4Å; L381-Y385 PolarHBondContact O-N 3.1Å; L381-L418 HydrophobicContact CD1-CB 3.77Å; L381-L418 HydrophobicContact CD1-CD1 4.14Å; L381-I419 HydrophobicContact CD1-CD1 4.42Å; L381-I419 HydrophobicContact CD1-CG1 3.66Å; L381-I419 HydrophobicContact CD2-CD1 3.85Å; L381-I419 HydrophobicContact CD2-CG1 3.8Å; L381-I419 HydrophobicContact CG-CG1 4.39Å; L381-V438 HydrophobicContact CD2-CG1 3.91Å
382A94.3Very high94.9Very high61 Ų6148.8 Ų48.850%0.50426%0.255SS..Hα-helixtrans-58.8-41.4175.800000112.2Q378 R386Q378-A382 PolarHBondContact O-N 3.29Å; Q378-A382 VanDerWaalsContact O-N 3.11Å; A382-R386 PolarHBondContact O-N 3.09Å
383L95.1Very high95Very high13 Ų1356 Ų567%0.06828%0.28CS..Hα-helixtrans-61.4-50.7173.2-178163.5000111.3I343 V347 L362 P379 M380 L381 Y385 R386 A387I343-L383 HydrophobicContact CB-CD1 4.15Å; I343-L383 HydrophobicContact CG2-CD1 3.74Å; V347-L383 HydrophobicContact CG1-CD1 4.39Å; V347-L383 HydrophobicContact CG1-CD2 3.91Å; V347-L383 HydrophobicContact CG1-CG 3.86Å; L362-L383 HydrophobicContact CD2-CD2 3.83Å; P379-L383 WeakPolarHBondContact O-CB 3.44Å; P379-L383 PolarHBondContact O-N 3.1Å; M380-L383 HydrophobicContact CE-CD1 3.85Å; M380-L383 WeakPolarHBondContact O-CB 3.41Å; M380-L383 PolarHBondContact O-N 3.1Å; L381-L383 VanDerWaalsContact C-N 3.29Å; L381-L383 PolarHBondContact O-N 3.16Å; L383-Y385 PolarHBondContact O-N 2.91Å; L383-R386 PolarHBondContact O-N 3.42Å; L383-A387 HydrophobicContact CD2-CB 4.49Å; L383-A387 WeakPolarHBondContact O-CB 3.39Å; L383-A387 PolarHBondContact O-N 3.39Å
384L96.6Very high95.1Very high1 Ų160.4 Ų60.41%0.00530%0.303CS..Hα-helixtrans-61.8-42.4-177.8-72.4171.4000112.2L362 M380 L381 R386 A387 C388 C399 A403 I406 V438L362-L384 HydrophobicContact CD2-CD2 4Å; M380-L384 VanDerWaalsContact O-CG 3.29Å; M380-L384 WeakPolarHBondContact O-CG 3.42Å; M380-L384 PolarHBondContact O-N 3.17Å; L381-L384 PolarHBondContact O-N 3.36Å; L384-R386 VanDerWaalsContact C-N 3.28Å; L384-R386 PolarHBondContact O-N 2.9Å; L384-A387 PolarHBondContact O-N 3.16Å; L384-C388 WeakPolarHBondContact O-CB 3.43Å; L384-C388 PolarHBondContact O-N 3.36Å; L384-C388 PolarHBondContact O-SG 2.9Å; L384-C399 HydrophobicContact CD2-CB 3.73Å; L384-C399 WeakPolarHBondContact CD2-O 3.29Å; L384-A403 HydrophobicContact CD1-CB 4.05Å; L384-I406 HydrophobicContact CD1-CD1 3.55Å; L384-V438 HydrophobicContact CB-CG2 3.98Å; L384-V438 HydrophobicContact CD1-CG1 4.3Å
385Y95.8Very high95.3Very high15 Ų1558.1 Ų58.16%0.05929%0.289CS..Hα-helixtrans-59.4-41.2176.9-59.4-29.4000111.6L381 L383 H422 P435 V438L381-Y385 HydrophobicContact CB-CE2 4.08Å; L381-Y385 VanDerWaalsContact O-CD2 3.26Å; L381-Y385 WeakPolarHBondContact O-CD2 3.4Å; L381-Y385 PolarHBondContact O-N 3.1Å; L383-Y385 PolarHBondContact O-N 2.91Å; Y385-H422 HydrophobicContact CE2-CB 4.14Å; Y385-H422 AromaticContact CE2-CG 3.79Å; Y385-H422 AromaticContact CE2-ND1 3.92Å; Y385-P435 HydrophobicContact CE1-CB 4.16Å; Y385-V438 HydrophobicContact CD1-CB 4.08Å; Y385-V438 HydrophobicContact CD1-CG2 3.69Å; Y385-V438 HydrophobicContact CE1-CB 3.78Å; Y385-V438 HydrophobicContact CE1-CG1 3.97Å; Y385-V438 HydrophobicContact CE1-CG2 3.93Å
386R93.9Very high95.5Very high152 Ų15251.4 Ų51.457%0.57426%0.259SS*.Hα-helixtrans-71.2-38.7177.1-169.6171.4178.5-155.3-4.3112.5T348 A382 L383 L384 C388 T389T348-R386 HydrophobicContact CG2-CG 3.79Å; T348-R386 VanDerWaalsContact CG2-CZ 3.42Å; T348-R386 PolarHBondContact OG1-NH1 3.07Å; A382-R386 PolarHBondContact O-N 3.09Å; L383-R386 PolarHBondContact O-N 3.42Å; L384-R386 VanDerWaalsContact C-N 3.28Å; L384-R386 PolarHBondContact O-N 2.9Å; R386-C388 VanDerWaalsContact C-N 3.33Å; R386-T389 PolarHBondContact O-N 2.74Å; R386-T389 PolarHBondContact O-OG1 3.27Å
387A94.7Very high95.6Very high1 Ų154.3 Ų54.31%0.00828%0.276CS..Hα-helixtrans-70.4-29.7177.900000112.5V347 L383 L384 T389 D390 V395 C399V347-A387 HydrophobicContact CG1-CB 4.44Å; V347-A387 HydrophobicContact CG2-CB 3.95Å; L383-A387 HydrophobicContact CD2-CB 4.49Å; L383-A387 WeakPolarHBondContact O-CB 3.39Å; L383-A387 PolarHBondContact O-N 3.39Å; L384-A387 PolarHBondContact O-N 3.16Å; A387-T389 PolarHBondContact O-N 3.09Å; A387-D390 VanDerWaalsContact O-CB 3.25Å; A387-D390 WeakPolarHBondContact O-CB 3.29Å; A387-D390 PolarHBondContact O-N 3.45Å; A387-D390 VanDerWaalsContact O-N 3.1Å; A387-V395 HydrophobicContact CB-CG1 4.46Å; A387-C399 HydrophobicContact CB-CB 4.23Å; A387-C399 WeakPolarHBondContact CB-SG 3.18Å
388C94.6Very high95.7Very high6 Ų655.9 Ų55.94%0.04128%0.284CS..THydrogen-bonded Turntrans-72.1-6.1176.9-67.80000113.8L384 R386 T434 M437L384-C388 WeakPolarHBondContact O-CB 3.43Å; L384-C388 PolarHBondContact O-N 3.36Å; L384-C388 PolarHBondContact O-SG 2.9Å; R386-C388 VanDerWaalsContact C-N 3.33Å; C388-T434 HydrophobicContact CB-CG2 4.23Å; C388-M437 HydrophobicContact CB-SD 3.88Å
389T95.1Very high95.8Very high54 Ų5449.4 Ų49.433%0.33125%0.254SS..THydrogen-bonded Turntrans-93.52.6169.966.60000113.2R386 A387 H431 T434R386-T389 PolarHBondContact O-N 2.74Å; R386-T389 PolarHBondContact O-OG1 3.27Å; A387-T389 PolarHBondContact O-N 3.09Å; T389-H431 HydrophobicContact CG2-CB 3.63Å; T389-H431 VanDerWaalsContact CG2-CG 3.49Å; T389-T434 HydrophobicContact CG2-CG2 3.47Å; T389-T434 VanDerWaalsContact CG2-CG2 3.47Å
390D96.3Very high96Very high32 Ų3247.8 Ų47.817%0.17124%0.241CC..  trans-66.1146.7-177.9-154.2-61.1000111.6R355 A387 E392 V395 V396R355-D390 VanDerWaalsContact CD-OD2 3.23Å; R355-D390 WeakPolarHBondContact CD-OD2 3.19Å; R355-D390 IonicContact CZ-OD1 3.69Å; R355-D390 IonicContact CZ-OD2 2.93Å; R355-D390 IonicContact NE-OD1 2.87Å; R355-D390 IonicContact NE-OD2 3.75Å; R355-D390 PolarHBondContact NE-OD2 2.95Å; R355-D390 IonicContact NH2-OD1 2.62Å; R355-D390 PolarHBondContact NH2-OD1 3.24Å; R355-D390 IonicContact NH2-OD2 3.61Å; A387-D390 VanDerWaalsContact O-CB 3.25Å; A387-D390 WeakPolarHBondContact O-CB 3.29Å; A387-D390 PolarHBondContact O-N 3.45Å; A387-D390 VanDerWaalsContact O-N 3.1Å; D390-E392 VanDerWaalsContact C-N 3.3Å; D390-E392 WeakPolarHBondContact OD1-CB 3.39Å; D390-E392 PolarHBondContact OD1-N 2.96Å; D390-V395 HydrophobicContact CB-CB 4.13Å; D390-V395 HydrophobicContact CB-CG1 4.03Å; D390-V396 HydrophobicContact CB-CG2 4.21Å
391T95Very high96Very high120 Ų12049.8 Ų49.874%0.73626%0.258SS*.SBendtrans-74.5-25.8175.855.20000111.8
392E96.9Very high96.1Very high71 Ų7149.7 Ų49.733%0.33226%0.258SS..  trans-84.5114-179.5-62.4-58.4138.600110.9V352 D390 D394 V395 V396V352-E392 HydrophobicContact CG1-CG 3.79Å; V352-E392 HydrophobicContact CG2-CG 4.08Å; D390-E392 VanDerWaalsContact C-N 3.3Å; D390-E392 WeakPolarHBondContact OD1-CB 3.39Å; D390-E392 PolarHBondContact OD1-N 2.96Å; E392-D394 PolarHBondContact O-N 3.46Å; E392-V395 HydrophobicContact CB-CB 4.5Å; E392-V395 HydrophobicContact CB-CG2 3.94Å; E392-V395 WeakPolarHBondContact O-CB 3.41Å; E392-V395 PolarHBondContact O-N 3.01Å; E392-V395 VanDerWaalsContact O-N 3.13Å; E392-V396 PolarHBondContact O-N 3.12Å
393R96Very high96.3Very high203 Ų20346.8 Ų46.877%0.76623%0.234SC*.Hα-helixtrans-60.1-33.4-176.3-67.3-176.6-179.5176.2-0.5113V395 V396 N397R393-V395 VanDerWaalsContact C-N 3.32Å; R393-V395 PolarHBondContact O-N 3.24Å; R393-V396 PolarHBondContact O-N 3.16Å; R393-N397 WeakPolarHBondContact O-CB 3.15Å; R393-N397 PolarHBondContact O-N 3.36Å; R393-N397 PolarHBondContact O-ND2 3.41Å
394D96.1Very high96.4Very high94 Ų9451.3 Ų51.350%0.50325%0.253SS..Hα-helixtrans-64.1-38.3179.4-68.7-25.4000111.8V356 E392 N397 N398V356-D394 HydrophobicContact CG1-CB 4.44Å; V356-D394 HydrophobicContact CG2-CB 4.3Å; E392-D394 PolarHBondContact O-N 3.46Å; D394-N397 PolarHBondContact O-N 2.91Å; D394-N398 WeakPolarHBondContact O-CB 3.32Å; D394-N398 PolarHBondContact O-N 3.34Å; D394-N398 PolarHBondContact O-ND2 3.18Å
395V97.4Very high96.4Very high0 Ų052.2 Ų52.20%026%0.258CS..Hα-helixtrans-61.7-50.8175.31790000109.8V347 R355 V356 A387 D390 E392 R393 N397 N398 C399V347-V395 HydrophobicContact CG2-CG1 4.18Å; R355-V395 HydrophobicContact CB-CG2 3.83Å; V356-V395 HydrophobicContact CG2-CG2 3.8Å; A387-V395 HydrophobicContact CB-CG1 4.46Å; D390-V395 HydrophobicContact CB-CB 4.13Å; D390-V395 HydrophobicContact CB-CG1 4.03Å; E392-V395 HydrophobicContact CB-CB 4.5Å; E392-V395 HydrophobicContact CB-CG2 3.94Å; E392-V395 WeakPolarHBondContact O-CB 3.41Å; E392-V395 PolarHBondContact O-N 3.01Å; E392-V395 VanDerWaalsContact O-N 3.13Å; R393-V395 VanDerWaalsContact C-N 3.32Å; R393-V395 PolarHBondContact O-N 3.24Å; V395-N397 PolarHBondContact O-N 2.76Å; V395-N398 PolarHBondContact O-N 2.92Å; V395-C399 WeakPolarHBondContact O-CB 3.4Å; V395-C399 PolarHBondContact O-N 2.96Å; V395-C399 PolarHBondContact O-SG 2.69Å
396V97.3Very high96.4Very high16 Ų1651.5 Ų51.510%0.09726%0.255CS..Hα-helixtrans-59.6-49.3178.9-1780000110.6D390 E392 R393 N398 C399 L400 M437D390-V396 HydrophobicContact CB-CG2 4.21Å; E392-V396 PolarHBondContact O-N 3.12Å; R393-V396 PolarHBondContact O-N 3.16Å; V396-N398 PolarHBondContact O-N 3.48Å; V396-C399 PolarHBondContact O-N 3.36Å; V396-L400 HydrophobicContact CG1-CD1 4Å; V396-L400 HydrophobicContact CG1-CG 4.27Å; V396-L400 VanDerWaalsContact O-CG 3.31Å; V396-L400 WeakPolarHBondContact O-CG 3.13Å; V396-L400 PolarHBondContact O-N 2.99Å; V396-M437 HydrophobicContact CG1-CE 4.06Å; V396-M437 HydrophobicContact CG1-SD 4.11Å
397N97.4Very high96.5Very high92 Ų9244.4 Ų44.449%0.49223%0.229SC..Hα-helixtrans-60.1-44.7-179.1-72.1-24.7000112.6R393 D394 V395 L400 A401R393-N397 WeakPolarHBondContact O-CB 3.15Å; R393-N397 PolarHBondContact O-N 3.36Å; R393-N397 PolarHBondContact O-ND2 3.41Å; D394-N397 PolarHBondContact O-N 2.91Å; V395-N397 PolarHBondContact O-N 2.76Å; N397-L400 PolarHBondContact O-N 2.95Å; N397-A401 PolarHBondContact O-N 3.41Å
398N97Very high96.5Very high36 Ų3645.5 Ų45.519%0.19324%0.235CC..Hα-helixtrans-65.4-39.6176.9-68-29.3000111.5S359 Q360 S363 D394 V395 V396 A401 A402S359-N398 VanDerWaalsContact OG-CB 3.28Å; S359-N398 WeakPolarHBondContact OG-CB 3.48Å; S359-N398 PolarHBondContact OG-ND2 2.98Å; Q360-N398 WeakPolarHBondContact CG-ND2 3.48Å; S363-N398 PolarHBondContact OG-O 3.14Å; S363-N398 VanDerWaalsContact OG-O 3.13Å; D394-N398 WeakPolarHBondContact O-CB 3.32Å; D394-N398 PolarHBondContact O-N 3.34Å; D394-N398 PolarHBondContact O-ND2 3.18Å; V395-N398 PolarHBondContact O-N 2.92Å; V396-N398 PolarHBondContact O-N 3.48Å; N398-A401 WeakPolarHBondContact O-CB 3.49Å; N398-A401 PolarHBondContact O-N 3.31Å; N398-A402 PolarHBondContact O-N 3.25Å
399C97.4Very high96.5Very high0 Ų046 Ų460%024%0.237CC..Hα-helixtrans-67.2-36.1175.2-76.60000112.7L384 A387 V395 V396 A402 A403L384-C399 HydrophobicContact CD2-CB 3.73Å; L384-C399 WeakPolarHBondContact CD2-O 3.29Å; A387-C399 HydrophobicContact CB-CB 4.23Å; A387-C399 WeakPolarHBondContact CB-SG 3.18Å; V395-C399 WeakPolarHBondContact O-CB 3.4Å; V395-C399 PolarHBondContact O-N 2.96Å; V395-C399 PolarHBondContact O-SG 2.69Å; V396-C399 PolarHBondContact O-N 3.36Å; C399-A402 WeakPolarHBondContact O-CB 3.37Å; C399-A402 PolarHBondContact O-N 3.08Å; C399-A403 WeakPolarHBondContact O-CB 3.28Å; C399-A403 PolarHBondContact O-N 3.47Å
400L97.9Very high96.5Very high31 Ų3143.6 Ų43.616%0.16222%0.222CC..Hα-helixtrans-70.2-34.2173.1-63.5177.8000112V396 N397 A403 K404 M437 A441V396-L400 HydrophobicContact CG1-CD1 4Å; V396-L400 HydrophobicContact CG1-CG 4.27Å; V396-L400 VanDerWaalsContact O-CG 3.31Å; V396-L400 WeakPolarHBondContact O-CG 3.13Å; V396-L400 PolarHBondContact O-N 2.99Å; N397-L400 PolarHBondContact O-N 2.95Å; L400-A403 PolarHBondContact O-N 2.94Å; L400-K404 WeakPolarHBondContact O-CG 3.18Å; L400-K404 PolarHBondContact O-N 3.37Å; L400-M437 HydrophobicContact CD1-CE 4.19Å; L400-M437 HydrophobicContact CD1-CG 4.24Å; L400-M437 HydrophobicContact CD1-SD 4.39Å; L400-M437 HydrophobicContact CD2-CG 3.78Å; L400-M437 HydrophobicContact CD2-SD 4.37Å; L400-A441 HydrophobicContact CB-CB 4.16Å; L400-A441 HydrophobicContact CD2-CB 3.85Å
401A96.3Very high96.4Very high45 Ų4545 Ų4537%0.37223%0.233SC..Hα-helixtrans-63.3-42.6170.200000111.4N397 N398 K404 L405N397-A401 PolarHBondContact O-N 3.41Å; N398-A401 WeakPolarHBondContact O-CB 3.49Å; N398-A401 PolarHBondContact O-N 3.31Å; A401-K404 WeakPolarHBondContact O-CB 3.19Å; A401-K404 PolarHBondContact O-N 2.89Å; A401-L405 PolarHBondContact O-N 3.36Å
402A96.9Very high96.5Very high0 Ų039.7 Ų39.70%020%0.201CC..Hα-helixtrans-60.8-43.2171.800000112L362 S363 L366 N398 C399 K404 L405 I406L362-A402 HydrophobicContact CD2-CB 3.91Å; L362-A402 HydrophobicContact CG-CB 3.83Å; S363-A402 PolarHBondContact OG-N 3.4Å; L366-A402 HydrophobicContact CD1-CB 3.79Å; L366-A402 VanDerWaalsContact CD1-O 3.29Å; L366-A402 WeakPolarHBondContact CD1-O 3.21Å; N398-A402 PolarHBondContact O-N 3.25Å; C399-A402 WeakPolarHBondContact O-CB 3.37Å; C399-A402 PolarHBondContact O-N 3.08Å; A402-K404 VanDerWaalsContact C-N 3.32Å; A402-K404 PolarHBondContact O-N 3.29Å; A402-L405 WeakPolarHBondContact O-CB 3.24Å; A402-L405 PolarHBondContact O-N 3Å; A402-I406 PolarHBondContact O-N 3.44Å
403A98.1Very high96.5Very high0 Ų039.6 Ų39.60%021%0.206CC..Hα-helixtrans-62.6-35.4176.300000112.6L384 C399 L400 L405 I406 G407 V438 A441 V442L384-A403 HydrophobicContact CD1-CB 4.05Å; C399-A403 WeakPolarHBondContact O-CB 3.28Å; C399-A403 PolarHBondContact O-N 3.47Å; L400-A403 PolarHBondContact O-N 2.94Å; A403-L405 VanDerWaalsContact C-N 3.3Å; A403-L405 PolarHBondContact O-N 3.26Å; A403-I406 VanDerWaalsContact O-CB 3.32Å; A403-I406 WeakPolarHBondContact O-CB 3.4Å; A403-I406 PolarHBondContact O-N 3.12Å; A403-I406 VanDerWaalsContact O-N 3.16Å; A403-G407 PolarHBondContact O-N 3.38Å; A403-G407 VanDerWaalsContact O-N 3.1Å; A403-V438 HydrophobicContact CB-CG1 4.36Å; A403-A441 HydrophobicContact CB-CB 3.7Å; A403-V442 HydrophobicContact CB-CG2 4.13Å; A403-V442 WeakPolarHBondContact O-CA 3.45Å; A403-V442 WeakPolarHBondContact O-CG2 3.5Å
404K96.9Very high96.5Very high108 Ų10832.4 Ų32.447%0.4719%0.185SC..Hα-helixtrans-60.4-38.4170.6-74.2173.3179.3-175.20112.1L400 A401 A402 I406 G407 T408 A441 G445L400-K404 WeakPolarHBondContact O-CG 3.18Å; L400-K404 PolarHBondContact O-N 3.37Å; A401-K404 WeakPolarHBondContact O-CB 3.19Å; A401-K404 PolarHBondContact O-N 2.89Å; A402-K404 VanDerWaalsContact C-N 3.32Å; A402-K404 PolarHBondContact O-N 3.29Å; K404-I406 VanDerWaalsContact C-N 3.31Å; K404-I406 PolarHBondContact O-N 2.95Å; K404-G407 WeakPolarHBondContact O-CA 3.36Å; K404-G407 PolarHBondContact O-N 2.91Å; K404-G407 VanDerWaalsContact O-N 3.12Å; K404-T408 PolarHBondContact O-N 3.42Å; K404-T408 PolarHBondContact O-OG1 3.38Å; K404-A441 WeakPolarHBondContact CA-O 3.35Å; K404-A441 HydrophobicContact CG-CB 4.4Å; K404-A441 WeakPolarHBondContact CG-O 3.45Å; K404-G445 WeakPolarHBondContact O-CA 3.3Å
405L96.7Very high96.5Very high21 Ų2128 Ų2811%0.1116%0.161CC..Hα-helixtrans-65.4-35175.4-62.1174.9000111.9P318 S363 L366 L367 A401 A402 A403 G407 T408 F409P318-L405 HydrophobicContact CG-CD2 3.84Å; S363-L405 WeakPolarHBondContact O-CD1 3.37Å; L366-L405 HydrophobicContact CB-CB 4.12Å; L366-L405 HydrophobicContact CB-CD1 4.03Å; L367-L405 HydrophobicContact CB-CD1 4.12Å; L367-L405 HydrophobicContact CD1-CD2 4.07Å; A401-L405 PolarHBondContact O-N 3.36Å; A402-L405 WeakPolarHBondContact O-CB 3.24Å; A402-L405 PolarHBondContact O-N 3Å; A403-L405 VanDerWaalsContact C-N 3.3Å; A403-L405 PolarHBondContact O-N 3.26Å; L405-G407 VanDerWaalsContact C-N 3.32Å; L405-G407 PolarHBondContact O-N 2.94Å; L405-T408 WeakPolarHBondContact O-CB 3.32Å; L405-T408 PolarHBondContact O-N 3Å; L405-T408 VanDerWaalsContact O-N 3.15Å; L405-F409 HydrophobicContact CB-CD2 4.23Å; L405-F409 HydrophobicContact CB-CE2 4.17Å; L405-F409 HydrophobicContact CD2-CE2 3.99Å; L405-F409 WeakPolarHBondContact O-CD2 3.32Å; L405-F409 PolarHBondContact O-N 3.23Å
406I97.1Very high96.5Very high0 Ų028 Ų280%016%0.161CC..Hα-helixtrans-57.9-48169.9-60.6179.9000109.8L366 T373 L377 L384 A402 A403 K404 T408 F409 V410 V442L366-I406 HydrophobicContact CD1-CD1 4.36Å; L366-I406 HydrophobicContact CD1-CG1 3.89Å; T373-I406 HydrophobicContact CG2-CG1 4.21Å; L377-I406 HydrophobicContact CD1-CD1 4.25Å; L377-I406 HydrophobicContact CD1-CG2 3.59Å; L384-I406 HydrophobicContact CD1-CD1 3.55Å; A402-I406 PolarHBondContact O-N 3.44Å; A403-I406 VanDerWaalsContact O-CB 3.32Å; A403-I406 WeakPolarHBondContact O-CB 3.4Å; A403-I406 PolarHBondContact O-N 3.12Å; A403-I406 VanDerWaalsContact O-N 3.16Å; K404-I406 VanDerWaalsContact C-N 3.31Å; K404-I406 PolarHBondContact O-N 2.95Å; I406-T408 PolarHBondContact O-N 3.19Å; I406-F409 PolarHBondContact O-N 3.32Å; I406-V410 HydrophobicContact CG2-CB 4.05Å; I406-V410 HydrophobicContact CG2-CG2 3.88Å; I406-V410 WeakPolarHBondContact O-CA 3.48Å; I406-V410 WeakPolarHBondContact O-CB 3.49Å; I406-V410 PolarHBondContact O-N 3.13Å; I406-V442 HydrophobicContact CB-CG2 4.3Å; I406-V442 HydrophobicContact CG2-CG1 4.43Å; I406-V442 HydrophobicContact CG2-CG2 4.31Å
407G95.6Very high96.4Very high2 Ų234.6 Ų34.62%0.02119%0.188CC..Hα-helixtrans-59.7-3117600000115A403 K404 L405 V442 G446A403-G407 PolarHBondContact O-N 3.38Å; A403-G407 VanDerWaalsContact O-N 3.1Å; K404-G407 WeakPolarHBondContact O-CA 3.36Å; K404-G407 PolarHBondContact O-N 2.91Å; K404-G407 VanDerWaalsContact O-N 3.12Å; L405-G407 VanDerWaalsContact C-N 3.32Å; L405-G407 PolarHBondContact O-N 2.94Å; G407-V442 WeakPolarHBondContact CA-O 3.44Å; G407-G446 WeakPolarHBondContact O-CA 3.43Å
408T95Very high96.4Very high24 Ų2432 Ų3215%0.14717%0.174CC..Hα-helixtrans-75.1-43.6-179.5-53.20000111.7H316 P318 K404 L405 I406 G445H316-T408 WeakPolarHBondContact O-CG2 3.46Å; P318-T408 HydrophobicContact CG-CG2 4.33Å; K404-T408 PolarHBondContact O-N 3.42Å; K404-T408 PolarHBondContact O-OG1 3.38Å; L405-T408 WeakPolarHBondContact O-CB 3.32Å; L405-T408 PolarHBondContact O-N 3Å; L405-T408 VanDerWaalsContact O-N 3.15Å; I406-T408 PolarHBondContact O-N 3.19Å; T408-G445 WeakPolarHBondContact CA-O 3.43Å; T408-G445 PolarHBondContact N-O 3.27Å; T408-G445 PolarHBondContact OG1-O 3.27Å
409F94.3Very high96.4Very high17 Ų1730.2 Ų30.28%0.07517%0.165CC..Hα-helixtrans-106.8-25.1-168.3-58.9-55.3000114.8Y317 L367 E370 L405 I406Y317-F409 AromaticContact CD2-CE1 3.72Å; Y317-F409 HydrophobicContact CD2-CE1 3.72Å; Y317-F409 AromaticContact CD2-CZ 3.93Å; Y317-F409 HydrophobicContact CD2-CZ 3.93Å; Y317-F409 AromaticContact CE2-CE1 3.79Å; Y317-F409 HydrophobicContact CE2-CE1 3.79Å; Y317-F409 AromaticContact CE2-CZ 3.62Å; Y317-F409 HydrophobicContact CE2-CZ 3.62Å; L367-F409 HydrophobicContact CD1-CE2 4.34Å; L367-F409 HydrophobicContact CD1-CZ 4.22Å; E370-F409 HydrophobicContact CB-CD1 4.13Å; E370-F409 HydrophobicContact CB-CE1 4.44Å; E370-F409 HydrophobicContact CB-CG 4.21Å; E370-F409 HydrophobicContact CG-CD1 4.41Å; E370-F409 HydrophobicContact CG-CE1 4.22Å; E370-F409 HydrophobicContact CG-CZ 4.33Å; E370-F409 WeakPolarHBondContact O-CB 3.28Å; L405-F409 HydrophobicContact CB-CD2 4.23Å; L405-F409 HydrophobicContact CB-CE2 4.17Å; L405-F409 HydrophobicContact CD2-CE2 3.99Å; L405-F409 WeakPolarHBondContact O-CD2 3.32Å; L405-F409 PolarHBondContact O-N 3.23Å; I406-F409 PolarHBondContact O-N 3.32Å
410V95.4Very high96.4Very high3 Ų330.8 Ų30.82%0.01817%0.168CC..SBendtrans-92.9131-179-179.20000109.6T373 L377 I406 V414 F415T373-V410 HydrophobicContact CG2-CG2 4.03Å; L377-V410 HydrophobicContact CD2-CG1 4Å; I406-V410 HydrophobicContact CG2-CB 4.05Å; I406-V410 HydrophobicContact CG2-CG2 3.88Å; I406-V410 WeakPolarHBondContact O-CA 3.48Å; I406-V410 WeakPolarHBondContact O-CB 3.49Å; I406-V410 PolarHBondContact O-N 3.13Å; V410-V414 HydrophobicContact CG1-CB 4.11Å; V410-V414 HydrophobicContact CG1-CG1 4.42Å; V410-F415 HydrophobicContact CB-CD1 4.29Å; V410-F415 HydrophobicContact CG1-CB 4.41Å; V410-F415 HydrophobicContact CG1-CD1 4.22Å; V410-F415 WeakPolarHBondContact O-CD1 3.45Å; V410-F415 WeakPolarHBondContact O-CE1 3.44Å
411P94.2Very high96.3Very high63 Ų6335.1 Ų35.141%0.40919%0.187SC..  trans-59.9136.6178-25.134.2000112.9V414 F415P411-V414 HydrophobicContact CB-CG2 4.33Å; P411-V414 PolarHBondContact O-N 2.85Å; P411-F415 PolarHBondContact O-N 3.43Å
412P96.1Very high96.2Very high7 Ų735.5 Ų35.55%0.04518%0.181CC..Hα-helixtrans-50.6-41.2179.1-28.535.6000116.8V414 F415 L416 L450 L451P412-V414 PolarHBondContact O-N 3.18Å; P412-V414 VanDerWaalsContact O-N 3.09Å; P412-F415 HydrophobicContact CB-CE1 3.97Å; P412-F415 HydrophobicContact CB-CE2 4.36Å; P412-F415 HydrophobicContact CB-CZ 3.72Å; P412-F415 HydrophobicContact CG-CE1 3.9Å; P412-F415 HydrophobicContact CG-CZ 3.88Å; P412-F415 PolarHBondContact O-N 2.96Å; P412-L416 HydrophobicContact CB-CD1 4.11Å; P412-L416 WeakPolarHBondContact O-CB 3.44Å; P412-L416 WeakPolarHBondContact O-CG 3.27Å; P412-L416 PolarHBondContact O-N 2.92Å; P412-L450 HydrophobicContact CG-CB 4.14Å; P412-L451 HydrophobicContact CG-CD2 4.19Å
413P96.6Very high96.1Very high70 Ų7035.8 Ų35.846%0.45518%0.183SC..Hα-helixtrans-55.6-32.3177.7-24.431.5000113.8K417P413-K417 WeakPolarHBondContact O-CB 3.34Å; P413-K417 PolarHBondContact O-N 2.97Å
414V96.2Very high96Very high52 Ų5237.7 Ų37.732%0.31520%0.195SC..Hα-helixtrans-77.6-54-176.8-172.40000110.3T374 L377 V410 P411 P412T374-V414 HydrophobicContact CG2-CG1 4.12Å; T374-V414 HydrophobicContact CG2-CG2 4.4Å; L377-V414 HydrophobicContact CD2-CB 4.46Å; L377-V414 HydrophobicContact CD2-CG1 3.73Å; V410-V414 HydrophobicContact CG1-CB 4.11Å; V410-V414 HydrophobicContact CG1-CG1 4.42Å; P411-V414 HydrophobicContact CB-CG2 4.33Å; P411-V414 PolarHBondContact O-N 2.85Å; P412-V414 PolarHBondContact O-N 3.18Å; P412-V414 VanDerWaalsContact O-N 3.09Å
415F96.3Very high95.7Very high0 Ų037.3 Ų37.30%020%0.201CC..Hα-helixtrans-71.8-34.5-17769-116000112.5L377 V410 P411 P412 K417 L418 I419 V442 L443 L451L377-F415 HydrophobicContact CD2-CB 3.9Å; V410-F415 HydrophobicContact CB-CD1 4.29Å; V410-F415 HydrophobicContact CG1-CB 4.41Å; V410-F415 HydrophobicContact CG1-CD1 4.22Å; V410-F415 WeakPolarHBondContact O-CD1 3.45Å; V410-F415 WeakPolarHBondContact O-CE1 3.44Å; P411-F415 PolarHBondContact O-N 3.43Å; P412-F415 HydrophobicContact CB-CE1 3.97Å; P412-F415 HydrophobicContact CB-CE2 4.36Å; P412-F415 HydrophobicContact CB-CZ 3.72Å; P412-F415 HydrophobicContact CG-CE1 3.9Å; P412-F415 HydrophobicContact CG-CZ 3.88Å; P412-F415 PolarHBondContact O-N 2.96Å; F415-K417 VanDerWaalsContact C-N 3.34Å; F415-K417 PolarHBondContact O-N 2.88Å; F415-L418 PolarHBondContact O-N 2.99Å; F415-I419 HydrophobicContact CB-CD1 4.1Å; F415-I419 HydrophobicContact CD2-CD1 4.15Å; F415-I419 WeakPolarHBondContact O-CB 3.48Å; F415-I419 VanDerWaalsContact O-CG1 3.25Å; F415-I419 WeakPolarHBondContact O-CG1 3.25Å; F415-I419 PolarHBondContact O-N 3.41Å; F415-V442 HydrophobicContact CB-CG1 4.42Å; F415-V442 HydrophobicContact CD1-CG1 3.84Å; F415-V442 HydrophobicContact CD2-CG1 3.51Å; F415-V442 HydrophobicContact CE1-CG1 3.81Å; F415-V442 HydrophobicContact CE2-CG1 3.54Å; F415-V442 HydrophobicContact CG-CG1 3.69Å; F415-V442 HydrophobicContact CZ-CG1 3.69Å; F415-L443 HydrophobicContact CE2-CD2 4.49Å; F415-L451 HydrophobicContact CZ-CD2 4.25Å
416L97.7Very high95.1Very high0 Ų037.1 Ų37.10%020%0.201CC..Hα-helixtrans-65.5-40.2178.2-69.5177.7000111.3P412 L418 L420 L439 H454 V458P412-L416 HydrophobicContact CB-CD1 4.11Å; P412-L416 WeakPolarHBondContact O-CB 3.44Å; P412-L416 WeakPolarHBondContact O-CG 3.27Å; P412-L416 PolarHBondContact O-N 2.92Å; L416-L418 PolarHBondContact O-N 3.17Å; L416-L420 HydrophobicContact CB-CD1 4.03Å; L416-L420 HydrophobicContact CB-CG 4.32Å; L416-L420 HydrophobicContact CD2-CD1 4.27Å; L416-L420 HydrophobicContact CD2-CD2 4.43Å; L416-L420 HydrophobicContact CD2-CG 4.25Å; L416-L420 WeakPolarHBondContact O-CB 3.35Å; L416-L420 WeakPolarHBondContact O-CG 3.28Å; L416-L420 PolarHBondContact O-N 3.45Å; L416-L439 HydrophobicContact CD2-CD1 4.09Å; L416-H454 HydrophobicContact CD1-CB 3.46Å; L416-H454 VanDerWaalsContact CD1-CB 3.46Å; L416-V458 HydrophobicContact CD1-CG2 3.92Å; L416-V458 HydrophobicContact CD2-CG2 3.61Å; L416-V458 HydrophobicContact CG-CG2 4.43Å
417K95.9Very high94.4Very high155 Ų15541.7 Ų41.767%0.67423%0.233SC*.Hα-helixtrans-55.7-41.6176.4-177.4179.5178.4-1770111.9P413 F415P413-K417 WeakPolarHBondContact O-CB 3.34Å; P413-K417 PolarHBondContact O-N 2.97Å; F415-K417 VanDerWaalsContact C-N 3.34Å; F415-K417 PolarHBondContact O-N 2.88Å
418L96.4Very high93.9Very high37 Ų3743.4 Ų43.419%0.19425%0.245CC..Hα-helixtrans-82.3-46.4-178.8-61.4-178.8000112.4L377 Q378 L381 F415 L416 H422L377-L418 HydrophobicContact CB-CD1 4.28Å; L377-L418 HydrophobicContact CD2-CD1 3.8Å; L377-L418 HydrophobicContact CG-CD1 3.9Å; Q378-L418 HydrophobicContact CB-CD1 4.31Å; L381-L418 HydrophobicContact CD1-CB 3.77Å; L381-L418 HydrophobicContact CD1-CD1 4.14Å; F415-L418 PolarHBondContact O-N 2.99Å; L416-L418 PolarHBondContact O-N 3.17Å; L418-H422 PolarHBondContact O-ND1 3.25Å
419I97.6Very high93.4Very high0 Ų049.1 Ų49.10%027%0.27CS..Hα-helixtrans-72.2-42.2-173-61.6170.9000110.8L381 F415 E421 H422 V423 L439 V442L381-I419 HydrophobicContact CD1-CD1 4.42Å; L381-I419 HydrophobicContact CD1-CG1 3.66Å; L381-I419 HydrophobicContact CD2-CD1 3.85Å; L381-I419 HydrophobicContact CD2-CG1 3.8Å; L381-I419 HydrophobicContact CG-CG1 4.39Å; F415-I419 HydrophobicContact CB-CD1 4.1Å; F415-I419 HydrophobicContact CD2-CD1 4.15Å; F415-I419 WeakPolarHBondContact O-CB 3.48Å; F415-I419 VanDerWaalsContact O-CG1 3.25Å; F415-I419 WeakPolarHBondContact O-CG1 3.25Å; F415-I419 PolarHBondContact O-N 3.41Å; I419-E421 VanDerWaalsContact C-N 3.28Å; I419-E421 PolarHBondContact O-N 2.86Å; I419-H422 CarbonylContact O-C 3.53Å; I419-H422 PolarHBondContact O-N 3.47Å; I419-V423 HydrophobicContact CG2-CG2 4.19Å; I419-V423 WeakPolarHBondContact O-CG2 3.45Å; I419-V423 PolarHBondContact O-N 3.17Å; I419-L439 HydrophobicContact CB-CD1 4.49Å; I419-L439 HydrophobicContact CG2-CB 3.72Å; I419-L439 HydrophobicContact CG2-CD1 3.88Å; I419-L439 HydrophobicContact CG2-CG 4.27Å; I419-V442 HydrophobicContact CD1-CB 4.27Å; I419-V442 HydrophobicContact CD1-CG1 4.26Å; I419-V442 HydrophobicContact CD1-CG2 3.94Å
420L97Very high93.2Very high11 Ų1151.5 Ų51.56%0.05829%0.289CS..Hα-helixtrans-63.5-35.2-178-62.9179.7000111.9L416 H422 V423 T424 L439 Q457 T461L416-L420 HydrophobicContact CB-CD1 4.03Å; L416-L420 HydrophobicContact CB-CG 4.32Å; L416-L420 HydrophobicContact CD2-CD1 4.27Å; L416-L420 HydrophobicContact CD2-CD2 4.43Å; L416-L420 HydrophobicContact CD2-CG 4.25Å; L416-L420 WeakPolarHBondContact O-CB 3.35Å; L416-L420 WeakPolarHBondContact O-CG 3.28Å; L416-L420 PolarHBondContact O-N 3.45Å; L420-H422 VanDerWaalsContact C-N 3.32Å; L420-H422 PolarHBondContact O-N 2.85Å; L420-V423 PolarHBondContact O-N 2.91Å; L420-V423 VanDerWaalsContact O-N 3.16Å; L420-T424 WeakPolarHBondContact O-CG2 3.37Å; L420-T424 PolarHBondContact O-N 2.83Å; L420-T424 PolarHBondContact O-OG1 3.27Å; L420-L439 HydrophobicContact CD2-CD1 4.45Å; L420-L439 HydrophobicContact CD2-CD2 3.98Å; L420-Q457 HydrophobicContact CD1-CG 3.91Å; L420-T461 HydrophobicContact CB-CG2 4.32Å; L420-T461 HydrophobicContact CD2-CG2 4.04Å
421E95.2Very high93.1Very high123 Ų12354.5 Ų54.558%0.57530%0.303SS*.Hα-helixtrans-60.6-40173-175.2177.6-179.600112.1I419 T424 T425I419-E421 VanDerWaalsContact C-N 3.28Å; I419-E421 PolarHBondContact O-N 2.86Å; E421-T424 PolarHBondContact O-OG1 2.87Å; E421-T425 PolarHBondContact O-N 3.4Å
422H94.7Very high93.1Very high52 Ų5251.7 Ų51.724%0.24128%0.284CS..Hα-helixtrans-75.4-25.3175.6-64.8102.3000113.1Y385 L418 I419 L420 T425 P426 P435Y385-H422 HydrophobicContact CE2-CB 4.14Å; Y385-H422 AromaticContact CE2-CG 3.79Å; Y385-H422 AromaticContact CE2-ND1 3.92Å; L418-H422 PolarHBondContact O-ND1 3.25Å; I419-H422 CarbonylContact O-C 3.53Å; I419-H422 PolarHBondContact O-N 3.47Å; L420-H422 VanDerWaalsContact C-N 3.32Å; L420-H422 PolarHBondContact O-N 2.85Å; H422-T425 CarbonylContact O-C 3.12Å; H422-P426 VanDerWaalsContact O-CA 3.23Å; H422-P426 WeakPolarHBondContact O-CA 3.31Å; H422-P435 HydrophobicContact CB-CB 3.99Å; H422-P435 HydrophobicContact CB-CG 4.09Å; H422-P435 WeakPolarHBondContact O-CG 3.49Å
423V96.2Very high93.1Very high6 Ų653.2 Ų53.24%0.03629%0.289CS..Hα-helixtrans-71.1-43.1173.5168.10000110.5I419 L420 P435 L436 L439 T461 V467I419-V423 HydrophobicContact CG2-CG2 4.19Å; I419-V423 WeakPolarHBondContact O-CG2 3.45Å; I419-V423 PolarHBondContact O-N 3.17Å; L420-V423 PolarHBondContact O-N 2.91Å; L420-V423 VanDerWaalsContact O-N 3.16Å; V423-P435 HydrophobicContact CG2-CB 3.8Å; V423-L436 HydrophobicContact CG1-CD2 3.69Å; V423-L436 HydrophobicContact CG1-CG 4.34Å; V423-L436 HydrophobicContact CG2-CD2 4.1Å; V423-L436 HydrophobicContact CG2-CG 4.46Å; V423-L439 HydrophobicContact CG2-CD2 4.1Å; V423-T461 HydrophobicContact CG1-CG2 4.26Å; V423-V467 HydrophobicContact CG1-CG1 3.74Å; V423-V467 HydrophobicContact CG1-CG2 4.03Å
424T94.4Very high93.1Very high41 Ų4150.1 Ų50.125%0.25227%0.269SS..Hα-helixtrans-71.3-35.4176.654.80000112.2L420 E421 T461 Q464 V467L420-T424 WeakPolarHBondContact O-CG2 3.37Å; L420-T424 PolarHBondContact O-N 2.83Å; L420-T424 PolarHBondContact O-OG1 3.27Å; E421-T424 PolarHBondContact O-OG1 2.87Å; T424-T461 HydrophobicContact CG2-CG2 3.65Å; T424-Q464 VanDerWaalsContact CG2-OE1 3.25Å; T424-V467 HydrophobicContact CG2-CG2 4.22Å
425T90.3Very high93.2Very high99 Ų9947.7 Ų47.761%0.60726%0.255SS*.SBendtrans-131.378.9-175.3-38.20000109.7E421 H422 S427E421-T425 PolarHBondContact O-N 3.4Å; H422-T425 CarbonylContact O-C 3.12Å; T425-S427 PolarHBondContact O-N 3.26Å
426P84.6Confident93.2Very high17 Ų1747.8 Ų47.811%0.1126%0.255CS..  trans-64.5134.4-176.525.1-32.8000110.9H422 S428 P432 Y471H422-P426 VanDerWaalsContact O-CA 3.23Å; H422-P426 WeakPolarHBondContact O-CA 3.31Å; P426-S428 VanDerWaalsContact C-N 3.25Å; P426-S428 PolarHBondContact O-N 2.97Å; P426-P432 HydrophobicContact CB-CB 4.2Å; P426-P432 HydrophobicContact CG-CB 4.15Å; P426-Y471 HydrophobicContact CG-CE2 4.32Å
427S82.3Confident93.3Very high96 Ų9649.1 Ų49.167%0.67126%0.262SS*.SBendtrans-70-22.1179.656.10000113.4T425T425-S427 PolarHBondContact O-N 3.26Å
428S85.9Confident93.4Very high39 Ų3941.8 Ų41.827%0.27323%0.23SC..  trans-127.7116.9177.1178.80000111.3P426 S430 H431P426-S428 VanDerWaalsContact C-N 3.25Å; P426-S428 PolarHBondContact O-N 2.97Å; S428-S430 PolarHBondContact O-N 3.37Å; S428-S430 PolarHBondContact OG-N 3.43Å; S428-S430 PolarHBondContact OG-OG 2.97Å; S428-H431 CarbonylContact O-C 3.56Å; S428-H431 PolarHBondContact O-N 3.17Å; S428-H431 PolarHBondContact OG-N 3.37Å
429H85Confident93.5Very high143 Ų14340 Ų4066%0.66222%0.22SC*.THydrogen-bonded Turntrans-72.1-16.7173.8-63.7-66.4000113.4P432 Y471H429-P432 WeakPolarHBondContact O-CD 3.45Å; H429-Y471 PolarHBondContact ND1-OH 3.49Å
430S89.4Confident93.5Very high68 Ų6840.3 Ų40.348%0.47622%0.223SC..THydrogen-bonded Turntrans-81.1-24.7174.867.70000112.5S428 P432 W433S428-S430 PolarHBondContact O-N 3.37Å; S428-S430 PolarHBondContact OG-N 3.43Å; S428-S430 PolarHBondContact OG-OG 2.97Å; S430-P432 VanDerWaalsContact C-CD 3.43Å; S430-W433 WeakPolarHBondContact O-CH2 3.39Å; S430-W433 WeakPolarHBondContact O-CZ3 3.33Å
431H93.4Very high93.6Very high65 Ų6540.2 Ų40.230%0.30122%0.223SC..SBendtrans-132.553.4-179.7-54.1-60.7000112.8T389 S428 W433 T434T389-H431 HydrophobicContact CG2-CB 3.63Å; T389-H431 VanDerWaalsContact CG2-CG 3.49Å; S428-H431 CarbonylContact O-C 3.56Å; S428-H431 PolarHBondContact O-N 3.17Å; S428-H431 PolarHBondContact OG-N 3.37Å; H431-W433 HydrophobicContact CB-CH2 4.19Å; H431-W433 HydrophobicContact CB-CZ2 4.1Å; H431-W433 HydrophobicContact CB-CZ3 4.44Å; H431-W433 AromaticContact CE1-CH2 3.98Å; H431-W433 AromaticContact CG-CH2 3.99Å; H431-W433 AromaticContact ND1-CH2 3.05Å; H431-W433 WeakPolarHBondContact ND1-CH2 3.4Å; H431-W433 AromaticContact ND1-CZ2 3.18Å; H431-W433 WeakPolarHBondContact ND1-CZ2 3.43Å; H431-W433 AromaticContact ND1-CZ3 3.96Å; H431-W433 PolarHBondContact O-N 3.26Å; H431-W433 VanDerWaalsContact O-N 3.11Å; H431-T434 HydrophobicContact CB-CG2 3.96Å; H431-T434 PolarHBondContact O-N 3.38Å; H431-T434 PolarHBondContact O-OG1 3.02Å
432P94.6Very high93.7Very high4 Ų434.3 Ų34.33%0.02620%0.196CC..THydrogen-bonded Turntrans-67.4-14.4-173.829.2-36.3000113P426 H429 S430 T434 P435 Y471 Y476P426-P432 HydrophobicContact CB-CB 4.2Å; P426-P432 HydrophobicContact CG-CB 4.15Å; H429-P432 WeakPolarHBondContact O-CD 3.45Å; S430-P432 VanDerWaalsContact C-CD 3.43Å; P432-T434 VanDerWaalsContact C-N 3.34Å; P432-P435 WeakPolarHBondContact O-CD 3.33Å; P432-Y471 HydrophobicContact CB-CD1 4.04Å; P432-Y471 HydrophobicContact CB-CD2 4.15Å; P432-Y471 HydrophobicContact CB-CE1 3.73Å; P432-Y471 HydrophobicContact CB-CE2 3.89Å; P432-Y471 HydrophobicContact CB-CG 4.25Å; P432-Y471 HydrophobicContact CG-CD1 3.58Å; P432-Y471 HydrophobicContact CG-CD2 4.42Å; P432-Y471 HydrophobicContact CG-CE1 3.62Å; P432-Y471 HydrophobicContact CG-CE2 4.48Å; P432-Y471 HydrophobicContact CG-CG 4.01Å; P432-Y476 HydrophobicContact CB-CD2 4Å; P432-Y476 HydrophobicContact CB-CE2 3.95Å; P432-Y476 HydrophobicContact CG-CD2 3.94Å; P432-Y476 HydrophobicContact CG-CE2 4.38Å; P432-Y476 WeakPolarHBondContact O-CE2 3.19Å
433W95.7Very high93.9Very high39 Ų3931.9 Ų31.915%0.14819%0.185CC..THydrogen-bonded Turntrans-78-15.5179.464.385.6000113.9S430 H431 L436 M437 Q473 T475 Y476 Q479S430-W433 WeakPolarHBondContact O-CH2 3.39Å; S430-W433 WeakPolarHBondContact O-CZ3 3.33Å; H431-W433 HydrophobicContact CB-CH2 4.19Å; H431-W433 HydrophobicContact CB-CZ2 4.1Å; H431-W433 HydrophobicContact CB-CZ3 4.44Å; H431-W433 AromaticContact CE1-CH2 3.98Å; H431-W433 AromaticContact CG-CH2 3.99Å; H431-W433 AromaticContact ND1-CH2 3.05Å; H431-W433 WeakPolarHBondContact ND1-CH2 3.4Å; H431-W433 AromaticContact ND1-CZ2 3.18Å; H431-W433 WeakPolarHBondContact ND1-CZ2 3.43Å; H431-W433 AromaticContact ND1-CZ3 3.96Å; H431-W433 PolarHBondContact O-N 3.26Å; H431-W433 VanDerWaalsContact O-N 3.11Å; W433-L436 PolarHBondContact O-N 3.41Å; W433-M437 WeakPolarHBondContact O-CB 3.32Å; W433-M437 PolarHBondContact O-N 2.86Å; W433-Q473 VanDerWaalsContact CE3-OE1 3.27Å; W433-T475 HydrophobicContact CB-CG2 4.48Å; W433-T475 HydrophobicContact CD2-CG2 3.92Å; W433-T475 HydrophobicContact CG-CG2 3.82Å; W433-Y476 HydrophobicContact CB-CD2 4.01Å; W433-Y476 HydrophobicContact CB-CG 4.48Å; W433-Q479 HydrophobicContact CB-CB 4.44Å; W433-Q479 HydrophobicContact CB-CG 3.99Å
434T96.8Very high93.8Very high6 Ų632.6 Ų32.64%0.03719%0.193CC..Hα-helixtrans-63.7-39.5-173.153.50000114.2C388 T389 H431 P432 L436 M437 V438C388-T434 HydrophobicContact CB-CG2 4.23Å; T389-T434 HydrophobicContact CG2-CG2 3.47Å; T389-T434 VanDerWaalsContact CG2-CG2 3.47Å; H431-T434 HydrophobicContact CB-CG2 3.96Å; H431-T434 PolarHBondContact O-N 3.38Å; H431-T434 PolarHBondContact O-OG1 3.02Å; P432-T434 VanDerWaalsContact C-N 3.34Å; T434-L436 PolarHBondContact O-N 3.37Å; T434-M437 PolarHBondContact O-N 3.49Å; T434-V438 WeakPolarHBondContact O-CG2 3.38Å; T434-V438 PolarHBondContact O-N 3.08Å
435P97.2Very high93.8Very high1 Ų131.4 Ų31.41%0.00619%0.189CC..Hα-helixtrans-67.4-35.6175.3-20.436.9000112.2Y385 H422 V423 P432 L439Y385-P435 HydrophobicContact CE1-CB 4.16Å; H422-P435 HydrophobicContact CB-CB 3.99Å; H422-P435 HydrophobicContact CB-CG 4.09Å; H422-P435 WeakPolarHBondContact O-CG 3.49Å; V423-P435 HydrophobicContact CG2-CB 3.8Å; P432-P435 WeakPolarHBondContact O-CD 3.33Å; P435-L439 WeakPolarHBondContact O-CB 3.5Å; P435-L439 PolarHBondContact O-N 3.11Å
436L97.8Very high93.9Very high1 Ų126.8 Ų26.81%0.00516%0.161CC..Hα-helixtrans-66-42.8173.8-72.5173.4000111.6V423 W433 T434 V438 L439 A440 L462 Y476 Q479 L480 C483V423-L436 HydrophobicContact CG1-CD2 3.69Å; V423-L436 HydrophobicContact CG1-CG 4.34Å; V423-L436 HydrophobicContact CG2-CD2 4.1Å; V423-L436 HydrophobicContact CG2-CG 4.46Å; W433-L436 PolarHBondContact O-N 3.41Å; T434-L436 PolarHBondContact O-N 3.37Å; L436-V438 VanDerWaalsContact C-N 3.35Å; L436-V438 PolarHBondContact O-N 3.06Å; L436-L439 WeakPolarHBondContact O-CB 3.26Å; L436-L439 PolarHBondContact O-N 2.83Å; L436-A440 WeakPolarHBondContact O-CB 3.29Å; L436-A440 PolarHBondContact O-N 3.35Å; L436-L462 HydrophobicContact CD2-CD2 3.81Å; L436-Y476 HydrophobicContact CD1-CD1 4.26Å; L436-Y476 HydrophobicContact CD1-CD2 4.18Å; L436-Y476 HydrophobicContact CD1-CE1 3.74Å; L436-Y476 HydrophobicContact CD1-CE2 3.66Å; L436-Y476 HydrophobicContact CD1-CG 4.46Å; L436-Y476 VanDerWaalsContact CD1-CZ 3.41Å; L436-Q479 HydrophobicContact CB-CB 3.77Å; L436-L480 HydrophobicContact CD1-CB 4.21Å; L436-L480 HydrophobicContact CD1-CD1 4.32Å; L436-L480 HydrophobicContact CD2-CD1 4.22Å; L436-C483 PolarHBondContact O-SG 3Å; L436-C483 VanDerWaalsContact O-SG 3.34Å
437M98.1Very high94.2Very high29 Ų2926.8 Ų26.814%0.14316%0.161CC..Hα-helixtrans-58.8-47.1177.5-164.7176.1-135.600111.6C388 V396 L400 W433 T434 A441 Q479C388-M437 HydrophobicContact CB-SD 3.88Å; V396-M437 HydrophobicContact CG1-CE 4.06Å; V396-M437 HydrophobicContact CG1-SD 4.11Å; L400-M437 HydrophobicContact CD1-CE 4.19Å; L400-M437 HydrophobicContact CD1-CG 4.24Å; L400-M437 HydrophobicContact CD1-SD 4.39Å; L400-M437 HydrophobicContact CD2-CG 3.78Å; L400-M437 HydrophobicContact CD2-SD 4.37Å; W433-M437 WeakPolarHBondContact O-CB 3.32Å; W433-M437 PolarHBondContact O-N 2.86Å; T434-M437 PolarHBondContact O-N 3.49Å; M437-A441 PolarHBondContact O-N 3.24Å; M437-Q479 HydrophobicContact CB-CG 3.9Å; M437-Q479 HydrophobicContact CG-CG 4.26Å
438V98.3Very high94.6Very high0 Ų025.1 Ų25.10%014%0.142CC..Hα-helixtrans-69.1-40.1176.8173.10000110.9L381 L384 Y385 A403 T434 L436 A440 A441 V442L381-V438 HydrophobicContact CD2-CG1 3.91Å; L384-V438 HydrophobicContact CB-CG2 3.98Å; L384-V438 HydrophobicContact CD1-CG1 4.3Å; Y385-V438 HydrophobicContact CD1-CB 4.08Å; Y385-V438 HydrophobicContact CD1-CG2 3.69Å; Y385-V438 HydrophobicContact CE1-CB 3.78Å; Y385-V438 HydrophobicContact CE1-CG1 3.97Å; Y385-V438 HydrophobicContact CE1-CG2 3.93Å; A403-V438 HydrophobicContact CB-CG1 4.36Å; T434-V438 WeakPolarHBondContact O-CG2 3.38Å; T434-V438 PolarHBondContact O-N 3.08Å; L436-V438 VanDerWaalsContact C-N 3.35Å; L436-V438 PolarHBondContact O-N 3.06Å; V438-A440 PolarHBondContact O-N 3.31Å; V438-A441 PolarHBondContact O-N 3.42Å; V438-V442 HydrophobicContact CG1-CG2 4.08Å; V438-V442 WeakPolarHBondContact O-CB 3.25Å; V438-V442 VanDerWaalsContact O-CG2 3.26Å; V438-V442 WeakPolarHBondContact O-CG2 3.23Å; V438-V442 PolarHBondContact O-N 3.06Å
439L98.5Very high94.9Very high0 Ų027.1 Ų27.10%015%0.154CC..Hα-helixtrans-57.1-49.3175.1-18060.5000111.1L416 I419 L420 V423 P435 L436 A441 V442 L443 L462L416-L439 HydrophobicContact CD2-CD1 4.09Å; I419-L439 HydrophobicContact CB-CD1 4.49Å; I419-L439 HydrophobicContact CG2-CB 3.72Å; I419-L439 HydrophobicContact CG2-CD1 3.88Å; I419-L439 HydrophobicContact CG2-CG 4.27Å; L420-L439 HydrophobicContact CD2-CD1 4.45Å; L420-L439 HydrophobicContact CD2-CD2 3.98Å; V423-L439 HydrophobicContact CG2-CD2 4.1Å; P435-L439 WeakPolarHBondContact O-CB 3.5Å; P435-L439 PolarHBondContact O-N 3.11Å; L436-L439 WeakPolarHBondContact O-CB 3.26Å; L436-L439 PolarHBondContact O-N 2.83Å; L439-A441 VanDerWaalsContact C-N 3.3Å; L439-A441 PolarHBondContact O-N 3.03Å; L439-V442 PolarHBondContact O-N 3.37Å; L439-L443 HydrophobicContact CD1-CD1 3.91Å; L439-L443 HydrophobicContact CD1-CD2 4.4Å; L439-L443 HydrophobicContact CD1-CG 3.91Å; L439-L443 HydrophobicContact CD2-CD1 4.44Å; L439-L443 HydrophobicContact CG-CD1 3.77Å; L439-L443 HydrophobicContact CG-CG 4.21Å; L439-L443 WeakPolarHBondContact O-CB 3.25Å; L439-L443 VanDerWaalsContact O-CG 3.23Å; L439-L443 WeakPolarHBondContact O-CG 3.38Å; L439-L443 PolarHBondContact O-N 3.1Å; L439-L462 HydrophobicContact CD2-CD2 4.35Å
440A98.5Very high95.2Very high7 Ų723.9 Ų23.96%0.05814%0.142CC..Hα-helixtrans-57.7-43.7177.800000111.4L436 V438 G444 A482L436-A440 WeakPolarHBondContact O-CB 3.29Å; L436-A440 PolarHBondContact O-N 3.35Å; V438-A440 PolarHBondContact O-N 3.31Å; A440-G444 PolarHBondContact O-N 3Å; A440-A482 HydrophobicContact CB-CB 4Å
441A98.3Very high95.4Very high8 Ų820.9 Ų20.97%0.06612%0.12CC..Hα-helixtrans-65.8-45177.300000112.7L400 A403 K404 M437 V438 L439 G444 G445L400-A441 HydrophobicContact CB-CB 4.16Å; L400-A441 HydrophobicContact CD2-CB 3.85Å; A403-A441 HydrophobicContact CB-CB 3.7Å; K404-A441 WeakPolarHBondContact CA-O 3.35Å; K404-A441 HydrophobicContact CG-CB 4.4Å; K404-A441 WeakPolarHBondContact CG-O 3.45Å; M437-A441 PolarHBondContact O-N 3.24Å; V438-A441 PolarHBondContact O-N 3.42Å; L439-A441 VanDerWaalsContact C-N 3.3Å; L439-A441 PolarHBondContact O-N 3.03Å; A441-G444 PolarHBondContact O-N 2.94Å; A441-G444 VanDerWaalsContact O-N 3.13Å; A441-G445 PolarHBondContact O-N 3.15Å
442V98.1Very high95.5Very high0 Ų023.1 Ų23.10%013%0.129CC..Hα-helixtrans-62.5-47.2176.8174.10000110.5A403 I406 G407 F415 I419 V438 L439 G444 G445 G446A403-V442 HydrophobicContact CB-CG2 4.13Å; A403-V442 WeakPolarHBondContact O-CA 3.45Å; A403-V442 WeakPolarHBondContact O-CG2 3.5Å; I406-V442 HydrophobicContact CB-CG2 4.3Å; I406-V442 HydrophobicContact CG2-CG1 4.43Å; I406-V442 HydrophobicContact CG2-CG2 4.31Å; G407-V442 WeakPolarHBondContact CA-O 3.44Å; F415-V442 HydrophobicContact CB-CG1 4.42Å; F415-V442 HydrophobicContact CD1-CG1 3.84Å; F415-V442 HydrophobicContact CD2-CG1 3.51Å; F415-V442 HydrophobicContact CE1-CG1 3.81Å; F415-V442 HydrophobicContact CE2-CG1 3.54Å; F415-V442 HydrophobicContact CG-CG1 3.69Å; F415-V442 HydrophobicContact CZ-CG1 3.69Å; I419-V442 HydrophobicContact CD1-CB 4.27Å; I419-V442 HydrophobicContact CD1-CG1 4.26Å; I419-V442 HydrophobicContact CD1-CG2 3.94Å; V438-V442 HydrophobicContact CG1-CG2 4.08Å; V438-V442 WeakPolarHBondContact O-CB 3.25Å; V438-V442 VanDerWaalsContact O-CG2 3.26Å; V438-V442 WeakPolarHBondContact O-CG2 3.23Å; V438-V442 PolarHBondContact O-N 3.06Å; L439-V442 PolarHBondContact O-N 3.37Å; V442-G444 PolarHBondContact O-N 2.81Å; V442-G445 PolarHBondContact O-N 3.16Å; V442-G445 VanDerWaalsContact O-N 3.14Å; V442-G446 PolarHBondContact O-N 3.48Å
443L97.6Very high95.5Very high1 Ų127.4 Ų27.41%0.00516%0.157CC..Hα-helixtrans-58.7-36.1174.2-68.1172.4000111.3F415 L439 G445 G446 L451 V458 V486 L487F415-L443 HydrophobicContact CE2-CD2 4.49Å; L439-L443 HydrophobicContact CD1-CD1 3.91Å; L439-L443 HydrophobicContact CD1-CD2 4.4Å; L439-L443 HydrophobicContact CD1-CG 3.91Å; L439-L443 HydrophobicContact CD2-CD1 4.44Å; L439-L443 HydrophobicContact CG-CD1 3.77Å; L439-L443 HydrophobicContact CG-CG 4.21Å; L439-L443 WeakPolarHBondContact O-CB 3.25Å; L439-L443 VanDerWaalsContact O-CG 3.23Å; L439-L443 WeakPolarHBondContact O-CG 3.38Å; L439-L443 PolarHBondContact O-N 3.1Å; L443-G445 PolarHBondContact O-N 2.83Å; L443-G446 PolarHBondContact O-N 3.31Å; L443-G446 VanDerWaalsContact O-N 3.1Å; L443-L451 HydrophobicContact CD2-CD2 3.86Å; L443-L451 WeakPolarHBondContact O-CD1 3.22Å; L443-V458 HydrophobicContact CD1-CG1 4.08Å; L443-V458 HydrophobicContact CD2-CG2 4.41Å; L443-V486 VanDerWaalsContact C-CG1 3.47Å; L443-V486 HydrophobicContact CB-CG1 3.55Å; L443-L487 HydrophobicContact CD1-CD2 3.99Å; L443-L487 HydrophobicContact CD1-CG 4.22Å; L443-L487 HydrophobicContact CD2-CD2 4.29Å
444G95.8Very high95.6Very high20 Ų2027.5 Ų27.521%0.20616%0.159CC..Hα-helixtrans-68.5-20.5-179.600000114.3A440 A441 V442 V486 Q490A440-G444 PolarHBondContact O-N 3Å; A441-G444 PolarHBondContact O-N 2.94Å; A441-G444 VanDerWaalsContact O-N 3.13Å; V442-G444 PolarHBondContact O-N 2.81Å; G444-V486 VanDerWaalsContact CA-CG1 3.49Å; G444-V486 VanDerWaalsContact N-CG1 3.28Å; G444-Q490 PolarHBondContact O-NE2 2.89Å; G444-Q490 VanDerWaalsContact O-NE2 3.13Å
445G94.1Very high95.5Very high16 Ų1627.4 Ų27.417%0.16516%0.158CC..Hα-helixtrans-92.6-12.9171.600000114.4K404 T408 A441 V442 L443K404-G445 WeakPolarHBondContact O-CA 3.3Å; T408-G445 WeakPolarHBondContact CA-O 3.43Å; T408-G445 PolarHBondContact N-O 3.27Å; T408-G445 PolarHBondContact OG1-O 3.27Å; A441-G445 PolarHBondContact O-N 3.15Å; V442-G445 PolarHBondContact O-N 3.16Å; V442-G445 VanDerWaalsContact O-N 3.14Å; L443-G445 PolarHBondContact O-N 2.83Å
446G92.1Very high95.5Very high3 Ų330.7 Ų30.73%0.03117%0.173CC..SBendtrans-75.7146.6179.100000112.3G407 V442 L443 Q490G407-G446 WeakPolarHBondContact O-CA 3.43Å; V442-G446 PolarHBondContact O-N 3.48Å; L443-G446 PolarHBondContact O-N 3.31Å; L443-G446 VanDerWaalsContact O-N 3.1Å; G446-Q490 PolarHBondContact O-OE1 2.96Å
447S90.4Very high95.5Very high16 Ų1634.6 Ų34.611%0.11219%0.192CC..  trans-86.8148.2175.773.70000111.7H316 P449 L450 L451H316-S447 PolarHBondContact CD2-OG 3.35Å; H316-S447 PolarHBondContact CE1-OG 2.96Å; H316-S447 PolarHBondContact NE2-OG 3.31Å; S447-P449 VanDerWaalsContact C-CD 3.47Å; S447-L450 PolarHBondContact O-N 3.21Å; S447-L450 WeakPolarHBondContact OG-CG 3.41Å; S447-L451 PolarHBondContact O-N 3.48Å
448K91.4Very high95.5Very high61 Ų6133.4 Ų33.427%0.26519%0.186SC..Hα-helixtrans-42.2-52.6174.2-172.5170.7-174.9173.60114.7L450 L451 K452 Q490 C491 E492 D494K448-L450 VanDerWaalsContact C-N 3.28Å; K448-L450 PolarHBondContact O-N 2.88Å; K448-L451 PolarHBondContact O-N 2.89Å; K448-K452 VanDerWaalsContact O-CB 3.3Å; K448-K452 WeakPolarHBondContact O-CB 3.26Å; K448-K452 PolarHBondContact O-N 3.46Å; K448-Q490 VanDerWaalsContact CB-O 3.22Å; K448-Q490 WeakPolarHBondContact CB-O 3.19Å; K448-Q490 VanDerWaalsContact CG-O 3.32Å; K448-Q490 WeakPolarHBondContact CG-O 3.18Å; K448-C491 WeakPolarHBondContact CE-O 3.39Å; K448-E492 IonicContact NZ-OE2 2.72Å; K448-E492 PolarHBondContact NZ-OE2 3.49Å; K448-D494 WeakPolarHBondContact CE-OD2 3.38Å; K448-D494 IonicContact NZ-OD2 2.73Å
449P91.6Very high95.5Very high82 Ų8233.4 Ų33.453%0.53219%0.186SC..Hα-helixtrans-65.6-29.3-17726.3-35.9000113.5S447 P453S447-P449 VanDerWaalsContact C-CD 3.47Å; P449-P453 WeakPolarHBondContact O-CD 3.42Å
450L91.7Very high95.4Very high75 Ų7536.3 Ų36.339%0.39320%0.202SC..Hα-helixtrans-82.4-34.1178.8-65179.4000112.1P412 S447 K448 P453 H454P412-L450 HydrophobicContact CG-CB 4.14Å; S447-L450 PolarHBondContact O-N 3.21Å; S447-L450 WeakPolarHBondContact OG-CG 3.41Å; K448-L450 VanDerWaalsContact C-N 3.28Å; K448-L450 PolarHBondContact O-N 2.88Å; L450-P453 WeakPolarHBondContact O-CD 3.43Å; L450-H454 PolarHBondContact O-CD2 2.67Å
451L93.6Very high95.4Very high5 Ų536.7 Ų36.73%0.02620%0.203CC..Hα-helixtrans-81.1-34.2-179.3-68.1177.8000113.2P412 F415 L443 S447 K448 P453 H454 L455 Q490P412-L451 HydrophobicContact CG-CD2 4.19Å; F415-L451 HydrophobicContact CZ-CD2 4.25Å; L443-L451 HydrophobicContact CD2-CD2 3.86Å; L443-L451 WeakPolarHBondContact O-CD1 3.22Å; S447-L451 PolarHBondContact O-N 3.48Å; K448-L451 PolarHBondContact O-N 2.89Å; L451-P453 VanDerWaalsContact C-CD 3.45Å; L451-H454 CarbonylContact O-C 3.43Å; L451-H454 PolarHBondContact O-N 3.29Å; L451-L455 PolarHBondContact O-N 3Å; L451-L455 VanDerWaalsContact O-N 3.1Å; L451-Q490 HydrophobicContact CD1-CB 4.05Å; L451-Q490 HydrophobicContact CD1-CG 4.38Å
452K94.5Very high95.4Very high111 Ų11136.3 Ų36.348%0.48320%0.2SC..G310 helixtrans-48-47.1-176.9172.8178-178.5152.80114.4K448 H454 L455 D494K448-K452 VanDerWaalsContact O-CB 3.3Å; K448-K452 WeakPolarHBondContact O-CB 3.26Å; K448-K452 PolarHBondContact O-N 3.46Å; K452-H454 PolarHBondContact O-N 3.06Å; K452-H454 VanDerWaalsContact O-N 3.16Å; K452-L455 PolarHBondContact O-N 2.66Å; K452-D494 VanDerWaalsContact CE-OD1 3.24Å; K452-D494 WeakPolarHBondContact CE-OD1 3.49Å; K452-D494 HydrophobicContact CG-CB 4.43Å; K452-D494 IonicContact NZ-OD1 3.61Å; K452-D494 PolarHBondContact NZ-OD1 3.34Å; K452-D494 IonicContact NZ-OD2 3.92Å
453P96.2Very high95.4Very high94 Ų9437.7 Ų37.761%0.6121%0.208SC*.G310 helixtrans-63.9-20.3-179.9-21.334.1000114.1P449 L450 L451P449-P453 WeakPolarHBondContact O-CD 3.42Å; L450-P453 WeakPolarHBondContact O-CD 3.43Å; L451-P453 VanDerWaalsContact C-CD 3.45Å
454H96.4Very high95.3Very high41 Ų4141 Ų4119%0.1922%0.223CC..G310 helixtrans-108.2-3.1-174.8-58.8-70.8000113.4L416 L450 L451 K452 Q456 Q457 V458L416-H454 HydrophobicContact CD1-CB 3.46Å; L416-H454 VanDerWaalsContact CD1-CB 3.46Å; L450-H454 PolarHBondContact O-CD2 2.67Å; L451-H454 CarbonylContact O-C 3.43Å; L451-H454 PolarHBondContact O-N 3.29Å; K452-H454 PolarHBondContact O-N 3.06Å; K452-H454 VanDerWaalsContact O-N 3.16Å; H454-Q456 VanDerWaalsContact C-N 3.26Å; H454-Q456 PolarHBondContact O-N 3.29Å; H454-Q457 WeakPolarHBondContact O-CB 3.46Å; H454-Q457 PolarHBondContact O-N 3Å; H454-Q457 VanDerWaalsContact O-N 3.08Å; H454-V458 PolarHBondContact O-N 3.02Å
455L96.2Very high95.2Very high4 Ų443.3 Ų43.32%0.02124%0.235CC..Hα-helixtrans-53.5-44.7-178.7178.661.3000112.1L451 K452 Q457 V458 V459 L487 C491 D494 T498L451-L455 PolarHBondContact O-N 3Å; L451-L455 VanDerWaalsContact O-N 3.1Å; K452-L455 PolarHBondContact O-N 2.66Å; L455-Q457 PolarHBondContact O-N 3.23Å; L455-V458 PolarHBondContact O-N 3.34Å; L455-V459 HydrophobicContact CD1-CG2 3.96Å; L455-V459 VanDerWaalsContact O-CG2 3.32Å; L455-V459 WeakPolarHBondContact O-CG2 3.49Å; L455-V459 PolarHBondContact O-N 2.91Å; L455-L487 HydrophobicContact CD1-CB 4.38Å; L455-L487 HydrophobicContact CD1-CD1 4.32Å; L455-L487 HydrophobicContact CD1-CD2 3.88Å; L455-L487 HydrophobicContact CD1-CG 4.42Å; L455-C491 HydrophobicContact CD1-CB 4.46Å; L455-C491 HydrophobicContact CD2-CB 4.14Å; L455-D494 HydrophobicContact CD2-CB 4.4Å; L455-D494 WeakPolarHBondContact CD2-O 3.35Å; L455-T498 HydrophobicContact CG-CG2 4.17Å
456Q96.9Very high95.1Very high70 Ų7047.8 Ų47.833%0.32725%0.252SS..Hα-helixtrans-58.7-48.8177.6-171.26348.200111.6H454 V458 V459 D460 T498H454-Q456 VanDerWaalsContact C-N 3.26Å; H454-Q456 PolarHBondContact O-N 3.29Å; Q456-V458 PolarHBondContact O-N 3.25Å; Q456-V459 PolarHBondContact O-N 2.84Å; Q456-D460 WeakPolarHBondContact CG-OD2 3.48Å; Q456-D460 PolarHBondContact NE2-OD1 2.82Å; Q456-D460 PolarHBondContact NE2-OD2 3.25Å; Q456-D460 VanDerWaalsContact O-CB 3.25Å; Q456-D460 WeakPolarHBondContact O-CB 3.38Å; Q456-D460 PolarHBondContact O-N 3.44Å; Q456-T498 HydrophobicContact CB-CG2 4.43Å
457Q97.4Very high95.3Very high84 Ų8447.6 Ų47.639%0.39325%0.25SS..Hα-helixtrans-59-45.7179.5-178.1-173.71.400111.9L420 H454 L455 T461L420-Q457 HydrophobicContact CD1-CG 3.91Å; H454-Q457 WeakPolarHBondContact O-CB 3.46Å; H454-Q457 PolarHBondContact O-N 3Å; H454-Q457 VanDerWaalsContact O-N 3.08Å; L455-Q457 PolarHBondContact O-N 3.23Å; Q457-T461 PolarHBondContact O-N 2.84Å; Q457-T461 VanDerWaalsContact O-N 3.15Å; Q457-T461 PolarHBondContact O-OG1 3.14Å
458V97.8Very high95.5Very high3 Ų346.9 Ų46.92%0.01825%0.245CC..Hα-helixtrans-63.6-50.6-179.5178.20000110.4L416 L443 H454 L455 Q456 D460 T461 L462 L487L416-V458 HydrophobicContact CD1-CG2 3.92Å; L416-V458 HydrophobicContact CD2-CG2 3.61Å; L416-V458 HydrophobicContact CG-CG2 4.43Å; L443-V458 HydrophobicContact CD1-CG1 4.08Å; L443-V458 HydrophobicContact CD2-CG2 4.41Å; H454-V458 PolarHBondContact O-N 3.02Å; L455-V458 PolarHBondContact O-N 3.34Å; Q456-V458 PolarHBondContact O-N 3.25Å; V458-D460 VanDerWaalsContact C-N 3.34Å; V458-D460 PolarHBondContact O-N 3.32Å; V458-T461 WeakPolarHBondContact O-CB 3.41Å; V458-T461 PolarHBondContact O-N 2.94Å; V458-T461 VanDerWaalsContact O-N 3.15Å; V458-L462 HydrophobicContact CG1-CD1 4.31Å; V458-L462 HydrophobicContact CG1-CG 4.46Å; V458-L462 WeakPolarHBondContact O-CG 3.47Å; V458-L462 PolarHBondContact O-N 3.39Å; V458-L487 HydrophobicContact CG1-CD1 3.95Å; V458-L487 HydrophobicContact CG1-CD2 4.45Å
459V97.9Very high95.6Very high0 Ų045.4 Ų45.40%024%0.239CC..Hα-helixtrans-67.3-37.4-176.5179.20000111.5L455 Q456 T461 L462 V463 L487 T498 Q501 L502L455-V459 HydrophobicContact CD1-CG2 3.96Å; L455-V459 VanDerWaalsContact O-CG2 3.32Å; L455-V459 WeakPolarHBondContact O-CG2 3.49Å; L455-V459 PolarHBondContact O-N 2.91Å; Q456-V459 PolarHBondContact O-N 2.84Å; V459-T461 PolarHBondContact O-N 2.84Å; V459-L462 PolarHBondContact O-N 3.22Å; V459-L462 VanDerWaalsContact O-N 3.12Å; V459-V463 PolarHBondContact O-N 3.48Å; V459-L487 HydrophobicContact CG2-CD1 3.85Å; V459-T498 HydrophobicContact CB-CG2 4.18Å; V459-T498 HydrophobicContact CG2-CG2 4.31Å; V459-Q501 HydrophobicContact CG1-CB 3.31Å; V459-Q501 HydrophobicContact CG1-CG 4.34Å; V459-L502 HydrophobicContact CB-CD2 4.5Å; V459-L502 HydrophobicContact CG1-CD2 3.96Å; V459-L502 HydrophobicContact CG1-CG 4.02Å; V459-L502 HydrophobicContact CG2-CD2 3.65Å; V459-L502 HydrophobicContact CG2-CG 4.1Å
460D97.7Very high95.5Very high62 Ų6247.5 Ų47.533%0.33224%0.242SC..Hα-helixtrans-63.2-30174.6-72.8-20.2000112.1Q456 V458 Q464 Q501Q456-D460 WeakPolarHBondContact CG-OD2 3.48Å; Q456-D460 PolarHBondContact NE2-OD1 2.82Å; Q456-D460 PolarHBondContact NE2-OD2 3.25Å; Q456-D460 VanDerWaalsContact O-CB 3.25Å; Q456-D460 WeakPolarHBondContact O-CB 3.38Å; Q456-D460 PolarHBondContact O-N 3.44Å; V458-D460 VanDerWaalsContact C-N 3.34Å; V458-D460 PolarHBondContact O-N 3.32Å; D460-Q464 WeakPolarHBondContact O-CG 3.25Å; D460-Q501 PolarHBondContact OD1-NE2 2.78Å
461T98.1Very high95.5Very high14 Ų1445.5 Ų45.59%0.08623%0.229CC..Hα-helixtrans-72.3-44.9169.4-58.80000111.8L420 V423 T424 Q457 V458 V459 V463 Q464L420-T461 HydrophobicContact CB-CG2 4.32Å; L420-T461 HydrophobicContact CD2-CG2 4.04Å; V423-T461 HydrophobicContact CG1-CG2 4.26Å; T424-T461 HydrophobicContact CG2-CG2 3.65Å; Q457-T461 PolarHBondContact O-N 2.84Å; Q457-T461 VanDerWaalsContact O-N 3.15Å; Q457-T461 PolarHBondContact O-OG1 3.14Å; V458-T461 WeakPolarHBondContact O-CB 3.41Å; V458-T461 PolarHBondContact O-N 2.94Å; V458-T461 VanDerWaalsContact O-N 3.15Å; V459-T461 PolarHBondContact O-N 2.84Å; T461-V463 VanDerWaalsContact C-N 3.27Å; T461-V463 PolarHBondContact O-N 3.46Å; T461-Q464 WeakPolarHBondContact O-CB 3.24Å; T461-Q464 PolarHBondContact O-N 3.16Å
462L97.9Very high95.4Very high1 Ų151 Ų511%0.00526%0.255CS..Hα-helixtrans-63.7-31.3-178-64-178000113L436 L439 V458 V459 Q464 C468 L480 C483 L487 V505L436-L462 HydrophobicContact CD2-CD2 3.81Å; L439-L462 HydrophobicContact CD2-CD2 4.35Å; V458-L462 HydrophobicContact CG1-CD1 4.31Å; V458-L462 HydrophobicContact CG1-CG 4.46Å; V458-L462 WeakPolarHBondContact O-CG 3.47Å; V458-L462 PolarHBondContact O-N 3.39Å; V459-L462 PolarHBondContact O-N 3.22Å; V459-L462 VanDerWaalsContact O-N 3.12Å; L462-Q464 VanDerWaalsContact C-N 3.31Å; L462-C468 WeakPolarHBondContact O-CB 3.28Å; L462-L480 HydrophobicContact CB-CD1 4.39Å; L462-L480 HydrophobicContact CD2-CD1 3.89Å; L462-C483 HydrophobicContact CD1-CB 3.91Å; L462-C483 HydrophobicContact CD2-CB 4.42Å; L462-L487 HydrophobicContact CD1-CD1 4.18Å; L462-V505 HydrophobicContact CB-CG2 4.12Å
463V97.1Very high95.3Very high29 Ų2949.4 Ų49.418%0.17625%0.249CC..THydrogen-bonded Turntrans-81.8-7.3179.978.90000113.6V459 T461 C468 Q501 Q504 V505V459-V463 PolarHBondContact O-N 3.48Å; T461-V463 VanDerWaalsContact C-N 3.27Å; T461-V463 PolarHBondContact O-N 3.46Å; V463-C468 PolarHBondContact O-SG 3.13Å; V463-C468 VanDerWaalsContact O-SG 3.38Å; V463-Q501 HydrophobicContact CB-CB 4.31Å; V463-Q501 HydrophobicContact CG1-CB 4.41Å; V463-Q501 HydrophobicContact CG1-CG 4.3Å; V463-Q501 HydrophobicContact CG2-CB 4.34Å; V463-Q504 HydrophobicContact CG2-CB 3.83Å; V463-V505 HydrophobicContact CB-CG2 4.07Å; V463-V505 HydrophobicContact CG2-CG2 4.29Å
464Q96.4Very high95.2Very high69 Ų6947.2 Ų47.232%0.32223%0.234SC..SBendtrans-59.4136176.8-71.6177.35.900110.3T424 D460 T461 L462 E466 V467 C468T424-Q464 VanDerWaalsContact CG2-OE1 3.25Å; D460-Q464 WeakPolarHBondContact O-CG 3.25Å; T461-Q464 WeakPolarHBondContact O-CB 3.24Å; T461-Q464 PolarHBondContact O-N 3.16Å; L462-Q464 VanDerWaalsContact C-N 3.31Å; Q464-E466 PolarHBondContact O-N 3.32Å; Q464-V467 HydrophobicContact CB-CB 4.48Å; Q464-V467 HydrophobicContact CB-CG2 4.21Å; Q464-V467 PolarHBondContact O-N 3.21Å; Q464-C468 PolarHBondContact O-N 3.33Å; Q464-C468 PolarHBondContact O-SG 3.45Å
465P93.1Very high95.1Very high69 Ų6947.9 Ų47.945%0.44824%0.241SC..Hα-helixtrans-54.3-38.4179.3-2735.2000113.3V467 Q469 E470P465-V467 PolarHBondContact O-N 3.34Å; P465-Q469 WeakPolarHBondContact O-CA 3.47Å; P465-Q469 WeakPolarHBondContact O-CB 3.49Å; P465-Q469 PolarHBondContact O-N 3.39Å; P465-E470 PolarHBondContact O-N 2.88Å
466E93.2Very high95.2Very high110 Ų11047.8 Ų47.851%0.51424%0.24SC..Hα-helixtrans-64.2-21.8178.9-57.378.3-171.600112.7Q464 E470Q464-E466 PolarHBondContact O-N 3.32Å; E466-E470 WeakPolarHBondContact O-CB 3.43Å
467V95.8Very high95.2Very high0 Ų044.5 Ų44.50%023%0.225CC..Hα-helixtrans-98.6-57.5177.8-178.70000110.5V423 T424 Q464 P465 Y476 L480V423-V467 HydrophobicContact CG1-CG1 3.74Å; V423-V467 HydrophobicContact CG1-CG2 4.03Å; T424-V467 HydrophobicContact CG2-CG2 4.22Å; Q464-V467 HydrophobicContact CB-CB 4.48Å; Q464-V467 HydrophobicContact CB-CG2 4.21Å; Q464-V467 PolarHBondContact O-N 3.21Å; P465-V467 PolarHBondContact O-N 3.34Å; V467-Y476 VanDerWaalsContact O-CE1 3.24Å; V467-Y476 WeakPolarHBondContact O-CE1 3.25Å; V467-Y476 PolarHBondContact O-OH 3.4Å; V467-L480 HydrophobicContact CG1-CD1 4.36Å
468C94.6Very high95.2Very high1 Ų143.9 Ų43.91%0.00722%0.222CC..Hα-helixtrans-78.8-20.6-172620000114.9L462 V463 Q464 L480 T508L462-C468 WeakPolarHBondContact O-CB 3.28Å; V463-C468 PolarHBondContact O-SG 3.13Å; V463-C468 VanDerWaalsContact O-SG 3.38Å; Q464-C468 PolarHBondContact O-N 3.33Å; Q464-C468 PolarHBondContact O-SG 3.45Å; C468-L480 HydrophobicContact CB-CD2 4.1Å; C468-T508 HydrophobicContact CB-CG2 4.12Å; C468-T508 WeakPolarHBondContact O-CG2 3.2Å
469Q92.6Very high95.2Very high29 Ų2945 Ų4514%0.13623%0.227CC..THydrogen-bonded Turntrans-117.9-20.5-171-64.6167.836.300114.7P465 Y471 T508 P564P465-Q469 WeakPolarHBondContact O-CA 3.47Å; P465-Q469 WeakPolarHBondContact O-CB 3.49Å; P465-Q469 PolarHBondContact O-N 3.39Å; Q469-Y471 PolarHBondContact O-N 3.35Å; Q469-T508 HydrophobicContact CG-CG2 3.71Å; Q469-P564 HydrophobicContact CB-CG 4.42Å; Q469-P564 HydrophobicContact CG-CG 4.42Å
470E90.4Very high95.2Very high126 Ų12645 Ų4559%0.58923%0.227SC*.SBendtrans-65.3-37.9-174.1-173.865.7-165.500113P465 E466P465-E470 PolarHBondContact O-N 2.88Å; E466-E470 WeakPolarHBondContact O-CB 3.43Å
471Y90.9Very high95.2Very high33 Ų3342.2 Ų42.213%0.12921%0.212CC..  trans-115.3128.4-171.8-60.5-78.2000112.5P426 H429 P432 Q469 Y476P426-Y471 HydrophobicContact CG-CE2 4.32Å; H429-Y471 PolarHBondContact ND1-OH 3.49Å; P432-Y471 HydrophobicContact CB-CD1 4.04Å; P432-Y471 HydrophobicContact CB-CD2 4.15Å; P432-Y471 HydrophobicContact CB-CE1 3.73Å; P432-Y471 HydrophobicContact CB-CE2 3.89Å; P432-Y471 HydrophobicContact CB-CG 4.25Å; P432-Y471 HydrophobicContact CG-CD1 3.58Å; P432-Y471 HydrophobicContact CG-CD2 4.42Å; P432-Y471 HydrophobicContact CG-CE1 3.62Å; P432-Y471 HydrophobicContact CG-CE2 4.48Å; P432-Y471 HydrophobicContact CG-CG 4.01Å; Q469-Y471 PolarHBondContact O-N 3.35Å; Y471-Y476 HydrophobicContact CD2-CD2 4.03Å; Y471-Y476 HydrophobicContact CD2-CE1 4.14Å; Y471-Y476 AromaticContact CD2-CE2 3.49Å; Y471-Y476 HydrophobicContact CD2-CE2 3.49Å; Y471-Y476 VanDerWaalsContact CD2-CE2 3.49Å; Y471-Y476 AromaticContact CD2-CZ 3.56Å; Y471-Y476 HydrophobicContact CE2-CE2 4.22Å; Y471-Y476 HydrophobicContact CG-CD2 4.02Å; Y471-Y476 HydrophobicContact CG-CE1 4.5Å; Y471-Y476 AromaticContact CG-CE2 3.97Å; Y471-Y476 HydrophobicContact CG-CE2 3.97Å; Y471-Y476 HydrophobicContact CG-CG 4.31Å
472Q91.3Very high95.2Very high121 Ų12143 Ų4357%0.56522%0.22SC*.  trans-105.25.5179.3-60.5179.46.700113.6V474 L512Q472-V474 PolarHBondContact O-N 2.83Å; Q472-L512 HydrophobicContact CG-CD2 4.31Å
473Q93.3Very high95.3Very high77 Ų7742.9 Ų42.936%0.3622%0.219SC..  trans-64.6133.4178.8-66.9171.6-11.700109.9W433 T475 Y476 L477W433-Q473 VanDerWaalsContact CE3-OE1 3.27Å; Q473-T475 VanDerWaalsContact C-N 3.28Å; Q473-T475 PolarHBondContact O-N 3.26Å; Q473-Y476 WeakPolarHBondContact O-CB 3.5Å; Q473-Y476 PolarHBondContact O-N 3.02Å; Q473-L477 PolarHBondContact O-N 3.31Å; Q473-L477 VanDerWaalsContact O-N 3.08Å
474V94.9Very high95.3Very high48 Ų4841.5 Ų41.529%0.29121%0.211SC..Hα-helixtrans-53.5-47.1-179.3178.70000110.9Q472 Y476 L477 E478 D515 L518Q472-V474 PolarHBondContact O-N 2.83Å; V474-Y476 VanDerWaalsContact C-N 3.29Å; V474-Y476 PolarHBondContact O-N 3.32Å; V474-L477 PolarHBondContact O-N 2.88Å; V474-E478 HydrophobicContact CG1-CG 4.32Å; V474-E478 WeakPolarHBondContact O-CG 3.08Å; V474-E478 PolarHBondContact O-N 3.1Å; V474-D515 HydrophobicContact CG1-CB 4.46Å; V474-L518 HydrophobicContact CG1-CD2 4.25Å
475T94.5Very high95.4Very high55 Ų5540.4 Ų40.434%0.33721%0.207SC..Hα-helixtrans-60.4-36.9178.2-49.50000112.7W433 Q473 E478 Q479W433-T475 HydrophobicContact CB-CG2 4.48Å; W433-T475 HydrophobicContact CD2-CG2 3.92Å; W433-T475 HydrophobicContact CG-CG2 3.82Å; Q473-T475 VanDerWaalsContact C-N 3.28Å; Q473-T475 PolarHBondContact O-N 3.26Å; T475-E478 PolarHBondContact O-N 3.22Å; T475-Q479 VanDerWaalsContact O-CG 3.29Å; T475-Q479 WeakPolarHBondContact O-CG 3.23Å; T475-Q479 PolarHBondContact O-N 3.22Å; T475-Q479 VanDerWaalsContact O-N 3.08Å
476Y96.6Very high95.6Very high2 Ų238.6 Ų38.61%0.00820%0.195CC..Hα-helixtrans-65.3-48.2176.6-172.5-83.5000111.5P432 W433 L436 V467 Y471 Q473 V474 E478 Q479 L480P432-Y476 HydrophobicContact CB-CD2 4Å; P432-Y476 HydrophobicContact CB-CE2 3.95Å; P432-Y476 HydrophobicContact CG-CD2 3.94Å; P432-Y476 HydrophobicContact CG-CE2 4.38Å; P432-Y476 WeakPolarHBondContact O-CE2 3.19Å; W433-Y476 HydrophobicContact CB-CD2 4.01Å; W433-Y476 HydrophobicContact CB-CG 4.48Å; L436-Y476 HydrophobicContact CD1-CD1 4.26Å; L436-Y476 HydrophobicContact CD1-CD2 4.18Å; L436-Y476 HydrophobicContact CD1-CE1 3.74Å; L436-Y476 HydrophobicContact CD1-CE2 3.66Å; L436-Y476 HydrophobicContact CD1-CG 4.46Å; L436-Y476 VanDerWaalsContact CD1-CZ 3.41Å; V467-Y476 VanDerWaalsContact O-CE1 3.24Å; V467-Y476 WeakPolarHBondContact O-CE1 3.25Å; V467-Y476 PolarHBondContact O-OH 3.4Å; Y471-Y476 HydrophobicContact CD2-CD2 4.03Å; Y471-Y476 HydrophobicContact CD2-CE1 4.14Å; Y471-Y476 AromaticContact CD2-CE2 3.49Å; Y471-Y476 HydrophobicContact CD2-CE2 3.49Å; Y471-Y476 VanDerWaalsContact CD2-CE2 3.49Å; Y471-Y476 AromaticContact CD2-CZ 3.56Å; Y471-Y476 HydrophobicContact CE2-CE2 4.22Å; Y471-Y476 HydrophobicContact CG-CD2 4.02Å; Y471-Y476 HydrophobicContact CG-CE1 4.5Å; Y471-Y476 AromaticContact CG-CE2 3.97Å; Y471-Y476 HydrophobicContact CG-CE2 3.97Å; Y471-Y476 HydrophobicContact CG-CG 4.31Å; Q473-Y476 WeakPolarHBondContact O-CB 3.5Å; Q473-Y476 PolarHBondContact O-N 3.02Å; V474-Y476 VanDerWaalsContact C-N 3.29Å; V474-Y476 PolarHBondContact O-N 3.32Å; Y476-E478 VanDerWaalsContact C-N 3.31Å; Y476-E478 PolarHBondContact O-N 3.18Å; Y476-Q479 PolarHBondContact O-N 3.03Å; Y476-Q479 VanDerWaalsContact O-N 3.14Å; Y476-L480 PolarHBondContact O-N 3.22Å
477L97.4Very high95.8Very high1 Ų133.5 Ų33.51%0.00517%0.171CC..Hα-helixtrans-64.6-34.8178-63.7-179.9000112Q473 V474 L480 L481 I509 L512 L518Q473-L477 PolarHBondContact O-N 3.31Å; Q473-L477 VanDerWaalsContact O-N 3.08Å; V474-L477 PolarHBondContact O-N 2.88Å; L477-L480 PolarHBondContact O-N 2.83Å; L477-L481 WeakPolarHBondContact O-CB 3.2Å; L477-L481 PolarHBondContact O-N 2.87Å; L477-I509 HydrophobicContact CB-CG2 4.42Å; L477-L512 HydrophobicContact CD1-CB 3.93Å; L477-L512 HydrophobicContact CD2-CB 4.37Å; L477-L518 HydrophobicContact CB-CD2 3.61Å; L477-L518 HydrophobicContact CD1-CD2 4.44Å
478E97.3Very high95.8Very high72 Ų7233.5 Ų33.534%0.33617%0.171SC..Hα-helixtrans-60.9-43.1171-75.8177.3149.900112.2V474 T475 Y476 L481 A482 L518V474-E478 HydrophobicContact CG1-CG 4.32Å; V474-E478 WeakPolarHBondContact O-CG 3.08Å; V474-E478 PolarHBondContact O-N 3.1Å; T475-E478 PolarHBondContact O-N 3.22Å; Y476-E478 VanDerWaalsContact C-N 3.31Å; Y476-E478 PolarHBondContact O-N 3.18Å; E478-L481 PolarHBondContact O-N 3.1Å; E478-A482 WeakPolarHBondContact O-CB 3.29Å; E478-A482 PolarHBondContact O-N 3.48Å; E478-L518 HydrophobicContact CG-CD1 3.94Å; E478-L518 HydrophobicContact CG-CD2 4.2Å
479Q97.6Very high95.9Very high25 Ų2538.9 Ų38.912%0.11720%0.196CC..Hα-helixtrans-73.2-34178.7-59.6-36.6-56.900112.5W433 L436 M437 T475 Y476 L481 A482 C483W433-Q479 HydrophobicContact CB-CB 4.44Å; W433-Q479 HydrophobicContact CB-CG 3.99Å; L436-Q479 HydrophobicContact CB-CB 3.77Å; M437-Q479 HydrophobicContact CB-CG 3.9Å; M437-Q479 HydrophobicContact CG-CG 4.26Å; T475-Q479 VanDerWaalsContact O-CG 3.29Å; T475-Q479 WeakPolarHBondContact O-CG 3.23Å; T475-Q479 PolarHBondContact O-N 3.22Å; T475-Q479 VanDerWaalsContact O-N 3.08Å; Y476-Q479 PolarHBondContact O-N 3.03Å; Y476-Q479 VanDerWaalsContact O-N 3.14Å; Q479-L481 VanDerWaalsContact C-N 3.33Å; Q479-A482 PolarHBondContact O-N 3.26Å; Q479-C483 PolarHBondContact O-N 2.96Å
480L98.1Very high95.9Very high0 Ų040.3 Ų40.30%020%0.203CC..Hα-helixtrans-63.2-42.2172.1-171.760.8000110.9L436 L462 V467 C468 Y476 L477 C483 V484 V505 I509L436-L480 HydrophobicContact CD1-CB 4.21Å; L436-L480 HydrophobicContact CD1-CD1 4.32Å; L436-L480 HydrophobicContact CD2-CD1 4.22Å; L462-L480 HydrophobicContact CB-CD1 4.39Å; L462-L480 HydrophobicContact CD2-CD1 3.89Å; V467-L480 HydrophobicContact CG1-CD1 4.36Å; C468-L480 HydrophobicContact CB-CD2 4.1Å; Y476-L480 PolarHBondContact O-N 3.22Å; L477-L480 PolarHBondContact O-N 2.83Å; L480-C483 WeakPolarHBondContact O-CB 3.43Å; L480-C483 PolarHBondContact O-N 3.47Å; L480-V484 PolarHBondContact O-N 3.42Å; L480-V505 HydrophobicContact CD1-CG1 4.16Å; L480-V505 HydrophobicContact CD2-CG1 4.01Å; L480-V505 HydrophobicContact CG-CG1 3.86Å; L480-I509 HydrophobicContact CB-CD1 4.29Å; L480-I509 HydrophobicContact CD2-CD1 4.2Å; L480-I509 HydrophobicContact CD2-CG1 3.89Å; L480-I509 HydrophobicContact CG-CD1 4.01Å; L480-I509 HydrophobicContact CG-CG1 4.25Å
481L98.5Very high96.1Very high5 Ų534.3 Ų34.33%0.02618%0.175CC..Hα-helixtrans-63.1-43.8173.2-174.260.2000111.6L477 E478 Q479 C483 V484 D485 L506 I509 L518 K521 A522 S525L477-L481 WeakPolarHBondContact O-CB 3.2Å; L477-L481 PolarHBondContact O-N 2.87Å; E478-L481 PolarHBondContact O-N 3.1Å; Q479-L481 VanDerWaalsContact C-N 3.33Å; L481-C483 VanDerWaalsContact C-N 3.29Å; L481-C483 PolarHBondContact O-N 3.22Å; L481-V484 WeakPolarHBondContact O-CA 3.36Å; L481-V484 WeakPolarHBondContact O-CB 3.28Å; L481-V484 PolarHBondContact O-N 3.16Å; L481-D485 PolarHBondContact O-N 3.24Å; L481-L506 HydrophobicContact CD1-CD2 3.53Å; L481-I509 HydrophobicContact CB-CD1 4.03Å; L481-I509 HydrophobicContact CD1-CD1 4.16Å; L481-L518 HydrophobicContact CD2-CD1 3.68Å; L481-K521 HydrophobicContact CD2-CB 3.78Å; L481-A522 HydrophobicContact CD1-CB 4.18Å; L481-A522 HydrophobicContact CD2-CB 4.36Å; L481-S525 WeakPolarHBondContact CD1-OG 3.4Å
482A98.4Very high96.2Very high29 Ų2937.4 Ų37.424%0.2419%0.19CC..Hα-helixtrans-59.2-37.9177.800000112.6A440 E478 Q479 V486A440-A482 HydrophobicContact CB-CB 4Å; E478-A482 WeakPolarHBondContact O-CB 3.29Å; E478-A482 PolarHBondContact O-N 3.48Å; Q479-A482 PolarHBondContact O-N 3.26Å; A482-V486 WeakPolarHBondContact O-CB 3.49Å; A482-V486 VanDerWaalsContact O-CG2 3.25Å; A482-V486 WeakPolarHBondContact O-CG2 3.21Å; A482-V486 PolarHBondContact O-N 2.83Å
483C98.4Very high96.3Very high0 Ų035.1 Ų35.10%019%0.187CC..Hα-helixtrans-60.3-47171.6-74.80000111.7L436 L462 Q479 L480 L481 L487L436-C483 PolarHBondContact O-SG 3Å; L436-C483 VanDerWaalsContact O-SG 3.34Å; L462-C483 HydrophobicContact CD1-CB 3.91Å; L462-C483 HydrophobicContact CD2-CB 4.42Å; Q479-C483 PolarHBondContact O-N 2.96Å; L480-C483 WeakPolarHBondContact O-CB 3.43Å; L480-C483 PolarHBondContact O-N 3.47Å; L481-C483 VanDerWaalsContact C-N 3.29Å; L481-C483 PolarHBondContact O-N 3.22Å; C483-L487 VanDerWaalsContact O-CG 3.28Å; C483-L487 WeakPolarHBondContact O-CG 3.46Å; C483-L487 PolarHBondContact O-N 2.88Å; C483-L487 VanDerWaalsContact O-N 3.13Å
484V98.3Very high96.4Very high0 Ų032.9 Ų32.90%018%0.178CC..Hα-helixtrans-62.3-49.1177.9173.10000110.8L480 L481 V486 L487 L488 L502 V505 L506L480-V484 PolarHBondContact O-N 3.42Å; L481-V484 WeakPolarHBondContact O-CA 3.36Å; L481-V484 WeakPolarHBondContact O-CB 3.28Å; L481-V484 PolarHBondContact O-N 3.16Å; V484-V486 VanDerWaalsContact C-N 3.34Å; V484-V486 PolarHBondContact O-N 3.34Å; V484-L487 WeakPolarHBondContact O-CB 3.49Å; V484-L487 PolarHBondContact O-N 3.35Å; V484-L487 VanDerWaalsContact O-N 3.12Å; V484-L488 HydrophobicContact CG1-CD1 4Å; V484-L488 HydrophobicContact CG1-CG 4.24Å; V484-L488 WeakPolarHBondContact O-CG 3.4Å; V484-L488 PolarHBondContact O-N 3.24Å; V484-L502 HydrophobicContact CG1-CD2 4.21Å; V484-L502 HydrophobicContact CG2-CD2 4.32Å; V484-V505 HydrophobicContact CG2-CB 4.37Å; V484-V505 HydrophobicContact CG2-CG1 3.73Å; V484-L506 HydrophobicContact CB-CD2 4.46Å; V484-L506 HydrophobicContact CG1-CD1 4.14Å; V484-L506 HydrophobicContact CG1-CD2 3.87Å; V484-L506 HydrophobicContact CG1-CG 4.03Å
485D98.1Very high96.3Very high45 Ų4530.6 Ų30.624%0.24116%0.164CC..Hα-helixtrans-57.7-45.9-179.9-82-30.5000112.2L481 L487 L488 H489 S525L481-D485 PolarHBondContact O-N 3.24Å; D485-L487 VanDerWaalsContact C-N 3.32Å; D485-L487 PolarHBondContact O-N 3.45Å; D485-L488 PolarHBondContact O-N 3.5Å; D485-H489 PolarHBondContact O-N 3.06Å; D485-H489 PolarHBondContact O-ND1 3.37Å; D485-S525 PolarHBondContact OD1-OG 3.31Å
486V97.6Very high96.3Very high32 Ų3228.8 Ų28.819%0.19416%0.157CC..Hα-helixtrans-61.7-42177.6165.50000111.3L443 G444 A482 V484 H489 Q490L443-V486 VanDerWaalsContact C-CG1 3.47Å; L443-V486 HydrophobicContact CB-CG1 3.55Å; G444-V486 VanDerWaalsContact CA-CG1 3.49Å; G444-V486 VanDerWaalsContact N-CG1 3.28Å; A482-V486 WeakPolarHBondContact O-CB 3.49Å; A482-V486 VanDerWaalsContact O-CG2 3.25Å; A482-V486 WeakPolarHBondContact O-CG2 3.21Å; A482-V486 PolarHBondContact O-N 2.83Å; V484-V486 VanDerWaalsContact C-N 3.34Å; V484-V486 PolarHBondContact O-N 3.34Å; V486-H489 PolarHBondContact O-N 3.11Å; V486-Q490 HydrophobicContact CG1-CG 4.23Å; V486-Q490 WeakPolarHBondContact O-CB 3.49Å; V486-Q490 WeakPolarHBondContact O-CG 3.41Å; V486-Q490 PolarHBondContact O-N 3.34Å
487L97.2Very high96.1Very high2 Ų232.9 Ų32.91%0.0119%0.185CC..Hα-helixtrans-63.2-43.1176.4-69.3172.4000111.6L443 L455 V458 V459 L462 C483 V484 D485 H489 Q490 C491 L502L443-L487 HydrophobicContact CD1-CD2 3.99Å; L443-L487 HydrophobicContact CD1-CG 4.22Å; L443-L487 HydrophobicContact CD2-CD2 4.29Å; L455-L487 HydrophobicContact CD1-CB 4.38Å; L455-L487 HydrophobicContact CD1-CD1 4.32Å; L455-L487 HydrophobicContact CD1-CD2 3.88Å; L455-L487 HydrophobicContact CD1-CG 4.42Å; V458-L487 HydrophobicContact CG1-CD1 3.95Å; V458-L487 HydrophobicContact CG1-CD2 4.45Å; V459-L487 HydrophobicContact CG2-CD1 3.85Å; L462-L487 HydrophobicContact CD1-CD1 4.18Å; C483-L487 VanDerWaalsContact O-CG 3.28Å; C483-L487 WeakPolarHBondContact O-CG 3.46Å; C483-L487 PolarHBondContact O-N 2.88Å; C483-L487 VanDerWaalsContact O-N 3.13Å; V484-L487 WeakPolarHBondContact O-CB 3.49Å; V484-L487 PolarHBondContact O-N 3.35Å; V484-L487 VanDerWaalsContact O-N 3.12Å; D485-L487 VanDerWaalsContact C-N 3.32Å; D485-L487 PolarHBondContact O-N 3.45Å; L487-H489 VanDerWaalsContact C-N 3.32Å; L487-H489 PolarHBondContact O-N 2.88Å; L487-Q490 PolarHBondContact O-N 3.21Å; L487-C491 VanDerWaalsContact O-CB 3.27Å; L487-C491 WeakPolarHBondContact O-CB 3.48Å; L487-C491 PolarHBondContact O-N 3.45Å; L487-L502 HydrophobicContact CD1-CD2 4.43Å
488L96.8Very high96.1Very high0 Ų032.8 Ų32.80%019%0.185CC..Hα-helixtrans-61.2-40.4177.6-66176.4000111.9V484 D485 E492 C495 L502 F528 L529 V532V484-L488 HydrophobicContact CG1-CD1 4Å; V484-L488 HydrophobicContact CG1-CG 4.24Å; V484-L488 WeakPolarHBondContact O-CG 3.4Å; V484-L488 PolarHBondContact O-N 3.24Å; D485-L488 PolarHBondContact O-N 3.5Å; L488-E492 VanDerWaalsContact O-CA 3.31Å; L488-E492 WeakPolarHBondContact O-CA 3.45Å; L488-E492 PolarHBondContact O-N 2.89Å; L488-E492 VanDerWaalsContact O-N 3.08Å; L488-C495 HydrophobicContact CD2-CB 4.22Å; L488-L502 HydrophobicContact CD2-CD1 4.15Å; L488-F528 HydrophobicContact CB-CD1 3.51Å; L488-F528 HydrophobicContact CB-CE1 3.49Å; L488-F528 VanDerWaalsContact CB-CE1 3.49Å; L488-F528 HydrophobicContact CD1-CB 4.39Å; L488-F528 HydrophobicContact CD1-CD1 3.83Å; L488-F528 HydrophobicContact CG-CD1 4.28Å; L488-L529 HydrophobicContact CD1-CB 4.33Å; L488-L529 HydrophobicContact CD2-CB 3.95Å; L488-L529 HydrophobicContact CD2-CD1 3.66Å; L488-L529 HydrophobicContact CD2-CG 4.38Å; L488-V532 HydrophobicContact CD2-CG2 4.3Å
489H95.4Very high96.1Very high115 Ų11529.4 Ų29.453%0.53217%0.169SC..Hα-helixtrans-74-38.7178.6-73.285.9000113.1D485 V486 L487 F528D485-H489 PolarHBondContact O-N 3.06Å; D485-H489 PolarHBondContact O-ND1 3.37Å; V486-H489 PolarHBondContact O-N 3.11Å; L487-H489 VanDerWaalsContact C-N 3.32Å; L487-H489 PolarHBondContact O-N 2.88Å; H489-F528 AromaticContact CD2-CE1 3.91Å; H489-F528 AromaticContact CE1-CD1 3.99Å; H489-F528 AromaticContact CE1-CE1 3.49Å; H489-F528 VanDerWaalsContact CE1-CE1 3.49Å; H489-F528 WeakPolarHBondContact CE1-CE1 3.47Å; H489-F528 AromaticContact CG-CE1 3.79Å; H489-F528 AromaticContact ND1-CE1 3.53Å; H489-F528 AromaticContact NE2-CE1 3.74Å
490Q93.5Very high96.1Very high59 Ų5929.5 Ų29.528%0.27617%0.17SC..Hα-helixtrans-83.8-34.5-176.1-67.8-63.6-7.500113.4G444 G446 K448 L451 V486 L487G444-Q490 PolarHBondContact O-NE2 2.89Å; G444-Q490 VanDerWaalsContact O-NE2 3.13Å; G446-Q490 PolarHBondContact O-OE1 2.96Å; K448-Q490 VanDerWaalsContact CB-O 3.22Å; K448-Q490 WeakPolarHBondContact CB-O 3.19Å; K448-Q490 VanDerWaalsContact CG-O 3.32Å; K448-Q490 WeakPolarHBondContact CG-O 3.18Å; L451-Q490 HydrophobicContact CD1-CB 4.05Å; L451-Q490 HydrophobicContact CD1-CG 4.38Å; V486-Q490 HydrophobicContact CG1-CG 4.23Å; V486-Q490 WeakPolarHBondContact O-CB 3.49Å; V486-Q490 WeakPolarHBondContact O-CG 3.41Å; V486-Q490 PolarHBondContact O-N 3.34Å; L487-Q490 PolarHBondContact O-N 3.21Å
491C94.3Very high96.1Very high0 Ų031.1 Ų31.10%018%0.178CC..Hα-helixtrans-100.7-20.8-176-620000113K448 L455 L487 S493 D494K448-C491 WeakPolarHBondContact CE-O 3.39Å; L455-C491 HydrophobicContact CD1-CB 4.46Å; L455-C491 HydrophobicContact CD2-CB 4.14Å; L487-C491 VanDerWaalsContact O-CB 3.27Å; L487-C491 WeakPolarHBondContact O-CB 3.48Å; L487-C491 PolarHBondContact O-N 3.45Å; C491-S493 PolarHBondContact O-N 3.1Å; C491-D494 HydrophobicContact CB-CB 4.25Å; C491-D494 WeakPolarHBondContact O-CB 3.45Å; C491-D494 PolarHBondContact O-N 3.24Å
492E93.6Very high96Very high98 Ų9830.9 Ų30.946%0.45818%0.177SC..G310 helixtrans47.7-119.2176.4-54.8171.4148.900111.9K448 L488 D494 C495K448-E492 IonicContact NZ-OE2 2.72Å; K448-E492 PolarHBondContact NZ-OE2 3.49Å; L488-E492 VanDerWaalsContact O-CA 3.31Å; L488-E492 WeakPolarHBondContact O-CA 3.45Å; L488-E492 PolarHBondContact O-N 2.89Å; L488-E492 VanDerWaalsContact O-N 3.08Å; E492-D494 PolarHBondContact O-N 2.89Å; E492-D494 VanDerWaalsContact O-N 3.17Å; E492-C495 VanDerWaalsContact O-CB 3.26Å; E492-C495 WeakPolarHBondContact O-CB 3.26Å; E492-C495 PolarHBondContact O-N 3.36Å
493S93.2Very high96Very high72 Ų7229.5 Ų29.550%0.50317%0.165SC..G310 helixtrans-59.9-23.6179.861.30000114.5C491 C495 G496 V532C491-S493 PolarHBondContact O-N 3.1Å; S493-C495 PolarHBondContact O-N 3.34Å; S493-G496 PolarHBondContact O-N 3.12Å; S493-G496 VanDerWaalsContact O-N 3.12Å; S493-V532 VanDerWaalsContact CA-O 3.27Å; S493-V532 WeakPolarHBondContact CA-O 3.36Å
494D94.3Very high96Very high31 Ų3130.3 Ų30.317%0.16617%0.169CC..G310 helixtrans-67.7-20.1177.1-65.7-52.7000111.7K448 K452 L455 C491 E492 G496 S497K448-D494 WeakPolarHBondContact CE-OD2 3.38Å; K448-D494 IonicContact NZ-OD2 2.73Å; K452-D494 VanDerWaalsContact CE-OD1 3.24Å; K452-D494 WeakPolarHBondContact CE-OD1 3.49Å; K452-D494 HydrophobicContact CG-CB 4.43Å; K452-D494 IonicContact NZ-OD1 3.61Å; K452-D494 PolarHBondContact NZ-OD1 3.34Å; K452-D494 IonicContact NZ-OD2 3.92Å; L455-D494 HydrophobicContact CD2-CB 4.4Å; L455-D494 WeakPolarHBondContact CD2-O 3.35Å; C491-D494 HydrophobicContact CB-CB 4.25Å; C491-D494 WeakPolarHBondContact O-CB 3.45Å; C491-D494 PolarHBondContact O-N 3.24Å; E492-D494 PolarHBondContact O-N 2.89Å; E492-D494 VanDerWaalsContact O-N 3.17Å; D494-G496 PolarHBondContact O-N 3.01Å; D494-G496 VanDerWaalsContact O-N 3.1Å; D494-S497 PolarHBondContact O-N 3.46Å; D494-S497 PolarHBondContact O-OG 2.98Å
495C94.1Very high96Very high0 Ų030.3 Ų30.30%017%0.169CC..G310 helixtrans-62.4-12.5170.7-66.20000113.7L488 E492 S493 S497 T498 S499 L502 L529 V532L488-C495 HydrophobicContact CD2-CB 4.22Å; E492-C495 VanDerWaalsContact O-CB 3.26Å; E492-C495 WeakPolarHBondContact O-CB 3.26Å; E492-C495 PolarHBondContact O-N 3.36Å; S493-C495 PolarHBondContact O-N 3.34Å; C495-S497 PolarHBondContact O-N 3.16Å; C495-T498 CarbonylContact O-C 3.51Å; C495-T498 PolarHBondContact O-N 2.91Å; C495-T498 VanDerWaalsContact O-N 3.17Å; C495-T498 PolarHBondContact O-OG1 3.15Å; C495-S499 WeakPolarHBondContact O-CA 3.47Å; C495-S499 PolarHBondContact O-N 3.34Å; C495-L502 HydrophobicContact CB-CD1 3.84Å; C495-L529 HydrophobicContact CB-CD1 4.33Å; C495-V532 HydrophobicContact CB-CG2 4.46Å
496G92.8Very high96Very high17 Ų1728.2 Ų28.218%0.17516%0.158CC..G310 helixtrans-60.4-27.8176.500000114.4S493 D494S493-G496 PolarHBondContact O-N 3.12Å; S493-G496 VanDerWaalsContact O-N 3.12Å; D494-G496 PolarHBondContact O-N 3.01Å; D494-G496 VanDerWaalsContact O-N 3.1Å
497S93.3Very high96Very high87 Ų8726.7 Ų26.761%0.60815%0.148SC*.G310 helixtrans-76-26.1177.461.10000113.4D494 C495D494-S497 PolarHBondContact O-N 3.46Å; D494-S497 PolarHBondContact O-OG 2.98Å; C495-S497 PolarHBondContact O-N 3.16Å
498T96.5Very high96Very high0 Ų026.6 Ų26.60%015%0.148CC..SBendtrans-110.814.5-179.349.60000112.8L455 Q456 V459 C495 L500 Q501 L502L455-T498 HydrophobicContact CG-CG2 4.17Å; Q456-T498 HydrophobicContact CB-CG2 4.43Å; V459-T498 HydrophobicContact CB-CG2 4.18Å; V459-T498 HydrophobicContact CG2-CG2 4.31Å; C495-T498 CarbonylContact O-C 3.51Å; C495-T498 PolarHBondContact O-N 2.91Å; C495-T498 VanDerWaalsContact O-N 3.17Å; C495-T498 PolarHBondContact O-OG1 3.15Å; T498-L500 VanDerWaalsContact C-N 3.31Å; T498-L500 PolarHBondContact O-N 2.97Å; T498-Q501 PolarHBondContact O-N 3.43Å; T498-Q501 VanDerWaalsContact O-N 3.16Å; T498-Q501 PolarHBondContact O-OE1 3.06Å; T498-L502 WeakPolarHBondContact O-CG 3.34Å; T498-L502 PolarHBondContact O-N 3.23Å
499S97.2Very high96.1Very high1 Ų126.6 Ų26.61%0.00715%0.148CC..Hα-helixtrans-56.5-40.4-172.8171.70000113.1C495 L503 Q533 L540 H544C495-S499 WeakPolarHBondContact O-CA 3.47Å; C495-S499 PolarHBondContact O-N 3.34Å; S499-L503 VanDerWaalsContact O-CB 3.28Å; S499-L503 WeakPolarHBondContact O-CB 3.43Å; S499-L503 PolarHBondContact O-N 3.23Å; S499-Q533 PolarHBondContact OG-NE2 2.97Å; S499-Q533 PolarHBondContact OG-OE1 3.17Å; S499-L540 VanDerWaalsContact OG-CD1 3.28Å; S499-L540 WeakPolarHBondContact OG-CD1 3.48Å; S499-H544 WeakPolarHBondContact CB-NE2 3.27Å; S499-H544 PolarHBondContact OG-CD2 2.92Å; S499-H544 PolarHBondContact OG-NE2 3.34Å
500L97.7Very high96.1Very high26 Ų2621.5 Ų21.514%0.13612%0.124CC..Hα-helixtrans-60.9-51.5177.1175.466.5000111.4T498 L503 Q504 H544 Q547 L548T498-L500 VanDerWaalsContact C-N 3.31Å; T498-L500 PolarHBondContact O-N 2.97Å; L500-L503 WeakPolarHBondContact O-CB 3.34Å; L500-L503 PolarHBondContact O-N 2.9Å; L500-Q504 HydrophobicContact CD1-CG 4.48Å; L500-Q504 WeakPolarHBondContact O-CG 3.45Å; L500-Q504 PolarHBondContact O-N 2.73Å; L500-H544 HydrophobicContact CD1-CB 3.83Å; L500-Q547 HydrophobicContact CD1-CB 3.85Å; L500-Q547 HydrophobicContact CD2-CB 3.75Å; L500-Q547 HydrophobicContact CD2-CG 4.32Å; L500-Q547 HydrophobicContact CG-CB 4.48Å; L500-L548 HydrophobicContact CD1-CD2 3.92Å; L500-L548 HydrophobicContact CD1-CG 4.07Å
501Q98.2Very high96.2Very high35 Ų3519.2 Ų19.216%0.16412%0.115CC..Hα-helixtrans-66.8-39.8-176.3-62.995.6-44.400111.6V459 D460 V463 T498 L503 Q504 V505V459-Q501 HydrophobicContact CG1-CB 3.31Å; V459-Q501 HydrophobicContact CG1-CG 4.34Å; D460-Q501 PolarHBondContact OD1-NE2 2.78Å; V463-Q501 HydrophobicContact CB-CB 4.31Å; V463-Q501 HydrophobicContact CG1-CB 4.41Å; V463-Q501 HydrophobicContact CG1-CG 4.3Å; V463-Q501 HydrophobicContact CG2-CB 4.34Å; T498-Q501 PolarHBondContact O-N 3.43Å; T498-Q501 VanDerWaalsContact O-N 3.16Å; T498-Q501 PolarHBondContact O-OE1 3.06Å; Q501-L503 VanDerWaalsContact C-N 3.32Å; Q501-L503 PolarHBondContact O-N 3.01Å; Q501-Q504 WeakPolarHBondContact O-CB 3.34Å; Q501-Q504 PolarHBondContact O-N 3.31Å; Q501-V505 WeakPolarHBondContact O-CG2 3.48Å; Q501-V505 PolarHBondContact O-N 3.19Å
502L98.2Very high96.2Very high0 Ų019.7 Ų19.70%012%0.117CC..Hα-helixtrans-60.9-42.7173-70.5173.8000111.2V459 V484 L487 L488 C495 T498 Q504 V505 L506 L529V459-L502 HydrophobicContact CB-CD2 4.5Å; V459-L502 HydrophobicContact CG1-CD2 3.96Å; V459-L502 HydrophobicContact CG1-CG 4.02Å; V459-L502 HydrophobicContact CG2-CD2 3.65Å; V459-L502 HydrophobicContact CG2-CG 4.1Å; V484-L502 HydrophobicContact CG1-CD2 4.21Å; V484-L502 HydrophobicContact CG2-CD2 4.32Å; L487-L502 HydrophobicContact CD1-CD2 4.43Å; L488-L502 HydrophobicContact CD2-CD1 4.15Å; C495-L502 HydrophobicContact CB-CD1 3.84Å; T498-L502 WeakPolarHBondContact O-CG 3.34Å; T498-L502 PolarHBondContact O-N 3.23Å; L502-Q504 PolarHBondContact O-N 3.47Å; L502-V505 PolarHBondContact O-N 2.81Å; L502-L506 WeakPolarHBondContact O-CG 3.35Å; L502-L506 PolarHBondContact O-N 3.45Å; L502-L529 HydrophobicContact CB-CD1 4.4Å; L502-L529 HydrophobicContact CB-CD2 3.95Å; L502-L529 HydrophobicContact CD1-CD1 3.99Å
503L98.2Very high96.2Very high0 Ų016 Ų160%010%0.103CC..Hα-helixtrans-63.4-39.8175.1-177.458.9000111.9S499 L500 Q501 L506 V507 V526 L529 L540 Y541 H544 L548S499-L503 VanDerWaalsContact O-CB 3.28Å; S499-L503 WeakPolarHBondContact O-CB 3.43Å; S499-L503 PolarHBondContact O-N 3.23Å; L500-L503 WeakPolarHBondContact O-CB 3.34Å; L500-L503 PolarHBondContact O-N 2.9Å; Q501-L503 VanDerWaalsContact C-N 3.32Å; Q501-L503 PolarHBondContact O-N 3.01Å; L503-L506 PolarHBondContact O-N 3.01Å; L503-V507 HydrophobicContact CD1-CG2 4.22Å; L503-V507 HydrophobicContact CG-CG2 4.41Å; L503-V507 WeakPolarHBondContact O-CB 3.42Å; L503-V507 VanDerWaalsContact O-CG2 3.25Å; L503-V507 WeakPolarHBondContact O-CG2 3.49Å; L503-V507 PolarHBondContact O-N 2.95Å; L503-V526 HydrophobicContact CD1-CG1 3.95Å; L503-V526 HydrophobicContact CD1-CG2 4.2Å; L503-L529 HydrophobicContact CB-CD2 4.19Å; L503-L540 HydrophobicContact CD1-CD2 4.39Å; L503-L540 HydrophobicContact CD2-CG 4.32Å; L503-Y541 HydrophobicContact CD1-CE1 4.33Å; L503-Y541 HydrophobicContact CD2-CD1 4.38Å; L503-Y541 HydrophobicContact CD2-CE1 4.31Å; L503-H544 HydrophobicContact CD2-CB 4.26Å; L503-L548 HydrophobicContact CD2-CD1 3.87Å; L503-L548 HydrophobicContact CG-CD1 4.48Å
504Q98.2Very high96.1Very high17 Ų1718.2 Ų18.28%0.07911%0.113CC..Hα-helixtrans-61.5-43175-73.8171.8-41.400112.1V463 L500 Q501 L502 T508 L548 W551V463-Q504 HydrophobicContact CG2-CB 3.83Å; L500-Q504 HydrophobicContact CD1-CG 4.48Å; L500-Q504 WeakPolarHBondContact O-CG 3.45Å; L500-Q504 PolarHBondContact O-N 2.73Å; Q501-Q504 WeakPolarHBondContact O-CB 3.34Å; Q501-Q504 PolarHBondContact O-N 3.31Å; L502-Q504 PolarHBondContact O-N 3.47Å; Q504-T508 WeakPolarHBondContact O-CB 3.45Å; Q504-T508 PolarHBondContact O-N 2.76Å; Q504-T508 PolarHBondContact O-OG1 3.34Å; Q504-L548 HydrophobicContact CG-CD2 3.73Å; Q504-W551 HydrophobicContact CB-CH2 4.37Å; Q504-W551 HydrophobicContact CG-CD2 4.25Å; Q504-W551 HydrophobicContact CG-CE3 4.1Å; Q504-W551 HydrophobicContact CG-CH2 4.4Å; Q504-W551 HydrophobicContact CG-CZ3 4.18Å
505V98.2Very high96Very high0 Ų018.8 Ų18.80%012%0.116CC..Hα-helixtrans-62.9-47.2175.2175.10000110.6L462 V463 L480 V484 Q501 L502 V507 T508 I509L462-V505 HydrophobicContact CB-CG2 4.12Å; V463-V505 HydrophobicContact CB-CG2 4.07Å; V463-V505 HydrophobicContact CG2-CG2 4.29Å; L480-V505 HydrophobicContact CD1-CG1 4.16Å; L480-V505 HydrophobicContact CD2-CG1 4.01Å; L480-V505 HydrophobicContact CG-CG1 3.86Å; V484-V505 HydrophobicContact CG2-CB 4.37Å; V484-V505 HydrophobicContact CG2-CG1 3.73Å; Q501-V505 WeakPolarHBondContact O-CG2 3.48Å; Q501-V505 PolarHBondContact O-N 3.19Å; L502-V505 PolarHBondContact O-N 2.81Å; V505-V507 PolarHBondContact O-N 2.88Å; V505-T508 WeakPolarHBondContact O-CB 3.44Å; V505-T508 PolarHBondContact O-N 3.15Å; V505-T508 VanDerWaalsContact O-N 3.11Å; V505-I509 HydrophobicContact CG1-CD1 3.91Å; V505-I509 HydrophobicContact CG1-CG1 4.49Å; V505-I509 WeakPolarHBondContact O-CG1 3.32Å; V505-I509 PolarHBondContact O-N 2.98Å
506L98.3Very high95.9Very high0 Ų023.7 Ų23.70%015%0.148CC..Hα-helixtrans-63.9-40.1179.2-71.1170.5000113.2L481 V484 L502 L503 T508 I509 Q510 V526 L529L481-L506 HydrophobicContact CD1-CD2 3.53Å; V484-L506 HydrophobicContact CB-CD2 4.46Å; V484-L506 HydrophobicContact CG1-CD1 4.14Å; V484-L506 HydrophobicContact CG1-CD2 3.87Å; V484-L506 HydrophobicContact CG1-CG 4.03Å; L502-L506 WeakPolarHBondContact O-CG 3.35Å; L502-L506 PolarHBondContact O-N 3.45Å; L503-L506 PolarHBondContact O-N 3.01Å; L506-T508 VanDerWaalsContact C-N 3.29Å; L506-I509 HydrophobicContact CD2-CD1 4.49Å; L506-I509 PolarHBondContact O-N 3.45Å; L506-Q510 WeakPolarHBondContact O-CG 3.38Å; L506-Q510 PolarHBondContact O-N 3.36Å; L506-Q510 PolarHBondContact O-NE2 3.43Å; L506-V526 HydrophobicContact CB-CG2 3.73Å; L506-V526 HydrophobicContact CD1-CB 4.41Å; L506-V526 HydrophobicContact CD1-CG2 3.69Å; L506-V526 HydrophobicContact CG-CG2 4.26Å; L506-L529 HydrophobicContact CD1-CD2 4.27Å
507V97.7Very high96Very high0 Ų029.5 Ų29.50%017%0.171CC..Hα-helixtrans-61.5-41.5172.3164.60000110.2L503 V505 Q510 S511 Q568 I571 V572L503-V507 HydrophobicContact CD1-CG2 4.22Å; L503-V507 HydrophobicContact CG-CG2 4.41Å; L503-V507 WeakPolarHBondContact O-CB 3.42Å; L503-V507 VanDerWaalsContact O-CG2 3.25Å; L503-V507 WeakPolarHBondContact O-CG2 3.49Å; L503-V507 PolarHBondContact O-N 2.95Å; V505-V507 PolarHBondContact O-N 2.88Å; V507-Q510 PolarHBondContact O-N 3.28Å; V507-S511 VanDerWaalsContact O-CB 3.26Å; V507-S511 WeakPolarHBondContact O-CB 3.35Å; V507-S511 PolarHBondContact O-N 2.94Å; V507-S511 PolarHBondContact O-OG 2.95Å; V507-Q568 HydrophobicContact CG1-CB 3.94Å; V507-Q568 HydrophobicContact CG1-CG 4.18Å; V507-I571 HydrophobicContact CB-CG2 4.47Å; V507-I571 HydrophobicContact CG1-CB 4.26Å; V507-I571 HydrophobicContact CG1-CG2 4.17Å; V507-I571 HydrophobicContact CG2-CG2 4.25Å; V507-V572 HydrophobicContact CG1-CG2 3.87Å; V507-V572 HydrophobicContact CG2-CG2 4.19Å
508T97.1Very high96.1Very high0 Ų025.4 Ų25.40%014%0.142CC..Hα-helixtrans-64.9-46.3178.7-57.40000111.5C468 Q469 Q504 V505 L506 Q510 S511 L512 Q568C468-T508 HydrophobicContact CB-CG2 4.12Å; C468-T508 WeakPolarHBondContact O-CG2 3.2Å; Q469-T508 HydrophobicContact CG-CG2 3.71Å; Q504-T508 WeakPolarHBondContact O-CB 3.45Å; Q504-T508 PolarHBondContact O-N 2.76Å; Q504-T508 PolarHBondContact O-OG1 3.34Å; V505-T508 WeakPolarHBondContact O-CB 3.44Å; V505-T508 PolarHBondContact O-N 3.15Å; V505-T508 VanDerWaalsContact O-N 3.11Å; L506-T508 VanDerWaalsContact C-N 3.29Å; T508-Q510 PolarHBondContact O-N 2.91Å; T508-S511 WeakPolarHBondContact CA-OG 3.24Å; T508-S511 PolarHBondContact O-N 3.4Å; T508-S511 VanDerWaalsContact O-N 3.11Å; T508-S511 PolarHBondContact O-OG 2.73Å; T508-L512 HydrophobicContact CG2-CD1 3.88Å; T508-L512 HydrophobicContact CG2-CG 4.35Å; T508-L512 WeakPolarHBondContact O-CG 3.36Å; T508-L512 PolarHBondContact O-N 3.14Å; T508-Q568 PolarHBondContact OG1-NE2 2.68Å
509I97.4Very high96Very high0 Ų027.1 Ų27.10%015%0.154CC..Hα-helixtrans-56.9-49.1175.2-66.9161.8000110.8L477 L480 L481 V505 L506 S511 L512 S513 L518 A522L477-I509 HydrophobicContact CB-CG2 4.42Å; L480-I509 HydrophobicContact CB-CD1 4.29Å; L480-I509 HydrophobicContact CD2-CD1 4.2Å; L480-I509 HydrophobicContact CD2-CG1 3.89Å; L480-I509 HydrophobicContact CG-CD1 4.01Å; L480-I509 HydrophobicContact CG-CG1 4.25Å; L481-I509 HydrophobicContact CB-CD1 4.03Å; L481-I509 HydrophobicContact CD1-CD1 4.16Å; V505-I509 HydrophobicContact CG1-CD1 3.91Å; V505-I509 HydrophobicContact CG1-CG1 4.49Å; V505-I509 WeakPolarHBondContact O-CG1 3.32Å; V505-I509 PolarHBondContact O-N 2.98Å; L506-I509 HydrophobicContact CD2-CD1 4.49Å; L506-I509 PolarHBondContact O-N 3.45Å; I509-S511 VanDerWaalsContact C-N 3.27Å; I509-S511 PolarHBondContact O-N 3.42Å; I509-L512 PolarHBondContact O-N 2.92Å; I509-S513 VanDerWaalsContact O-CB 3.32Å; I509-S513 WeakPolarHBondContact O-CB 3.47Å; I509-S513 PolarHBondContact O-N 3.45Å; I509-L518 HydrophobicContact CG2-CG 4.41Å; I509-A522 HydrophobicContact CB-CB 4.45Å; I509-A522 HydrophobicContact CG2-CB 3.88Å
510Q96.3Very high95.9Very high8 Ų829.3 Ų29.34%0.03717%0.172CC..Hα-helixtrans-61.3-36.7177.5-75.2177.969.500112.4L506 V507 T508 A522 I571L506-Q510 WeakPolarHBondContact O-CG 3.38Å; L506-Q510 PolarHBondContact O-N 3.36Å; L506-Q510 PolarHBondContact O-NE2 3.43Å; V507-Q510 PolarHBondContact O-N 3.28Å; T508-Q510 PolarHBondContact O-N 2.91Å; Q510-A522 HydrophobicContact CG-CB 3.58Å; Q510-I571 HydrophobicContact CB-CD1 4.16Å; Q510-I571 HydrophobicContact CB-CG1 4.17Å; Q510-I571 HydrophobicContact CB-CG2 4.12Å
511S94.8Very high95.9Very high12 Ų1233 Ų338%0.08419%0.187CC..Hα-helixtrans-72.5-32.7-17876.10000113.4V507 T508 I509 L567 Q568V507-S511 VanDerWaalsContact O-CB 3.26Å; V507-S511 WeakPolarHBondContact O-CB 3.35Å; V507-S511 PolarHBondContact O-N 2.94Å; V507-S511 PolarHBondContact O-OG 2.95Å; T508-S511 WeakPolarHBondContact CA-OG 3.24Å; T508-S511 PolarHBondContact O-N 3.4Å; T508-S511 VanDerWaalsContact O-N 3.11Å; T508-S511 PolarHBondContact O-OG 2.73Å; I509-S511 VanDerWaalsContact C-N 3.27Å; I509-S511 PolarHBondContact O-N 3.42Å; S511-L567 WeakPolarHBondContact O-CD1 3.38Å; S511-Q568 WeakPolarHBondContact OG-CG 3.37Å
512L94.9Very high95.8Very high9 Ų931.3 Ų31.35%0.04718%0.179CC..Hα-helixtrans-96.7-14.5-177-64.8-177.2000113.5Q472 L477 T508 I509 T514 P564Q472-L512 HydrophobicContact CG-CD2 4.31Å; L477-L512 HydrophobicContact CD1-CB 3.93Å; L477-L512 HydrophobicContact CD2-CB 4.37Å; T508-L512 HydrophobicContact CG2-CD1 3.88Å; T508-L512 HydrophobicContact CG2-CG 4.35Å; T508-L512 WeakPolarHBondContact O-CG 3.36Å; T508-L512 PolarHBondContact O-N 3.14Å; I509-L512 PolarHBondContact O-N 2.92Å; L512-T514 PolarHBondContact O-N 2.86Å; L512-P564 HydrophobicContact CD2-CB 3.86Å
513S93.8Very high95.7Very high22 Ų2233.4 Ų33.415%0.15419%0.19CC..  trans-68.3125.9-179.6-172.50000111.9I509 D515I509-S513 VanDerWaalsContact O-CB 3.32Å; I509-S513 WeakPolarHBondContact O-CB 3.47Å; I509-S513 PolarHBondContact O-N 3.45Å; S513-D515 PolarHBondContact OG-N 3.48Å; S513-D515 PolarHBondContact OG-O 3.14Å
514T90.8Very high95.7Very high118 Ų11839.7 Ų39.772%0.72422%0.22SC*.  trans-89.6-14.3167.555.30000112.6L512L512-T514 PolarHBondContact O-N 2.86Å
515D91.8Very high95.7Very high43 Ų4339.1 Ų39.123%0.2322%0.218CC..  trans-92.7120.5176.7174.823.1000111V474 S513 Q517 L518 S519V474-D515 HydrophobicContact CG1-CB 4.46Å; S513-D515 PolarHBondContact OG-N 3.48Å; S513-D515 PolarHBondContact OG-O 3.14Å; D515-Q517 VanDerWaalsContact C-N 3.26Å; D515-Q517 PolarHBondContact O-N 3.37Å; D515-Q517 PolarHBondContact OD1-N 2.72Å; D515-L518 HydrophobicContact CB-CB 4.17Å; D515-L518 PolarHBondContact O-N 3.24Å; D515-L518 PolarHBondContact OD2-N 3.27Å; D515-S519 PolarHBondContact O-N 3.29Å
516P92.1Very high95.7Very high102 Ų10239.1 Ų39.166%0.66222%0.218SC*.Hα-helixtrans-59.4-32.1174.9-24.334.4000114S519 A520P516-S519 PolarHBondContact O-N 3.08Å; P516-A520 PolarHBondContact O-N 3.4Å
517Q95.1Very high95.6Very high139 Ų13942.7 Ų42.765%0.6523%0.234SC*.Hα-helixtrans-70.1-43.9-178.9-62-172.9-2.100111.4D515 S519 A520 K521D515-Q517 VanDerWaalsContact C-N 3.26Å; D515-Q517 PolarHBondContact O-N 3.37Å; D515-Q517 PolarHBondContact OD1-N 2.72Å; Q517-S519 VanDerWaalsContact C-N 3.32Å; Q517-S519 PolarHBondContact O-N 2.8Å; Q517-A520 PolarHBondContact O-N 2.92Å; Q517-K521 WeakPolarHBondContact O-CG 3.44Å; Q517-K521 PolarHBondContact O-N 2.99Å
518L95.5Very high95.6Very high2 Ų245.4 Ų45.41%0.0125%0.246CC..Hα-helixtrans-61.5-40.6173.9179.159.3000112.2V474 L477 E478 L481 I509 D515 A520 K521 A522V474-L518 HydrophobicContact CG1-CD2 4.25Å; L477-L518 HydrophobicContact CB-CD2 3.61Å; L477-L518 HydrophobicContact CD1-CD2 4.44Å; E478-L518 HydrophobicContact CG-CD1 3.94Å; E478-L518 HydrophobicContact CG-CD2 4.2Å; L481-L518 HydrophobicContact CD2-CD1 3.68Å; I509-L518 HydrophobicContact CG2-CG 4.41Å; D515-L518 HydrophobicContact CB-CB 4.17Å; D515-L518 PolarHBondContact O-N 3.24Å; D515-L518 PolarHBondContact OD2-N 3.27Å; L518-A520 VanDerWaalsContact C-N 3.34Å; L518-A520 PolarHBondContact O-N 3.08Å; L518-K521 PolarHBondContact O-N 3.5Å; L518-A522 PolarHBondContact O-N 3.22Å
519S94.1Very high95.6Very high35 Ų3545.4 Ų45.425%0.24525%0.246CC..Hα-helixtrans-61.2-42.2175.4-169.40000111.8D515 P516 Q517 A522 L523D515-S519 PolarHBondContact O-N 3.29Å; P516-S519 PolarHBondContact O-N 3.08Å; Q517-S519 VanDerWaalsContact C-N 3.32Å; Q517-S519 PolarHBondContact O-N 2.8Å; S519-A522 PolarHBondContact O-N 3.11Å; S519-L523 PolarHBondContact O-N 2.97Å
520A95.6Very high95.6Very high48 Ų4845.6 Ų45.640%0.39725%0.247SC..Hα-helixtrans-62.7-44.5175.300000112.5P516 Q517 L518 A522 L523 E524P516-A520 PolarHBondContact O-N 3.4Å; Q517-A520 PolarHBondContact O-N 2.92Å; L518-A520 VanDerWaalsContact C-N 3.34Å; L518-A520 PolarHBondContact O-N 3.08Å; A520-A522 PolarHBondContact O-N 2.87Å; A520-L523 WeakPolarHBondContact O-CB 3.29Å; A520-L523 PolarHBondContact O-N 3.33Å; A520-E524 WeakPolarHBondContact O-CG 3.37Å; A520-E524 PolarHBondContact O-N 3.11Å
521K97.2Very high95.6Very high103 Ų10352.4 Ų52.445%0.44828%0.277SS..Hα-helixtrans-62.4-40.6175.6-71176.3178.8174.40112.5L481 Q517 L518 L523 E524 S525L481-K521 HydrophobicContact CD2-CB 3.78Å; Q517-K521 WeakPolarHBondContact O-CG 3.44Å; Q517-K521 PolarHBondContact O-N 2.99Å; L518-K521 PolarHBondContact O-N 3.5Å; K521-L523 VanDerWaalsContact C-N 3.3Å; K521-L523 PolarHBondContact O-N 3.24Å; K521-E524 WeakPolarHBondContact O-CB 3.46Å; K521-E524 PolarHBondContact O-N 2.84Å; K521-S525 PolarHBondContact O-N 3.46Å; K521-S525 PolarHBondContact O-OG 2.96Å
522A97.3Very high95.6Very high0 Ų053 Ų530%028%0.279CS..Hα-helixtrans-63.5-38.4175.400000111.4L481 I509 Q510 L518 S519 A520 S525 V526L481-A522 HydrophobicContact CD1-CB 4.18Å; L481-A522 HydrophobicContact CD2-CB 4.36Å; I509-A522 HydrophobicContact CB-CB 4.45Å; I509-A522 HydrophobicContact CG2-CB 3.88Å; Q510-A522 HydrophobicContact CG-CB 3.58Å; L518-A522 PolarHBondContact O-N 3.22Å; S519-A522 PolarHBondContact O-N 3.11Å; A520-A522 PolarHBondContact O-N 2.87Å; A522-S525 WeakPolarHBondContact O-CB 3.46Å; A522-S525 PolarHBondContact O-N 3.18Å; A522-V526 WeakPolarHBondContact O-CG2 3.35Å; A522-V526 PolarHBondContact O-N 2.95Å
523L96.3Very high95.6Very high44 Ų4454.1 Ų54.123%0.2329%0.285CS..Hα-helixtrans-65.6-41172.5-17861.6000112.2S519 A520 K521 S525 V526 H527S519-L523 PolarHBondContact O-N 2.97Å; A520-L523 WeakPolarHBondContact O-CB 3.29Å; A520-L523 PolarHBondContact O-N 3.33Å; K521-L523 VanDerWaalsContact C-N 3.3Å; K521-L523 PolarHBondContact O-N 3.24Å; L523-S525 PolarHBondContact O-N 3.38Å; L523-V526 WeakPolarHBondContact O-CB 3.34Å; L523-V526 PolarHBondContact O-N 3.43Å; L523-V526 VanDerWaalsContact O-N 3.14Å; L523-H527 PolarHBondContact O-N 3.46Å; L523-H527 PolarHBondContact O-ND1 3.45Å
524E97.4Very high95.6Very high132 Ų13256.4 Ų56.462%0.61731%0.312SS*.Hα-helixtrans-58-37.4172.2-71.9174-176.500111.7A520 K521 H527 F528A520-E524 WeakPolarHBondContact O-CG 3.37Å; A520-E524 PolarHBondContact O-N 3.11Å; K521-E524 WeakPolarHBondContact O-CB 3.46Å; K521-E524 PolarHBondContact O-N 2.84Å; E524-H527 CarbonylContact O-C 3.46Å; E524-H527 WeakPolarHBondContact O-CB 3.32Å; E524-H527 PolarHBondContact O-N 3.48Å; E524-F528 PolarHBondContact O-N 3.24Å
525S97.9Very high95.8Very high5 Ų553 Ų534%0.03529%0.289CS..Hα-helixtrans-69.1-34.9176.2-51.10000112.3L481 D485 K521 A522 L523 H527 F528 L529L481-S525 WeakPolarHBondContact CD1-OG 3.4Å; D485-S525 PolarHBondContact OD1-OG 3.31Å; K521-S525 PolarHBondContact O-N 3.46Å; K521-S525 PolarHBondContact O-OG 2.96Å; A522-S525 WeakPolarHBondContact O-CB 3.46Å; A522-S525 PolarHBondContact O-N 3.18Å; L523-S525 PolarHBondContact O-N 3.38Å; S525-H527 VanDerWaalsContact C-N 3.35Å; S525-F528 PolarHBondContact O-N 3.43Å; S525-L529 WeakPolarHBondContact O-CB 3.41Å; S525-L529 PolarHBondContact O-N 3.34Å
526V97.8Very high95.9Very high0 Ų054.3 Ų54.30%030%0.296CS..Hα-helixtrans-63.1-43.1170.1178.40000110.4L503 L506 A522 L523 F528 L529 S530 L537 L540L503-V526 HydrophobicContact CD1-CG1 3.95Å; L503-V526 HydrophobicContact CD1-CG2 4.2Å; L506-V526 HydrophobicContact CB-CG2 3.73Å; L506-V526 HydrophobicContact CD1-CB 4.41Å; L506-V526 HydrophobicContact CD1-CG2 3.69Å; L506-V526 HydrophobicContact CG-CG2 4.26Å; A522-V526 WeakPolarHBondContact O-CG2 3.35Å; A522-V526 PolarHBondContact O-N 2.95Å; L523-V526 WeakPolarHBondContact O-CB 3.34Å; L523-V526 PolarHBondContact O-N 3.43Å; L523-V526 VanDerWaalsContact O-N 3.14Å; V526-F528 VanDerWaalsContact C-N 3.3Å; V526-F528 PolarHBondContact O-N 3.28Å; V526-L529 PolarHBondContact O-N 3.02Å; V526-S530 PolarHBondContact O-N 3.26Å; V526-L537 HydrophobicContact CG1-CD1 3.5Å; V526-L540 HydrophobicContact CG1-CD2 3.89Å
527H97.1Very high96Very high74 Ų7451 Ų5134%0.34327%0.273SS..Hα-helixtrans-61.6-41.5174.1-71.382.4000110.9L523 E524 S525 S530 K531L523-H527 PolarHBondContact O-N 3.46Å; L523-H527 PolarHBondContact O-ND1 3.45Å; E524-H527 CarbonylContact O-C 3.46Å; E524-H527 WeakPolarHBondContact O-CB 3.32Å; E524-H527 PolarHBondContact O-N 3.48Å; S525-H527 VanDerWaalsContact C-N 3.35Å; H527-S530 PolarHBondContact O-N 3.22Å; H527-S530 PolarHBondContact O-OG 3.31Å; H527-K531 WeakPolarHBondContact O-CG 3.46Å; H527-K531 PolarHBondContact O-N 3.24Å
528F97.6Very high96.1Very high58 Ų5847.2 Ų47.225%0.25426%0.256SS..Hα-helixtrans-65.3-41.3177-170.6-138.6000112L488 H489 E524 S525 V526 S530 K531 V532L488-F528 HydrophobicContact CB-CD1 3.51Å; L488-F528 HydrophobicContact CB-CE1 3.49Å; L488-F528 VanDerWaalsContact CB-CE1 3.49Å; L488-F528 HydrophobicContact CD1-CB 4.39Å; L488-F528 HydrophobicContact CD1-CD1 3.83Å; L488-F528 HydrophobicContact CG-CD1 4.28Å; H489-F528 AromaticContact CD2-CE1 3.91Å; H489-F528 AromaticContact CE1-CD1 3.99Å; H489-F528 AromaticContact CE1-CE1 3.49Å; H489-F528 VanDerWaalsContact CE1-CE1 3.49Å; H489-F528 WeakPolarHBondContact CE1-CE1 3.47Å; H489-F528 AromaticContact CG-CE1 3.79Å; H489-F528 AromaticContact ND1-CE1 3.53Å; H489-F528 AromaticContact NE2-CE1 3.74Å; E524-F528 PolarHBondContact O-N 3.24Å; S525-F528 PolarHBondContact O-N 3.43Å; V526-F528 VanDerWaalsContact C-N 3.3Å; V526-F528 PolarHBondContact O-N 3.28Å; F528-S530 VanDerWaalsContact C-N 3.3Å; F528-S530 PolarHBondContact O-N 2.97Å; F528-K531 PolarHBondContact O-N 3.22Å; F528-K531 VanDerWaalsContact O-N 3.12Å; F528-V532 HydrophobicContact CD2-CG1 3.91Å; F528-V532 HydrophobicContact CE1-CG1 4.24Å; F528-V532 HydrophobicContact CE2-CG1 3.51Å; F528-V532 HydrophobicContact CG-CG1 4.41Å; F528-V532 HydrophobicContact CZ-CG1 3.69Å; F528-V532 WeakPolarHBondContact O-CG1 3.42Å; F528-V532 PolarHBondContact O-N 3.17Å
529L97.6Very high96.1Very high0 Ų051 Ų510%027%0.274CS..Hα-helixtrans-57.6-39.5172.9175.661.4000112.5L488 C495 L502 L503 L506 S525 V526 V532 Q533 L540L488-L529 HydrophobicContact CD1-CB 4.33Å; L488-L529 HydrophobicContact CD2-CB 3.95Å; L488-L529 HydrophobicContact CD2-CD1 3.66Å; L488-L529 HydrophobicContact CD2-CG 4.38Å; C495-L529 HydrophobicContact CB-CD1 4.33Å; L502-L529 HydrophobicContact CB-CD1 4.4Å; L502-L529 HydrophobicContact CB-CD2 3.95Å; L502-L529 HydrophobicContact CD1-CD1 3.99Å; L503-L529 HydrophobicContact CB-CD2 4.19Å; L506-L529 HydrophobicContact CD1-CD2 4.27Å; S525-L529 WeakPolarHBondContact O-CB 3.41Å; S525-L529 PolarHBondContact O-N 3.34Å; V526-L529 PolarHBondContact O-N 3.02Å; L529-V532 WeakPolarHBondContact O-CG2 3.23Å; L529-Q533 WeakPolarHBondContact O-CG 3.47Å; L529-Q533 PolarHBondContact O-NE2 3.49Å; L529-L540 HydrophobicContact CD2-CD2 4.23Å; L529-L540 HydrophobicContact CG-CD1 4.44Å; L529-L540 HydrophobicContact CG-CD2 4.26Å
530S96.6Very high96.2Very high4 Ų449.3 Ų49.33%0.02826%0.262CS..Hα-helixtrans-65.8-46.5173.567.10000111.7V526 H527 F528 V532 Q533 G534 L535V526-S530 PolarHBondContact O-N 3.26Å; H527-S530 PolarHBondContact O-N 3.22Å; H527-S530 PolarHBondContact O-OG 3.31Å; F528-S530 VanDerWaalsContact C-N 3.3Å; F528-S530 PolarHBondContact O-N 2.97Å; S530-V532 PolarHBondContact O-N 3.26Å; S530-Q533 PolarHBondContact O-N 2.62Å; S530-Q533 VanDerWaalsContact O-N 3.16Å; S530-G534 PolarHBondContact O-N 3.31Å; S530-L535 CarbonylContact C-O 3.56Å; S530-L535 VanDerWaalsContact C-O 3.28Å; S530-L535 WeakPolarHBondContact CB-O 3.2Å; S530-L535 PolarHBondContact O-N 3.16Å
531K96.1Very high96.3Very high151 Ų15147 Ų4766%0.65724%0.243SC*.Hα-helixtrans-61.6-44-179.2-74.3176.9-179.2178.60113.4H527 F528 Q533 G534H527-K531 WeakPolarHBondContact O-CG 3.46Å; H527-K531 PolarHBondContact O-N 3.24Å; F528-K531 PolarHBondContact O-N 3.22Å; F528-K531 VanDerWaalsContact O-N 3.12Å; K531-Q533 PolarHBondContact O-N 3.22Å; K531-G534 PolarHBondContact O-N 2.99Å
532V95.4Very high96.3Very high23 Ų2346.2 Ų46.214%0.13924%0.237CC..Hα-helixtrans-65.2-20.2-179.8-620000112.6L488 S493 C495 F528 L529 S530L488-V532 HydrophobicContact CD2-CG2 4.3Å; S493-V532 VanDerWaalsContact CA-O 3.27Å; S493-V532 WeakPolarHBondContact CA-O 3.36Å; C495-V532 HydrophobicContact CB-CG2 4.46Å; F528-V532 HydrophobicContact CD2-CG1 3.91Å; F528-V532 HydrophobicContact CE1-CG1 4.24Å; F528-V532 HydrophobicContact CE2-CG1 3.51Å; F528-V532 HydrophobicContact CG-CG1 4.41Å; F528-V532 HydrophobicContact CZ-CG1 3.69Å; F528-V532 WeakPolarHBondContact O-CG1 3.42Å; F528-V532 PolarHBondContact O-N 3.17Å; L529-V532 WeakPolarHBondContact O-CG2 3.23Å; S530-V532 PolarHBondContact O-N 3.26Å
533Q95.1Very high96.2Very high34 Ų3452.8 Ų52.816%0.15926%0.262CS..THydrogen-bonded Turntrans-93.7-4174.1-64.1179.779.200113.5S499 L529 S530 K531 L535 R543S499-Q533 PolarHBondContact OG-NE2 2.97Å; S499-Q533 PolarHBondContact OG-OE1 3.17Å; L529-Q533 WeakPolarHBondContact O-CG 3.47Å; L529-Q533 PolarHBondContact O-NE2 3.49Å; S530-Q533 PolarHBondContact O-N 2.62Å; S530-Q533 VanDerWaalsContact O-N 3.16Å; K531-Q533 PolarHBondContact O-N 3.22Å; Q533-L535 VanDerWaalsContact C-N 3.3Å; Q533-L535 HydrophobicContact CB-CD1 4.02Å; Q533-L535 HydrophobicContact CB-CG 3.95Å; Q533-R543 VanDerWaalsContact OE1-NH1 3.1Å
534G94.1Very high96.3Very high70 Ų7051.2 Ų51.272%0.72225%0.254SS*.THydrogen-bonded Turntrans68.526.9-17300000113.8S530 K531S530-G534 PolarHBondContact O-N 3.31Å; K531-G534 PolarHBondContact O-N 2.99Å
535L94.8Very high96.3Very high47 Ų4745 Ų4525%0.24623%0.225CC..  trans-106.7153.9178.1-58.2176.9000110.6S530 Q533 E539 L540S530-L535 CarbonylContact C-O 3.56Å; S530-L535 VanDerWaalsContact C-O 3.28Å; S530-L535 WeakPolarHBondContact CB-O 3.2Å; S530-L535 PolarHBondContact O-N 3.16Å; Q533-L535 VanDerWaalsContact C-N 3.3Å; Q533-L535 HydrophobicContact CB-CD1 4.02Å; Q533-L535 HydrophobicContact CB-CG 3.95Å; L535-E539 HydrophobicContact CB-CB 4.27Å; L535-E539 HydrophobicContact CD2-CB 4.43Å; L535-L540 HydrophobicContact CD1-CD1 4.48Å
536D94.4Very high96.3Very high70 Ų7045.3 Ų45.337%0.37423%0.229SC..  trans-77.7171.2159.384.115.9000111.5L538 E539 L540D536-L538 VanDerWaalsContact C-N 3.33Å; D536-L538 PolarHBondContact O-N 2.6Å; D536-L538 WeakPolarHBondContact OD1-CA 3.25Å; D536-L538 PolarHBondContact OD1-N 2.91Å; D536-E539 WeakPolarHBondContact CB-OE2 3.31Å; D536-E539 PolarHBondContact N-OE2 3.43Å; D536-E539 PolarHBondContact O-N 3.48Å; D536-E539 VanDerWaalsContact OD1-CB 3.26Å; D536-E539 WeakPolarHBondContact OD1-CB 3.27Å; D536-E539 VanDerWaalsContact OD1-CG 3.22Å; D536-E539 WeakPolarHBondContact OD1-CG 3.35Å; D536-E539 PolarHBondContact OD1-N 3.02Å; D536-L540 PolarHBondContact O-N 3.39Å
537L94.3Very high96.3Very high33 Ų3349.9 Ų49.917%0.17325%0.25CS..Hα-helixtrans-63.4-39.1-179.2-177.965.3000112.3V526 L540 Y541V526-L537 HydrophobicContact CG1-CD1 3.5Å; L537-L540 PolarHBondContact O-N 3.39Å; L537-Y541 HydrophobicContact CD1-CD2 4.16Å; L537-Y541 HydrophobicContact CD1-CE2 3.83Å; L537-Y541 HydrophobicContact CG-CD2 4.19Å; L537-Y541 HydrophobicContact CG-CE2 4.17Å; L537-Y541 WeakPolarHBondContact O-CD2 3.3Å; L537-Y541 PolarHBondContact O-N 3.43Å; L537-Y541 VanDerWaalsContact O-N 3.15Å
538L95.3Very high96.3Very high58 Ų5846.4 Ų46.430%0.30423%0.234SC..Hα-helixtrans-71.5-35.4-177.2-62.7-180000111D536 Y541 R542 P578 V579D536-L538 VanDerWaalsContact C-N 3.33Å; D536-L538 PolarHBondContact O-N 2.6Å; D536-L538 WeakPolarHBondContact OD1-CA 3.25Å; D536-L538 PolarHBondContact OD1-N 2.91Å; L538-Y541 PolarHBondContact O-N 2.85Å; L538-R542 VanDerWaalsContact O-CB 3.24Å; L538-R542 WeakPolarHBondContact O-CB 2.89Å; L538-R542 PolarHBondContact O-N 2.98Å; L538-P578 HydrophobicContact CD1-CG 4.2Å; L538-P578 HydrophobicContact CD2-CG 4.49Å; L538-V579 HydrophobicContact CB-CG2 4.06Å; L538-V579 HydrophobicContact CD2-CG2 4.27Å; L538-V579 WeakPolarHBondContact O-CG2 3.33Å
539E96.1Very high96.3Very high82 Ų8243.7 Ų43.738%0.38322%0.222SC..Hα-helixtrans-69.8-37.8176.4-73.8149.3176.800111.2L535 D536 R542 R543L535-E539 HydrophobicContact CB-CB 4.27Å; L535-E539 HydrophobicContact CD2-CB 4.43Å; D536-E539 WeakPolarHBondContact CB-OE2 3.31Å; D536-E539 PolarHBondContact N-OE2 3.43Å; D536-E539 PolarHBondContact O-N 3.48Å; D536-E539 VanDerWaalsContact OD1-CB 3.26Å; D536-E539 WeakPolarHBondContact OD1-CB 3.27Å; D536-E539 VanDerWaalsContact OD1-CG 3.22Å; D536-E539 WeakPolarHBondContact OD1-CG 3.35Å; D536-E539 PolarHBondContact OD1-N 3.02Å; E539-R542 PolarHBondContact O-N 3.46Å; E539-R543 VanDerWaalsContact O-CB 3.24Å; E539-R543 WeakPolarHBondContact O-CB 3.42Å; E539-R543 PolarHBondContact O-N 3.21Å
540L96.9Very high96.3Very high0 Ų048.3 Ų48.30%025%0.247CC..Hα-helixtrans-58.6-50.7170.3-179.968.5000110.9S499 L503 V526 L529 L535 D536 L537 R543 H544S499-L540 VanDerWaalsContact OG-CD1 3.28Å; S499-L540 WeakPolarHBondContact OG-CD1 3.48Å; L503-L540 HydrophobicContact CD1-CD2 4.39Å; L503-L540 HydrophobicContact CD2-CG 4.32Å; V526-L540 HydrophobicContact CG1-CD2 3.89Å; L529-L540 HydrophobicContact CD2-CD2 4.23Å; L529-L540 HydrophobicContact CG-CD1 4.44Å; L529-L540 HydrophobicContact CG-CD2 4.26Å; L535-L540 HydrophobicContact CD1-CD1 4.48Å; D536-L540 PolarHBondContact O-N 3.39Å; L537-L540 PolarHBondContact O-N 3.39Å; L540-R543 PolarHBondContact O-N 3.08Å; L540-H544 PolarHBondContact O-CD2 3.37Å; L540-H544 PolarHBondContact O-N 2.97Å
541Y97.4Very high96.2Very high0 Ų051 Ų510%026%0.257CS..Hα-helixtrans-63.9-44.1176.3-83.5-71000111.7L503 L537 L538 R543 H544 M545 L548 Q575L503-Y541 HydrophobicContact CD1-CE1 4.33Å; L503-Y541 HydrophobicContact CD2-CD1 4.38Å; L503-Y541 HydrophobicContact CD2-CE1 4.31Å; L537-Y541 HydrophobicContact CD1-CD2 4.16Å; L537-Y541 HydrophobicContact CD1-CE2 3.83Å; L537-Y541 HydrophobicContact CG-CD2 4.19Å; L537-Y541 HydrophobicContact CG-CE2 4.17Å; L537-Y541 WeakPolarHBondContact O-CD2 3.3Å; L537-Y541 PolarHBondContact O-N 3.43Å; L537-Y541 VanDerWaalsContact O-N 3.15Å; L538-Y541 PolarHBondContact O-N 2.85Å; Y541-R543 VanDerWaalsContact C-N 3.29Å; Y541-R543 PolarHBondContact O-N 3.31Å; Y541-H544 CarbonylContact O-C 3.5Å; Y541-H544 PolarHBondContact O-N 3.35Å; Y541-H544 VanDerWaalsContact O-N 3.14Å; Y541-M545 HydrophobicContact CD1-CE 4.3Å; Y541-M545 WeakPolarHBondContact O-CA 3.48Å; Y541-M545 WeakPolarHBondContact O-CB 3.28Å; Y541-M545 PolarHBondContact O-N 2.9Å; Y541-L548 HydrophobicContact CD1-CD1 4.25Å; Y541-L548 HydrophobicContact CE1-CD1 4.43Å; Y541-Q575 HydrophobicContact CE2-CB 3.87Å; Y541-Q575 VanDerWaalsContact OH-CB 3.27Å; Y541-Q575 WeakPolarHBondContact OH-CB 3.33Å
542R96.8Very high96.2Very high85 Ų8543.9 Ų43.932%0.32123%0.226SC..Hα-helixtrans-58.8-40.8178.8-176.6179.7-67.61062.9112L538 E539 H544 V579 E582L538-R542 VanDerWaalsContact O-CB 3.24Å; L538-R542 WeakPolarHBondContact O-CB 2.89Å; L538-R542 PolarHBondContact O-N 2.98Å; E539-R542 PolarHBondContact O-N 3.46Å; R542-H544 VanDerWaalsContact C-N 3.3Å; R542-H544 PolarHBondContact O-N 3.11Å; R542-V579 VanDerWaalsContact CA-CG1 3.49Å; R542-V579 HydrophobicContact CB-CG1 3.87Å; R542-V579 HydrophobicContact CB-CG2 4.26Å; R542-V579 HydrophobicContact CG-CG1 4.45Å; R542-E582 WeakPolarHBondContact CD-OE2 3.3Å; R542-E582 WeakPolarHBondContact CG-OE2 3.37Å; R542-E582 IonicContact CZ-OE1 3.68Å; R542-E582 IonicContact NE-OE1 2.68Å; R542-E582 PolarHBondContact NE-OE1 3.42Å; R542-E582 IonicContact NE-OE2 2.72Å; R542-E582 PolarHBondContact NE-OE2 2.98Å; R542-E582 IonicContact NH2-OE1 2.87Å; R542-E582 PolarHBondContact NH2-OE1 2.7Å
543R96.5Very high96.2Very high139 Ų13944.7 Ų44.753%0.52523%0.232SC..Hα-helixtrans-62-36.7178-175.9176-176-176-2.3112.7Q533 E539 L540 Y541Q533-R543 VanDerWaalsContact OE1-NH1 3.1Å; E539-R543 VanDerWaalsContact O-CB 3.24Å; E539-R543 WeakPolarHBondContact O-CB 3.42Å; E539-R543 PolarHBondContact O-N 3.21Å; L540-R543 PolarHBondContact O-N 3.08Å; Y541-R543 VanDerWaalsContact C-N 3.29Å; Y541-R543 PolarHBondContact O-N 3.31Å
544H97.6Very high96.2Very high11 Ų1147.2 Ų47.25%0.05126%0.259CS..Hα-helixtrans-112.4-5.6-170.7-67.7-52.9000114.8S499 L500 L503 L540 Y541 R542 G546 Q547 L548S499-H544 WeakPolarHBondContact CB-NE2 3.27Å; S499-H544 PolarHBondContact OG-CD2 2.92Å; S499-H544 PolarHBondContact OG-NE2 3.34Å; L500-H544 HydrophobicContact CD1-CB 3.83Å; L503-H544 HydrophobicContact CD2-CB 4.26Å; L540-H544 PolarHBondContact O-CD2 3.37Å; L540-H544 PolarHBondContact O-N 2.97Å; Y541-H544 CarbonylContact O-C 3.5Å; Y541-H544 PolarHBondContact O-N 3.35Å; Y541-H544 VanDerWaalsContact O-N 3.14Å; R542-H544 VanDerWaalsContact C-N 3.3Å; R542-H544 PolarHBondContact O-N 3.11Å; H544-G546 PolarHBondContact O-N 3.36Å; H544-Q547 PolarHBondContact ND1-OE1 3.15Å; H544-Q547 VanDerWaalsContact ND1-OE1 3.1Å; H544-Q547 PolarHBondContact O-N 2.97Å; H544-Q547 VanDerWaalsContact O-N 3.08Å; H544-L548 HydrophobicContact CB-CD1 4.48Å; H544-L548 WeakPolarHBondContact O-CG 3.37Å; H544-L548 PolarHBondContact O-N 3.26Å
545M97.4Very high96.1Very high1 Ų145.7 Ų45.71%0.00524%0.237CC..Hα-helixtrans-55.8-48-171.7-178.557.56900112.2Y541 Q547 L548 L549 V572 S576 V579 I580 F583Y541-M545 HydrophobicContact CD1-CE 4.3Å; Y541-M545 WeakPolarHBondContact O-CA 3.48Å; Y541-M545 WeakPolarHBondContact O-CB 3.28Å; Y541-M545 PolarHBondContact O-N 2.9Å; M545-Q547 VanDerWaalsContact C-N 3.3Å; M545-Q547 PolarHBondContact O-N 2.91Å; M545-L548 PolarHBondContact O-N 2.75Å; M545-L548 VanDerWaalsContact O-N 3.15Å; M545-L549 HydrophobicContact CG-CD1 4.11Å; M545-L549 HydrophobicContact CG-CG 4.37Å; M545-L549 WeakPolarHBondContact O-CG 3.37Å; M545-L549 PolarHBondContact O-N 2.96Å; M545-L549 HydrophobicContact SD-CD1 4.19Å; M545-L549 HydrophobicContact SD-CD2 4.33Å; M545-L549 HydrophobicContact SD-CG 3.99Å; M545-V572 HydrophobicContact CE-CG1 4.07Å; M545-V572 HydrophobicContact SD-CG1 3.89Å; M545-S576 VanDerWaalsContact CE-OG 3.28Å; M545-S576 WeakPolarHBondContact CE-OG 3.32Å; M545-V579 HydrophobicContact CB-CG1 4.3Å; M545-V579 HydrophobicContact CE-CG1 4.19Å; M545-I580 HydrophobicContact CE-CG2 4.25Å; M545-F583 HydrophobicContact CB-CD1 4.22Å; M545-F583 HydrophobicContact CB-CD2 3.69Å; M545-F583 HydrophobicContact CB-CE1 4.12Å; M545-F583 HydrophobicContact CB-CE2 3.6Å; M545-F583 HydrophobicContact CB-CG 4.02Å; M545-F583 HydrophobicContact CB-CZ 3.82Å; M545-F583 HydrophobicContact CG-CB 3.9Å; M545-F583 HydrophobicContact CG-CD1 4.03Å; M545-F583 HydrophobicContact CG-CD2 3.4Å; M545-F583 HydrophobicContact CG-CE1 4.44Å; M545-F583 HydrophobicContact CG-CE2 3.88Å; M545-F583 HydrophobicContact CG-CG 3.49Å; M545-F583 VanDerWaalsContact CG-CG 3.49Å; M545-F583 HydrophobicContact CG-CZ 4.38Å
546G97.5Very high96.1Very high12 Ų1243.8 Ų43.812%0.12423%0.228CC..Hα-helixtrans-58.4-43.9179.400000112.5H544 L548 L549 D550 Q586H544-G546 PolarHBondContact O-N 3.36Å; G546-L548 PolarHBondContact O-N 3.44Å; G546-L549 PolarHBondContact O-N 3.44Å; G546-D550 VanDerWaalsContact O-CG 3.29Å; G546-D550 PolarHBondContact O-N 2.96Å; G546-Q586 PolarHBondContact O-OE1 3.4Å
547Q97.8Very high96Very high96 Ų9645.6 Ų45.645%0.44924%0.237SC..Hα-helixtrans-67.8-34.9178.2-58.1176.3-61.300112.4L500 H544 M545 W551L500-Q547 HydrophobicContact CD1-CB 3.85Å; L500-Q547 HydrophobicContact CD2-CB 3.75Å; L500-Q547 HydrophobicContact CD2-CG 4.32Å; L500-Q547 HydrophobicContact CG-CB 4.48Å; H544-Q547 PolarHBondContact ND1-OE1 3.15Å; H544-Q547 VanDerWaalsContact ND1-OE1 3.1Å; H544-Q547 PolarHBondContact O-N 2.97Å; H544-Q547 VanDerWaalsContact O-N 3.08Å; M545-Q547 VanDerWaalsContact C-N 3.3Å; M545-Q547 PolarHBondContact O-N 2.91Å; Q547-W551 VanDerWaalsContact O-CB 3.3Å; Q547-W551 WeakPolarHBondContact O-CB 3.25Å; Q547-W551 PolarHBondContact O-N 3.31Å
548L97.8Very high95.9Very high0 Ų049.4 Ų49.40%026%0.262CS..Hα-helixtrans-67.1-41174.6-70.3172.6000111.7L500 L503 Q504 Y541 H544 M545 G546 W551 L552 V572L500-L548 HydrophobicContact CD1-CD2 3.92Å; L500-L548 HydrophobicContact CD1-CG 4.07Å; L503-L548 HydrophobicContact CD2-CD1 3.87Å; L503-L548 HydrophobicContact CG-CD1 4.48Å; Q504-L548 HydrophobicContact CG-CD2 3.73Å; Y541-L548 HydrophobicContact CD1-CD1 4.25Å; Y541-L548 HydrophobicContact CE1-CD1 4.43Å; H544-L548 HydrophobicContact CB-CD1 4.48Å; H544-L548 WeakPolarHBondContact O-CG 3.37Å; H544-L548 PolarHBondContact O-N 3.26Å; M545-L548 PolarHBondContact O-N 2.75Å; M545-L548 VanDerWaalsContact O-N 3.15Å; G546-L548 PolarHBondContact O-N 3.44Å; L548-W551 HydrophobicContact CD2-CE3 4.2Å; L548-W551 HydrophobicContact CD2-CZ3 4.48Å; L548-W551 PolarHBondContact O-N 3.06Å; L548-L552 WeakPolarHBondContact O-CG 3.26Å; L548-L552 PolarHBondContact O-N 3.48Å; L548-V572 HydrophobicContact CD1-CG1 4.35Å; L548-V572 HydrophobicContact CD1-CG2 4.44Å
549L97.5Very high95.8Very high2 Ų247 Ų471%0.0125%0.249CC..Hα-helixtrans-68.4-39.2176.5-67.1178.8000111.7M545 G546 L552 S553 F583 Q586 L587M545-L549 HydrophobicContact CG-CD1 4.11Å; M545-L549 HydrophobicContact CG-CG 4.37Å; M545-L549 WeakPolarHBondContact O-CG 3.37Å; M545-L549 PolarHBondContact O-N 2.96Å; M545-L549 HydrophobicContact SD-CD1 4.19Å; M545-L549 HydrophobicContact SD-CD2 4.33Å; M545-L549 HydrophobicContact SD-CG 3.99Å; G546-L549 PolarHBondContact O-N 3.44Å; L549-L552 PolarHBondContact O-N 3.42Å; L549-S553 VanDerWaalsContact O-CB 3.25Å; L549-S553 WeakPolarHBondContact O-CB 3.49Å; L549-S553 PolarHBondContact O-N 3.36Å; L549-S553 PolarHBondContact O-OG 2.93Å; L549-F583 HydrophobicContact CD1-CB 3.86Å; L549-Q586 HydrophobicContact CD1-CB 3.93Å; L549-L587 HydrophobicContact CD1-CB 4.39Å; L549-L587 HydrophobicContact CD2-CD1 4.28Å
550D96.8Very high95.7Very high96 Ų9644.9 Ų44.951%0.51324%0.243SC..Hα-helixtrans-62.6-43.9173.5-72.2-24.1000111.3G546 L552 S553 A554G546-D550 VanDerWaalsContact O-CG 3.29Å; G546-D550 PolarHBondContact O-N 2.96Å; D550-L552 PolarHBondContact O-N 3.45Å; D550-S553 PolarHBondContact O-N 3.21Å; D550-A554 PolarHBondContact O-N 2.94Å
551W95.7Very high95.3Very high62 Ų6245.3 Ų45.324%0.23525%0.246CC..Hα-helixtrans-57.9-45.7176168.258.8000112.5Q504 Q547 L548 Q568Q504-W551 HydrophobicContact CB-CH2 4.37Å; Q504-W551 HydrophobicContact CG-CD2 4.25Å; Q504-W551 HydrophobicContact CG-CE3 4.1Å; Q504-W551 HydrophobicContact CG-CH2 4.4Å; Q504-W551 HydrophobicContact CG-CZ3 4.18Å; Q547-W551 VanDerWaalsContact O-CB 3.3Å; Q547-W551 WeakPolarHBondContact O-CB 3.25Å; Q547-W551 PolarHBondContact O-N 3.31Å; L548-W551 HydrophobicContact CD2-CE3 4.2Å; L548-W551 HydrophobicContact CD2-CZ3 4.48Å; L548-W551 PolarHBondContact O-N 3.06Å; W551-Q568 HydrophobicContact CH2-CB 4.36Å; W551-Q568 HydrophobicContact CH2-CG 4.17Å; W551-Q568 HydrophobicContact CZ3-CB 4.43Å
552L95.9Very high95Very high1 Ų154.7 Ų54.71%0.00528%0.283CS..Hα-helixtrans-68.6-41.5176.1-68.4171.1000111.5L548 L549 D550 A554 S555 V556 W559 Q565 Q568 L569 V572 L590L548-L552 WeakPolarHBondContact O-CG 3.26Å; L548-L552 PolarHBondContact O-N 3.48Å; L549-L552 PolarHBondContact O-N 3.42Å; D550-L552 PolarHBondContact O-N 3.45Å; L552-A554 PolarHBondContact O-N 2.97Å; L552-S555 PolarHBondContact O-N 3.19Å; L552-V556 PolarHBondContact O-N 2.88Å; L552-W559 HydrophobicContact CB-CH2 4.07Å; L552-W559 HydrophobicContact CB-CZ2 4.06Å; L552-W559 HydrophobicContact CD2-CH2 4.18Å; L552-W559 HydrophobicContact CD2-CZ2 4.16Å; L552-W559 VanDerWaalsContact O-CZ2 3.23Å; L552-W559 WeakPolarHBondContact O-CZ2 3.41Å; L552-Q565 HydrophobicContact CD2-CB 4.13Å; L552-Q568 HydrophobicContact CD2-CB 3.97Å; L552-L569 HydrophobicContact CD1-CB 4.13Å; L552-L569 HydrophobicContact CD1-CD1 3.87Å; L552-V572 HydrophobicContact CD1-CG2 4.5Å; L552-L590 HydrophobicContact CB-CD1 3.83Å
553S95.4Very high94.8Very high39 Ų3951.5 Ų51.527%0.27327%0.273SS..Hα-helixtrans-61.3-30.5-179.9-62.80000112.8L549 D550 S555 V556 L590L549-S553 VanDerWaalsContact O-CB 3.25Å; L549-S553 WeakPolarHBondContact O-CB 3.49Å; L549-S553 PolarHBondContact O-N 3.36Å; L549-S553 PolarHBondContact O-OG 2.93Å; D550-S553 PolarHBondContact O-N 3.21Å; S553-S555 PolarHBondContact O-N 3.23Å; S553-S555 VanDerWaalsContact O-N 3.15Å; S553-V556 WeakPolarHBondContact O-CG1 3.18Å; S553-V556 PolarHBondContact O-N 2.96Å; S553-L590 WeakPolarHBondContact OG-CD1 3.45Å
554A94Very high94.6Very high88 Ų8846 Ų4673%0.72726%0.256SS*.THydrogen-bonded Turntrans-57.3-31.3-177.500000114D550 L552D550-A554 PolarHBondContact O-N 2.94Å; L552-A554 PolarHBondContact O-N 2.97Å
555S93.1Very high94.4Very high37 Ų3747 Ų4726%0.25926%0.26SS..THydrogen-bonded Turntrans-115.71.9-178.461.50000113.8L552 S553 N557 T558 W559L552-S555 PolarHBondContact O-N 3.19Å; S553-S555 PolarHBondContact O-N 3.23Å; S553-S555 VanDerWaalsContact O-N 3.15Å; S555-N557 PolarHBondContact O-N 3.38Å; S555-T558 PolarHBondContact O-N 3.37Å; S555-T558 PolarHBondContact O-OG1 3.48Å; S555-W559 VanDerWaalsContact C-NE1 3.31Å; S555-W559 PolarHBondContact O-NE1 2.81Å; S555-W559 PolarHBondContact OG-NE1 3.16Å
556V93.7Very high94.2Very high8 Ų849.7 Ų49.75%0.04827%0.271CS..G310 helixtrans-50.5-42-169.771.20000112.1L552 S553 T558 W559 L590 N593 C594 R599L552-V556 PolarHBondContact O-N 2.88Å; S553-V556 WeakPolarHBondContact O-CG1 3.18Å; S553-V556 PolarHBondContact O-N 2.96Å; V556-T558 PolarHBondContact O-N 3.01Å; V556-W559 HydrophobicContact CB-CZ2 4.42Å; V556-W559 HydrophobicContact CG2-CD2 4.25Å; V556-W559 HydrophobicContact CG2-CE3 4.22Å; V556-W559 HydrophobicContact CG2-CH2 4.5Å; V556-W559 HydrophobicContact CG2-CZ2 4.5Å; V556-W559 HydrophobicContact CG2-CZ3 4.36Å; V556-W559 WeakPolarHBondContact O-CB 3.41Å; V556-W559 PolarHBondContact O-N 3.02Å; V556-W559 VanDerWaalsContact O-N 3.08Å; V556-L590 HydrophobicContact CG2-CG 4.44Å; V556-N593 HydrophobicContact CG1-CB 4.18Å; V556-N593 HydrophobicContact CG2-CB 4.16Å; V556-C594 WeakPolarHBondContact CG2-SG 3.41Å; V556-R599 VanDerWaalsContact C-NH2 3.33Å; V556-R599 PolarHBondContact O-NH2 3.42Å
557N92.1Very high94Very high107 Ų10751.6 Ų51.657%0.57228%0.277SS*.G310 helixtrans-57.2-22.2-178.2-67.5-40.8000115.3S555 N593 R599S555-N557 PolarHBondContact O-N 3.38Å; N557-N593 PolarHBondContact OD1-ND2 2.77Å; N557-R599 VanDerWaalsContact CA-NH2 3.3Å; N557-R599 PolarHBondContact O-NH1 3.32Å
558T91.8Very high93.9Very high113 Ų11347 Ų4769%0.69326%0.256SS*.G310 helixtrans-104.12.5-177.959.80000113.5S555 V556S555-T558 PolarHBondContact O-N 3.37Å; S555-T558 PolarHBondContact O-OG1 3.48Å; V556-T558 PolarHBondContact O-N 3.01Å
559W94.4Very high93.9Very high8 Ų847 Ų473%0.0326%0.256CS..  trans-67.6146.2-175.3-65.55.7000113.7L552 S555 V556 S563 Q565 R566 L569 M603L552-W559 HydrophobicContact CB-CH2 4.07Å; L552-W559 HydrophobicContact CB-CZ2 4.06Å; L552-W559 HydrophobicContact CD2-CH2 4.18Å; L552-W559 HydrophobicContact CD2-CZ2 4.16Å; L552-W559 VanDerWaalsContact O-CZ2 3.23Å; L552-W559 WeakPolarHBondContact O-CZ2 3.41Å; S555-W559 VanDerWaalsContact C-NE1 3.31Å; S555-W559 PolarHBondContact O-NE1 2.81Å; S555-W559 PolarHBondContact OG-NE1 3.16Å; V556-W559 HydrophobicContact CB-CZ2 4.42Å; V556-W559 HydrophobicContact CG2-CD2 4.25Å; V556-W559 HydrophobicContact CG2-CE3 4.22Å; V556-W559 HydrophobicContact CG2-CH2 4.5Å; V556-W559 HydrophobicContact CG2-CZ2 4.5Å; V556-W559 HydrophobicContact CG2-CZ3 4.36Å; V556-W559 WeakPolarHBondContact O-CB 3.41Å; V556-W559 PolarHBondContact O-N 3.02Å; V556-W559 VanDerWaalsContact O-N 3.08Å; W559-S563 WeakPolarHBondContact CA-OG 3.41Å; W559-Q565 HydrophobicContact CD2-CB 4.01Å; W559-Q565 HydrophobicContact CH2-CB 3.94Å; W559-Q565 HydrophobicContact CZ2-CB 3.26Å; W559-Q565 HydrophobicContact CZ2-CG 4.15Å; W559-R566 HydrophobicContact CE3-CB 4.35Å; W559-L569 HydrophobicContact CH2-CB 4.33Å; W559-L569 HydrophobicContact CZ3-CB 4.4Å; W559-L569 HydrophobicContact CZ3-CD2 4.12Å; W559-M603 HydrophobicContact CB-CE 4.47Å; W559-M603 HydrophobicContact CB-SD 3.47Å; W559-M603 WeakPolarHBondContact CB-SD 3.33Å; W559-M603 HydrophobicContact CE3-SD 4.22Å
560S92.6Very high93.8Very high37 Ų3749.9 Ų49.926%0.25927%0.269SS..  trans-136.8-177.6173.869.20000110.5Y562 S563S560-Y562 PolarHBondContact O-N 3.03Å; S560-Y562 PolarHBondContact OG-N 3.14Å; S560-S563 PolarHBondContact N-OG 3.01Å; S560-S563 WeakPolarHBondContact O-CB 3.24Å; S560-S563 PolarHBondContact O-N 3.25Å; S560-S563 VanDerWaalsContact O-N 3.14Å; S560-S563 PolarHBondContact OG-OG 3.4Å
561S90.4Very high93.7Very high9 Ų946.2 Ų46.26%0.06325%0.249CC..THydrogen-bonded Turntrans-62.9-17.4173.5630000114.5R566 D600 E602S561-R566 VanDerWaalsContact O-CZ 3.24Å; S561-R566 PolarHBondContact O-NE 3.03Å; S561-R566 PolarHBondContact O-NH2 2.82Å; S561-D600 WeakPolarHBondContact CB-OD1 3.4Å; S561-D600 PolarHBondContact N-OD1 2.84Å; S561-E602 VanDerWaalsContact CB-OE2 3.28Å; S561-E602 WeakPolarHBondContact CB-OE2 3.07Å; S561-E602 PolarHBondContact OG-OE2 3.44Å; S561-E602 VanDerWaalsContact OG-OE2 3.1Å
562Y89.9Confident93.8Very high198 Ų19843.2 Ų43.278%0.77624%0.238SC*.THydrogen-bonded Turntrans-94.6-8.6177.3-56.4-77.9000113.5S560S560-Y562 PolarHBondContact O-N 3.03Å; S560-Y562 PolarHBondContact OG-N 3.14Å
563S92.2Very high93.8Very high17 Ų1743.2 Ų43.212%0.11924%0.238CC..  trans-73.2125.3-176.1-62.50000111.3W559 S560 Q565 R566W559-S563 WeakPolarHBondContact CA-OG 3.41Å; S560-S563 PolarHBondContact N-OG 3.01Å; S560-S563 WeakPolarHBondContact O-CB 3.24Å; S560-S563 PolarHBondContact O-N 3.25Å; S560-S563 VanDerWaalsContact O-N 3.14Å; S560-S563 PolarHBondContact OG-OG 3.4Å; S563-Q565 PolarHBondContact O-N 3.02Å; S563-R566 WeakPolarHBondContact O-CG 3.35Å; S563-R566 PolarHBondContact O-N 3.36Å
564P92.3Very high93.6Very high25 Ų2544 Ų4416%0.16224%0.242CC..Hα-helixtrans-63.8-26.8-179.426.8-35.8000112.6Q469 L512 R566 L567 Q568Q469-P564 HydrophobicContact CB-CG 4.42Å; Q469-P564 HydrophobicContact CG-CG 4.42Å; L512-P564 HydrophobicContact CD2-CB 3.86Å; P564-R566 PolarHBondContact O-N 3.41Å; P564-L567 WeakPolarHBondContact O-CA 3.17Å; P564-L567 WeakPolarHBondContact O-CB 3.05Å; P564-L567 PolarHBondContact O-N 3.46Å; P564-Q568 PolarHBondContact O-N 3.36Å
565Q93.9Very high93.6Very high31 Ų3142.5 Ų42.515%0.14522%0.219CC..Hα-helixtrans-61.5-27.2-178.9-60.875.913.300113.5L552 W559 S563 L567 Q568 L569L552-Q565 HydrophobicContact CD2-CB 4.13Å; W559-Q565 HydrophobicContact CD2-CB 4.01Å; W559-Q565 HydrophobicContact CH2-CB 3.94Å; W559-Q565 HydrophobicContact CZ2-CB 3.26Å; W559-Q565 HydrophobicContact CZ2-CG 4.15Å; S563-Q565 PolarHBondContact O-N 3.02Å; Q565-L567 VanDerWaalsContact C-N 3.31Å; Q565-L567 PolarHBondContact O-N 2.78Å; Q565-Q568 VanDerWaalsContact CA-OE1 3.26Å; Q565-Q568 PolarHBondContact O-N 3.36Å; Q565-L569 WeakPolarHBondContact O-CB 3.3Å; Q565-L569 PolarHBondContact O-N 3.23Å
566R92.9Very high93.6Very high58 Ų5840.8 Ų40.822%0.21921%0.207CC..Hα-helixtrans-66.5-35.9173.186.4-176.217078.9-0.5111.9W559 S561 S563 P564 H570 M603 S606W559-R566 HydrophobicContact CE3-CB 4.35Å; S561-R566 VanDerWaalsContact O-CZ 3.24Å; S561-R566 PolarHBondContact O-NE 3.03Å; S561-R566 PolarHBondContact O-NH2 2.82Å; S563-R566 WeakPolarHBondContact O-CG 3.35Å; S563-R566 PolarHBondContact O-N 3.36Å; P564-R566 PolarHBondContact O-N 3.41Å; R566-H570 PolarHBondContact O-N 2.82Å; R566-M603 HydrophobicContact CB-CG 4.44Å; R566-S606 PolarHBondContact NH1-OG 2.73Å
567L94.2Very high93.6Very high51 Ų5141.2 Ų41.227%0.26721%0.214SC..Hα-helixtrans-76.2-38.8178.5-60.6174.4000109.6S511 P564 Q565 L569 H570 I571S511-L567 WeakPolarHBondContact O-CD1 3.38Å; P564-L567 WeakPolarHBondContact O-CA 3.17Å; P564-L567 WeakPolarHBondContact O-CB 3.05Å; P564-L567 PolarHBondContact O-N 3.46Å; Q565-L567 VanDerWaalsContact C-N 3.31Å; Q565-L567 PolarHBondContact O-N 2.78Å; L567-L569 PolarHBondContact O-N 3.03Å; L567-H570 WeakPolarHBondContact O-CB 3.44Å; L567-H570 PolarHBondContact O-N 3.23Å; L567-H570 VanDerWaalsContact O-N 3.13Å; L567-I571 WeakPolarHBondContact O-CG1 3.47Å; L567-I571 PolarHBondContact O-N 3.07Å
568Q96.1Very high93.7Very high0 Ų038.2 Ų38.20%020%0.2CC..Hα-helixtrans-59.4-44.6172.2-65.4167.6-21.400111.2V507 T508 S511 W551 L552 P564 Q565 H570 I571 V572V507-Q568 HydrophobicContact CG1-CB 3.94Å; V507-Q568 HydrophobicContact CG1-CG 4.18Å; T508-Q568 PolarHBondContact OG1-NE2 2.68Å; S511-Q568 WeakPolarHBondContact OG-CG 3.37Å; W551-Q568 HydrophobicContact CH2-CB 4.36Å; W551-Q568 HydrophobicContact CH2-CG 4.17Å; W551-Q568 HydrophobicContact CZ3-CB 4.43Å; L552-Q568 HydrophobicContact CD2-CB 3.97Å; P564-Q568 PolarHBondContact O-N 3.36Å; Q565-Q568 VanDerWaalsContact CA-OE1 3.26Å; Q565-Q568 PolarHBondContact O-N 3.36Å; Q568-H570 VanDerWaalsContact C-N 3.29Å; Q568-H570 PolarHBondContact O-N 3.39Å; Q568-I571 PolarHBondContact O-N 3.24Å; Q568-V572 WeakPolarHBondContact O-CG2 3.35Å; Q568-V572 PolarHBondContact O-N 2.97Å
569L96.4Very high93.9Very high0 Ų032.8 Ų32.80%017%0.167CC..Hα-helixtrans-55.8-44.6172.7179.368.8000111.4L552 W559 Q565 L567 V572 L573 L590 M610L552-L569 HydrophobicContact CD1-CB 4.13Å; L552-L569 HydrophobicContact CD1-CD1 3.87Å; W559-L569 HydrophobicContact CH2-CB 4.33Å; W559-L569 HydrophobicContact CZ3-CB 4.4Å; W559-L569 HydrophobicContact CZ3-CD2 4.12Å; Q565-L569 WeakPolarHBondContact O-CB 3.3Å; Q565-L569 PolarHBondContact O-N 3.23Å; L567-L569 PolarHBondContact O-N 3.03Å; L569-V572 PolarHBondContact O-N 3.38Å; L569-L573 HydrophobicContact CD1-CD1 3.77Å; L569-L573 HydrophobicContact CD1-CG 3.98Å; L569-L573 HydrophobicContact CG-CD1 3.91Å; L569-L573 HydrophobicContact CG-CG 4.36Å; L569-L573 WeakPolarHBondContact O-CB 3.2Å; L569-L573 WeakPolarHBondContact O-CG 3.36Å; L569-L573 PolarHBondContact O-N 2.88Å; L569-L590 HydrophobicContact CD1-CD2 3.67Å; L569-L590 HydrophobicContact CD2-CD2 3.71Å; L569-L590 HydrophobicContact CG-CD2 4.36Å; L569-M610 HydrophobicContact CD2-CE 4.28Å; L569-M610 HydrophobicContact CG-CE 4.46Å
570H95.2Very high93.9Very high63 Ų6332.5 Ų32.529%0.29217%0.166SC..Hα-helixtrans-60.2-46.4177.2178.8-117.8000112.4R566 L567 Q568 T574 M610R566-H570 PolarHBondContact O-N 2.82Å; L567-H570 WeakPolarHBondContact O-CB 3.44Å; L567-H570 PolarHBondContact O-N 3.23Å; L567-H570 VanDerWaalsContact O-N 3.13Å; Q568-H570 VanDerWaalsContact C-N 3.29Å; Q568-H570 PolarHBondContact O-N 3.39Å; H570-T574 WeakPolarHBondContact O-CB 3.1Å; H570-T574 VanDerWaalsContact O-CG2 3.25Å; H570-T574 WeakPolarHBondContact O-CG2 3.26Å; H570-T574 PolarHBondContact O-N 3.21Å; H570-T574 PolarHBondContact O-OG1 3.22Å; H570-M610 VanDerWaalsContact CA-SD 3.58Å; H570-M610 HydrophobicContact CB-SD 4.02Å
571I95.9Very high93.9Very high18 Ų1830.9 Ų30.99%0.09215%0.154CC..Hα-helixtrans-62.6-48.1176.4-63-58000111V507 Q510 L567 Q568 L573 T574 Q575V507-I571 HydrophobicContact CB-CG2 4.47Å; V507-I571 HydrophobicContact CG1-CB 4.26Å; V507-I571 HydrophobicContact CG1-CG2 4.17Å; V507-I571 HydrophobicContact CG2-CG2 4.25Å; Q510-I571 HydrophobicContact CB-CD1 4.16Å; Q510-I571 HydrophobicContact CB-CG1 4.17Å; Q510-I571 HydrophobicContact CB-CG2 4.12Å; L567-I571 WeakPolarHBondContact O-CG1 3.47Å; L567-I571 PolarHBondContact O-N 3.07Å; Q568-I571 PolarHBondContact O-N 3.24Å; I571-L573 PolarHBondContact O-N 3.1Å; I571-T574 PolarHBondContact O-N 2.97Å; I571-T574 PolarHBondContact O-OG1 3.37Å; I571-Q575 HydrophobicContact CG2-CG 4.02Å; I571-Q575 VanDerWaalsContact O-CB 3.3Å; I571-Q575 WeakPolarHBondContact O-CB 3.43Å; I571-Q575 VanDerWaalsContact O-CG 3.25Å; I571-Q575 WeakPolarHBondContact O-CG 3.45Å; I571-Q575 PolarHBondContact O-N 3.13Å
572V97.1Very high94.1Very high0 Ų033.9 Ų33.90%017%0.167CC..Hα-helixtrans-58.3-47.4-179.4171.80000111.2V507 M545 L548 L552 Q568 L569 S576V507-V572 HydrophobicContact CG1-CG2 3.87Å; V507-V572 HydrophobicContact CG2-CG2 4.19Å; M545-V572 HydrophobicContact CE-CG1 4.07Å; M545-V572 HydrophobicContact SD-CG1 3.89Å; L548-V572 HydrophobicContact CD1-CG1 4.35Å; L548-V572 HydrophobicContact CD1-CG2 4.44Å; L552-V572 HydrophobicContact CD1-CG2 4.5Å; Q568-V572 WeakPolarHBondContact O-CG2 3.35Å; Q568-V572 PolarHBondContact O-N 2.97Å; L569-V572 PolarHBondContact O-N 3.38Å; V572-S576 VanDerWaalsContact O-CB 3.27Å; V572-S576 WeakPolarHBondContact O-CB 3.25Å; V572-S576 PolarHBondContact O-N 3.49Å; V572-S576 PolarHBondContact O-OG 3.46Å
573L95.3Very high94.3Very high1 Ų126.4 Ų26.41%0.00514%0.139CC..Hα-helixtrans-73.7-31-176.7-65.2-179.1000113.6L569 I571 I580 L587 M610 L614L569-L573 HydrophobicContact CD1-CD1 3.77Å; L569-L573 HydrophobicContact CD1-CG 3.98Å; L569-L573 HydrophobicContact CG-CD1 3.91Å; L569-L573 HydrophobicContact CG-CG 4.36Å; L569-L573 WeakPolarHBondContact O-CB 3.2Å; L569-L573 WeakPolarHBondContact O-CG 3.36Å; L569-L573 PolarHBondContact O-N 2.88Å; I571-L573 PolarHBondContact O-N 3.1Å; L573-I580 HydrophobicContact CD2-CB 4.39Å; L573-I580 HydrophobicContact CD2-CG2 3.92Å; L573-L587 HydrophobicContact CD1-CD1 4.14Å; L573-L587 HydrophobicContact CD2-CD1 3.89Å; L573-L587 HydrophobicContact CD2-CD2 4.04Å; L573-M610 HydrophobicContact CB-SD 4.25Å; L573-M610 HydrophobicContact CD1-CE 3.5Å; L573-M610 HydrophobicContact CD1-SD 3.82Å; L573-L614 HydrophobicContact CB-CD1 4.01Å; L573-L614 HydrophobicContact CD1-CD1 4.33Å
574T92.4Very high94.4Very high56 Ų5626.1 Ų26.134%0.34414%0.136SC..Hα-helixtrans-79.9-35.8179.452.40000112.6H570 I571H570-T574 WeakPolarHBondContact O-CB 3.1Å; H570-T574 VanDerWaalsContact O-CG2 3.25Å; H570-T574 WeakPolarHBondContact O-CG2 3.26Å; H570-T574 PolarHBondContact O-N 3.21Å; H570-T574 PolarHBondContact O-OG1 3.22Å; I571-T574 PolarHBondContact O-N 2.97Å; I571-T574 PolarHBondContact O-OG1 3.37Å
575Q92.9Very high94.3Very high56 Ų5629.6 Ų29.626%0.26216%0.161SC..Hα-helixtrans-84.9-23.1-175.6-64.4-61.4-24.600114.1Y541 I571 G577Y541-Q575 HydrophobicContact CE2-CB 3.87Å; Y541-Q575 VanDerWaalsContact OH-CB 3.27Å; Y541-Q575 WeakPolarHBondContact OH-CB 3.33Å; I571-Q575 HydrophobicContact CG2-CG 4.02Å; I571-Q575 VanDerWaalsContact O-CB 3.3Å; I571-Q575 WeakPolarHBondContact O-CB 3.43Å; I571-Q575 VanDerWaalsContact O-CG 3.25Å; I571-Q575 WeakPolarHBondContact O-CG 3.45Å; I571-Q575 PolarHBondContact O-N 3.13Å; Q575-G577 VanDerWaalsContact C-N 3.33Å
576S94.1Very high94.4Very high0 Ų031.4 Ų31.40%017%0.169CC..SBendtrans-82-9.3-178.153.50000114.5M545 V572 V579 I580M545-S576 VanDerWaalsContact CE-OG 3.28Å; M545-S576 WeakPolarHBondContact CE-OG 3.32Å; V572-S576 VanDerWaalsContact O-CB 3.27Å; V572-S576 WeakPolarHBondContact O-CB 3.25Å; V572-S576 PolarHBondContact O-N 3.49Å; V572-S576 PolarHBondContact O-OG 3.46Å; S576-V579 VanDerWaalsContact O-CB 3.31Å; S576-V579 WeakPolarHBondContact O-CB 3.35Å; S576-V579 WeakPolarHBondContact O-CG2 3.48Å; S576-V579 PolarHBondContact O-N 2.9Å; S576-V579 VanDerWaalsContact O-N 3.17Å; S576-I580 WeakPolarHBondContact OG-CG2 3.49Å
577G92.6Very high94.4Very high18 Ų1828.7 Ų28.719%0.18616%0.159CC..G310 helixtrans53.7-126.5174.700000112.9Q575 V579 N620Q575-G577 VanDerWaalsContact C-N 3.33Å; G577-V579 PolarHBondContact O-N 3.25Å; G577-N620 CarbonylContact C-O 3.58Å
578P94.3Very high94.3Very high43 Ų4327.2 Ų27.228%0.27915%0.151SC..G310 helixtrans-69.2-15.5-175.728-35.5000113.8L538 I580 G581 N620 S624L538-P578 HydrophobicContact CD1-CG 4.2Å; L538-P578 HydrophobicContact CD2-CG 4.49Å; P578-I580 PolarHBondContact O-N 3.21Å; P578-G581 PolarHBondContact O-N 3.27Å; P578-N620 WeakPolarHBondContact CA-O 3.5Å; P578-N620 WeakPolarHBondContact CB-O 3.48Å; P578-N620 VanDerWaalsContact N-O 3.13Å; P578-S624 WeakPolarHBondContact O-CB 3.46Å; P578-S624 PolarHBondContact O-OG 3.01Å
579V96.1Very high94.2Very high0 Ų031 Ų310%018%0.176CC..G310 helixtrans-60.8-31.5-178.1176.90000111.3L538 R542 M545 S576 G577 G581 E582 F583L538-V579 HydrophobicContact CB-CG2 4.06Å; L538-V579 HydrophobicContact CD2-CG2 4.27Å; L538-V579 WeakPolarHBondContact O-CG2 3.33Å; R542-V579 VanDerWaalsContact CA-CG1 3.49Å; R542-V579 HydrophobicContact CB-CG1 3.87Å; R542-V579 HydrophobicContact CB-CG2 4.26Å; R542-V579 HydrophobicContact CG-CG1 4.45Å; M545-V579 HydrophobicContact CB-CG1 4.3Å; M545-V579 HydrophobicContact CE-CG1 4.19Å; S576-V579 VanDerWaalsContact O-CB 3.31Å; S576-V579 WeakPolarHBondContact O-CB 3.35Å; S576-V579 WeakPolarHBondContact O-CG2 3.48Å; S576-V579 PolarHBondContact O-N 2.9Å; S576-V579 VanDerWaalsContact O-N 3.17Å; G577-V579 PolarHBondContact O-N 3.25Å; V579-G581 PolarHBondContact O-N 3.05Å; V579-G581 VanDerWaalsContact O-N 3.16Å; V579-E582 WeakPolarHBondContact O-CB 3.37Å; V579-E582 PolarHBondContact O-N 2.88Å; V579-F583 HydrophobicContact CG1-CD2 4.24Å; V579-F583 HydrophobicContact CG1-CE2 4.01Å; V579-F583 WeakPolarHBondContact O-CD2 3.39Å
580I94.1Very high94.2Very high2 Ų231.1 Ų31.11%0.0118%0.176CC..G310 helixtrans-59.3-31.9-178.373.8177.7000112.8M545 L573 S576 P578 E582 F583 L614 T621 L622M545-I580 HydrophobicContact CE-CG2 4.25Å; L573-I580 HydrophobicContact CD2-CB 4.39Å; L573-I580 HydrophobicContact CD2-CG2 3.92Å; S576-I580 WeakPolarHBondContact OG-CG2 3.49Å; P578-I580 PolarHBondContact O-N 3.21Å; I580-E582 PolarHBondContact O-N 3.47Å; I580-F583 PolarHBondContact O-N 3.14Å; I580-F583 VanDerWaalsContact O-N 3.1Å; I580-L614 HydrophobicContact CD1-CD1 4.13Å; I580-L614 HydrophobicContact CD1-CD2 4.36Å; I580-T621 WeakPolarHBondContact CG1-O 3.42Å; I580-L622 HydrophobicContact CD1-CB 4.48Å; I580-L622 HydrophobicContact CD1-CD2 3.51Å; I580-L622 HydrophobicContact CD1-CG 3.74Å; I580-L622 HydrophobicContact CG1-CD2 4.11Å
581G92.9Very high94.1Very high2 Ų228.1 Ų28.12%0.02116%0.163CC..G310 helixtrans-68.7-17.5178.800000113.5P578 V579 F583 L584 T621 L622 S624P578-G581 PolarHBondContact O-N 3.27Å; V579-G581 PolarHBondContact O-N 3.05Å; V579-G581 VanDerWaalsContact O-N 3.16Å; G581-F583 VanDerWaalsContact C-N 3.33Å; G581-L584 WeakPolarHBondContact O-CG 3.48Å; G581-T621 PolarHBondContact N-O 3.3Å; G581-L622 WeakPolarHBondContact CA-O 3.47Å; G581-S624 WeakPolarHBondContact CA-OG 3.28Å
582E94.6Very high94Very high72 Ų7231 Ų3134%0.33618%0.175SC..G310 helixtrans-77.3-20.3173.1-59.4173.1-148.100111.9R542 V579 I580 Q625R542-E582 WeakPolarHBondContact CD-OE2 3.3Å; R542-E582 WeakPolarHBondContact CG-OE2 3.37Å; R542-E582 IonicContact CZ-OE1 3.68Å; R542-E582 IonicContact NE-OE1 2.68Å; R542-E582 PolarHBondContact NE-OE1 3.42Å; R542-E582 IonicContact NE-OE2 2.72Å; R542-E582 PolarHBondContact NE-OE2 2.98Å; R542-E582 IonicContact NH2-OE1 2.87Å; R542-E582 PolarHBondContact NH2-OE1 2.7Å; V579-E582 WeakPolarHBondContact O-CB 3.37Å; V579-E582 PolarHBondContact O-N 2.88Å; I580-E582 PolarHBondContact O-N 3.47Å; E582-Q625 HydrophobicContact CG-CG 3.88Å
583F95.3Very high93.9Very high42 Ų4232.8 Ų32.818%0.18419%0.185CC..G310 helixtrans-11724.8-172-66-94.5000113.7M545 L549 V579 I580 G581 S585 Q586 L587M545-F583 HydrophobicContact CB-CD1 4.22Å; M545-F583 HydrophobicContact CB-CD2 3.69Å; M545-F583 HydrophobicContact CB-CE1 4.12Å; M545-F583 HydrophobicContact CB-CE2 3.6Å; M545-F583 HydrophobicContact CB-CG 4.02Å; M545-F583 HydrophobicContact CB-CZ 3.82Å; M545-F583 HydrophobicContact CG-CB 3.9Å; M545-F583 HydrophobicContact CG-CD1 4.03Å; M545-F583 HydrophobicContact CG-CD2 3.4Å; M545-F583 HydrophobicContact CG-CE1 4.44Å; M545-F583 HydrophobicContact CG-CE2 3.88Å; M545-F583 HydrophobicContact CG-CG 3.49Å; M545-F583 VanDerWaalsContact CG-CG 3.49Å; M545-F583 HydrophobicContact CG-CZ 4.38Å; L549-F583 HydrophobicContact CD1-CB 3.86Å; V579-F583 HydrophobicContact CG1-CD2 4.24Å; V579-F583 HydrophobicContact CG1-CE2 4.01Å; V579-F583 WeakPolarHBondContact O-CD2 3.39Å; I580-F583 PolarHBondContact O-N 3.14Å; I580-F583 VanDerWaalsContact O-N 3.1Å; G581-F583 VanDerWaalsContact C-N 3.33Å; F583-S585 VanDerWaalsContact C-N 3.26Å; F583-S585 PolarHBondContact O-N 3.41Å; F583-Q586 PolarHBondContact O-N 2.92Å; F583-Q586 VanDerWaalsContact O-N 3.14Å; F583-L587 PolarHBondContact O-N 3.17Å
584L92.7Very high93.8Very high11 Ų1132.7 Ų32.76%0.05819%0.185CC..Hα-helixtrans-56.2-36.6-177.8-67.3177.7000113.7G581 Q586 L587 M588 L622 H627 F628G581-L584 WeakPolarHBondContact O-CG 3.48Å; L584-Q586 PolarHBondContact O-N 2.71Å; L584-L587 PolarHBondContact O-N 2.85Å; L584-M588 HydrophobicContact CD2-CE 3.88Å; L584-M588 WeakPolarHBondContact O-CB 3.46Å; L584-M588 VanDerWaalsContact O-CG 3.3Å; L584-M588 WeakPolarHBondContact O-CG 3.46Å; L584-M588 PolarHBondContact O-N 3.24Å; L584-L622 WeakPolarHBondContact CD1-O 3.21Å; L584-L622 HydrophobicContact CD2-CD2 4.09Å; L584-L622 WeakPolarHBondContact CD2-O 3.33Å; L584-H627 HydrophobicContact CD1-CB 4.36Å; L584-F628 HydrophobicContact CD1-CB 3.97Å; L584-F628 HydrophobicContact CD1-CD2 4.3Å; L584-F628 HydrophobicContact CD2-CD2 4.1Å
585S92.1Very high93.9Very high98 Ų9830 Ų3069%0.68517%0.168SC*.Hα-helixtrans-61.8-30.6-179.261.70000113.5F583 P589F583-S585 VanDerWaalsContact C-N 3.26Å; F583-S585 PolarHBondContact O-N 3.41Å; S585-P589 WeakPolarHBondContact O-CD 3.47Å; S585-P589 WeakPolarHBondContact O-CG 3.43Å
586Q94Very high94Very high68 Ų6829.8 Ų29.832%0.31817%0.167SC..Hα-helixtrans-89.4-35.6175.8-66.2-176.5-0.200111.8G546 L549 F583 L584 P589G546-Q586 PolarHBondContact O-OE1 3.4Å; L549-Q586 HydrophobicContact CD1-CB 3.93Å; F583-Q586 PolarHBondContact O-N 2.92Å; F583-Q586 VanDerWaalsContact O-N 3.14Å; L584-Q586 PolarHBondContact O-N 2.71Å; Q586-P589 WeakPolarHBondContact O-CD 3.1Å
587L94.1Very high93.9Very high1 Ų132.3 Ų32.31%0.00518%0.183CC..Hα-helixtrans-67.4-41.8179.6179.659.1000112.4L549 L573 F583 L584 L590 L591 L622L549-L587 HydrophobicContact CD1-CB 4.39Å; L549-L587 HydrophobicContact CD2-CD1 4.28Å; L573-L587 HydrophobicContact CD1-CD1 4.14Å; L573-L587 HydrophobicContact CD2-CD1 3.89Å; L573-L587 HydrophobicContact CD2-CD2 4.04Å; F583-L587 PolarHBondContact O-N 3.17Å; L584-L587 PolarHBondContact O-N 2.85Å; L587-L590 HydrophobicContact CD1-CD2 4.45Å; L587-L590 WeakPolarHBondContact O-CB 3.43Å; L587-L590 PolarHBondContact O-N 3.25Å; L587-L591 HydrophobicContact CD1-CD1 4.12Å; L587-L591 HydrophobicContact CD1-CD2 4.15Å; L587-L591 HydrophobicContact CD1-CG 3.84Å; L587-L591 HydrophobicContact CD2-CD1 4.24Å; L587-L591 HydrophobicContact CG-CD1 3.8Å; L587-L591 HydrophobicContact CG-CG 3.99Å; L587-L591 WeakPolarHBondContact O-CG 3.25Å; L587-L591 PolarHBondContact O-N 3.46Å; L587-L622 HydrophobicContact CD2-CD2 3.69Å
588M92.9Very high93.8Very high20 Ų2038.1 Ų38.110%0.09921%0.21CC..Hα-helixtrans-60.4-46.6-174.9-72.7-56.3129.600113.6L584 L590 L591 H592 F628 E631 F635L584-M588 HydrophobicContact CD2-CE 3.88Å; L584-M588 WeakPolarHBondContact O-CB 3.46Å; L584-M588 VanDerWaalsContact O-CG 3.3Å; L584-M588 WeakPolarHBondContact O-CG 3.46Å; L584-M588 PolarHBondContact O-N 3.24Å; M588-L590 VanDerWaalsContact C-N 3.32Å; M588-L590 PolarHBondContact O-N 3.15Å; M588-L591 HydrophobicContact CE-CD1 3.99Å; M588-L591 PolarHBondContact O-N 3.42Å; M588-L591 HydrophobicContact SD-CD1 4.36Å; M588-H592 WeakPolarHBondContact O-CB 3.45Å; M588-H592 PolarHBondContact O-N 3.28Å; M588-F628 HydrophobicContact CE-CD2 4.11Å; M588-F628 HydrophobicContact CE-CE2 3.68Å; M588-E631 HydrophobicContact CG-CB 4.26Å; M588-E631 HydrophobicContact CG-CG 4.35Å; M588-F635 HydrophobicContact SD-CD2 4.11Å
589P93.9Very high93.8Very high79 Ų7938 Ų3851%0.51320%0.204SC..Hα-helixtrans-57.6-40.9173-26.834.8000113.7S585 Q586 H592 N593S585-P589 WeakPolarHBondContact O-CD 3.47Å; S585-P589 WeakPolarHBondContact O-CG 3.43Å; Q586-P589 WeakPolarHBondContact O-CD 3.1Å; P589-H592 PolarHBondContact O-N 3.15Å; P589-N593 PolarHBondContact O-N 3.37Å
590L95Very high93.6Very high3 Ų340.7 Ų40.72%0.01622%0.218CC..Hα-helixtrans-63.7-47.8177.4179.8150.8000110.9L552 S553 V556 L569 L587 M588 H592 N593 C594L552-L590 HydrophobicContact CB-CD1 3.83Å; S553-L590 WeakPolarHBondContact OG-CD1 3.45Å; V556-L590 HydrophobicContact CG2-CG 4.44Å; L569-L590 HydrophobicContact CD1-CD2 3.67Å; L569-L590 HydrophobicContact CD2-CD2 3.71Å; L569-L590 HydrophobicContact CG-CD2 4.36Å; L587-L590 HydrophobicContact CD1-CD2 4.45Å; L587-L590 WeakPolarHBondContact O-CB 3.43Å; L587-L590 PolarHBondContact O-N 3.25Å; M588-L590 VanDerWaalsContact C-N 3.32Å; M588-L590 PolarHBondContact O-N 3.15Å; L590-H592 PolarHBondContact O-N 3.11Å; L590-N593 PolarHBondContact O-N 3.24Å; L590-C594 PolarHBondContact O-N 3.06Å; L590-C594 PolarHBondContact O-SG 3.23Å
591L94Very high93.6Very high1 Ų144.5 Ų44.51%0.00524%0.237CC..Hα-helixtrans-62.5-42.9176.9-67.2-180000111.9L587 M588 N593 C594 L595 V607 L611L587-L591 HydrophobicContact CD1-CD1 4.12Å; L587-L591 HydrophobicContact CD1-CD2 4.15Å; L587-L591 HydrophobicContact CD1-CG 3.84Å; L587-L591 HydrophobicContact CD2-CD1 4.24Å; L587-L591 HydrophobicContact CG-CD1 3.8Å; L587-L591 HydrophobicContact CG-CG 3.99Å; L587-L591 WeakPolarHBondContact O-CG 3.25Å; L587-L591 PolarHBondContact O-N 3.46Å; M588-L591 HydrophobicContact CE-CD1 3.99Å; M588-L591 PolarHBondContact O-N 3.42Å; M588-L591 HydrophobicContact SD-CD1 4.36Å; L591-N593 VanDerWaalsContact C-N 3.28Å; L591-N593 PolarHBondContact O-N 3.06Å; L591-C594 PolarHBondContact O-N 3.05Å; L591-L595 VanDerWaalsContact O-CB 3.28Å; L591-L595 WeakPolarHBondContact O-CB 3.48Å; L591-L595 WeakPolarHBondContact O-CG 3.4Å; L591-L595 PolarHBondContact O-N 3.32Å; L591-V607 HydrophobicContact CD2-CG1 4.12Å; L591-L611 HydrophobicContact CD1-CD1 4.25Å; L591-L611 HydrophobicContact CD1-CD2 3.73Å; L591-L611 HydrophobicContact CD2-CD1 4.2Å; L591-L611 HydrophobicContact CD2-CD2 4.04Å; L591-L611 HydrophobicContact CD2-CG 4.49Å
592H93.8Very high93.5Very high77 Ų7749.1 Ų49.136%0.35626%0.258SS..Hα-helixtrans-58.1-42.6177.3-179.678.5000111.3M588 P589 L590 L595 Q596 D638 V639M588-H592 WeakPolarHBondContact O-CB 3.45Å; M588-H592 PolarHBondContact O-N 3.28Å; P589-H592 PolarHBondContact O-N 3.15Å; L590-H592 PolarHBondContact O-N 3.11Å; H592-L595 PolarHBondContact O-N 2.9Å; H592-Q596 PolarHBondContact CE1-NE2 3.22Å; H592-Q596 PolarHBondContact ND1-NE2 2.85Å; H592-Q596 PolarHBondContact NE2-NE2 3.17Å; H592-Q596 VanDerWaalsContact NE2-NE2 3.19Å; H592-Q596 VanDerWaalsContact O-CG 3.31Å; H592-Q596 WeakPolarHBondContact O-CG 3.23Å; H592-Q596 PolarHBondContact O-N 3.15Å; H592-Q596 PolarHBondContact O-NE2 3.46Å; H592-D638 PolarHBondContact ND1-O 3.08Å; H592-V639 HydrophobicContact CB-CG2 4.16Å
593N93.9Very high93.4Very high38 Ų3845.7 Ų45.720%0.20324%0.242CC..Hα-helixtrans-66.5-45.7176.8-169.7-72000112.9V556 N557 P589 L590 L591 L595 R599V556-N593 HydrophobicContact CG1-CB 4.18Å; V556-N593 HydrophobicContact CG2-CB 4.16Å; N557-N593 PolarHBondContact OD1-ND2 2.77Å; P589-N593 PolarHBondContact O-N 3.37Å; L590-N593 PolarHBondContact O-N 3.24Å; L591-N593 VanDerWaalsContact C-N 3.28Å; L591-N593 PolarHBondContact O-N 3.06Å; N593-L595 PolarHBondContact O-N 2.9Å; N593-R599 WeakPolarHBondContact O-CG 3.36Å; N593-R599 PolarHBondContact O-NE 3.35Å; N593-R599 PolarHBondContact OD1-NE 2.93Å; N593-R599 PolarHBondContact OD1-NH2 2.99Å
594C93.9Very high93.4Very high0 Ų044.5 Ų44.50%024%0.237CC..Hα-helixtrans-60.5-33.9178.1-71.40000112.3V556 L590 L591 M603 R604V556-C594 WeakPolarHBondContact CG2-SG 3.41Å; L590-C594 PolarHBondContact O-N 3.06Å; L590-C594 PolarHBondContact O-SG 3.23Å; L591-C594 PolarHBondContact O-N 3.05Å; C594-M603 WeakPolarHBondContact O-CE 3.34Å; C594-R604 WeakPolarHBondContact O-CG 3.45Å
595L95Very high93.4Very high0 Ų046.3 Ų46.30%025%0.245CC..THydrogen-bonded Turntrans-102.39.9-169.7-63.4174.2000114.1L591 H592 N593 R604 V607 F608 L611 V639 N643L591-L595 VanDerWaalsContact O-CB 3.28Å; L591-L595 WeakPolarHBondContact O-CB 3.48Å; L591-L595 WeakPolarHBondContact O-CG 3.4Å; L591-L595 PolarHBondContact O-N 3.32Å; H592-L595 PolarHBondContact O-N 2.9Å; N593-L595 PolarHBondContact O-N 2.9Å; L595-R604 HydrophobicContact CD2-CB 4.18Å; L595-R604 HydrophobicContact CD2-CG 4.16Å; L595-V607 HydrophobicContact CD1-CG1 4.03Å; L595-V607 HydrophobicContact CD2-CB 3.84Å; L595-V607 HydrophobicContact CD2-CG1 3.76Å; L595-V607 HydrophobicContact CG-CG1 4Å; L595-F608 HydrophobicContact CB-CZ 4.2Å; L595-F608 HydrophobicContact CD1-CD1 4.17Å; L595-F608 HydrophobicContact CD1-CE1 3.74Å; L595-F608 HydrophobicContact CD1-CZ 4Å; L595-F608 HydrophobicContact CD2-CD1 4.28Å; L595-F608 HydrophobicContact CD2-CD2 3.79Å; L595-F608 HydrophobicContact CD2-CE1 4.13Å; L595-F608 HydrophobicContact CD2-CE2 3.63Å; L595-F608 HydrophobicContact CD2-CG 4.1Å; L595-F608 HydrophobicContact CD2-CZ 3.8Å; L595-F608 HydrophobicContact CG-CE1 4.41Å; L595-F608 HydrophobicContact CG-CZ 4.22Å; L595-L611 HydrophobicContact CD1-CD1 3.66Å; L595-V639 HydrophobicContact CB-CG1 3.65Å; L595-V639 HydrophobicContact CD1-CG1 3.37Å; L595-V639 HydrophobicContact CG-CG1 4.15Å; L595-N643 PolarHBondContact O-ND2 2.83Å
596Q94.1Very high93.4Very high51 Ų5143.6 Ų43.624%0.23823%0.226CC..  trans-62.6142173.9-72.6-51.5-63.500112H592 N598 R599 R604H592-Q596 PolarHBondContact CE1-NE2 3.22Å; H592-Q596 PolarHBondContact ND1-NE2 2.85Å; H592-Q596 PolarHBondContact NE2-NE2 3.17Å; H592-Q596 VanDerWaalsContact NE2-NE2 3.19Å; H592-Q596 VanDerWaalsContact O-CG 3.31Å; H592-Q596 WeakPolarHBondContact O-CG 3.23Å; H592-Q596 PolarHBondContact O-N 3.15Å; H592-Q596 PolarHBondContact O-NE2 3.46Å; Q596-N598 WeakPolarHBondContact CB-OD1 3.49Å; Q596-N598 PolarHBondContact O-N 3.09Å; Q596-R599 HydrophobicContact CB-CG 3.68Å; Q596-R599 VanDerWaalsContact O-CB 3.31Å; Q596-R599 WeakPolarHBondContact O-CB 3.42Å; Q596-R599 WeakPolarHBondContact O-CG 3.35Å; Q596-R599 PolarHBondContact O-N 2.92Å; Q596-R604 VanDerWaalsContact O-CD 3.32Å; Q596-R604 WeakPolarHBondContact O-CD 3.41Å
597P92.1Very high93.5Very high52 Ų5240.5 Ų40.534%0.33821%0.212SC..THydrogen-bonded Turntrans-57.9-25.6-177.2-28.635.9000116R599 R604 P642P597-R599 VanDerWaalsContact C-N 3.27Å; P597-R599 PolarHBondContact O-N 3.23Å; P597-R604 PolarHBondContact O-NH2 3.32Å; P597-P642 HydrophobicContact CG-CB 3.5Å; P597-P642 VanDerWaalsContact CG-CB 3.5Å
598N91.3Very high93.6Very high140 Ų14040.5 Ų40.575%0.74921%0.212SC*.THydrogen-bonded Turntrans-80.6-3.1178.566.9-14.8000114Q596Q596-N598 WeakPolarHBondContact CB-OD1 3.49Å; Q596-N598 PolarHBondContact O-N 3.09Å
599R93.4Very high93.6Very high41 Ų4142.3 Ų42.316%0.15523%0.225CC..SBendtrans-88.3164.2-178.8-48.9-67.9-94139.72.6111.1V556 N557 N593 Q596 P597 M601 M603 R604V556-R599 VanDerWaalsContact C-NH2 3.33Å; V556-R599 PolarHBondContact O-NH2 3.42Å; N557-R599 VanDerWaalsContact CA-NH2 3.3Å; N557-R599 PolarHBondContact O-NH1 3.32Å; N593-R599 WeakPolarHBondContact O-CG 3.36Å; N593-R599 PolarHBondContact O-NE 3.35Å; N593-R599 PolarHBondContact OD1-NE 2.93Å; N593-R599 PolarHBondContact OD1-NH2 2.99Å; Q596-R599 HydrophobicContact CB-CG 3.68Å; Q596-R599 VanDerWaalsContact O-CB 3.31Å; Q596-R599 WeakPolarHBondContact O-CB 3.42Å; Q596-R599 WeakPolarHBondContact O-CG 3.35Å; Q596-R599 PolarHBondContact O-N 2.92Å; P597-R599 VanDerWaalsContact C-N 3.27Å; P597-R599 PolarHBondContact O-N 3.23Å; R599-M601 PolarHBondContact O-N 3.4Å; R599-M603 HydrophobicContact CB-CE 3.94Å; R599-R604 HydrophobicContact CB-CG 4.42Å; R599-R604 PolarHBondContact O-NE 3.49Å; R599-R604 VanDerWaalsContact O-NE 3.13Å; R599-R604 PolarHBondContact O-NH2 3.05Å; R599-R604 VanDerWaalsContact O-NH2 3.14Å
600D93.3Very high93.7Very high56 Ų5638.9 Ų38.930%0.29920%0.202SC..  trans-49.7129.9178.7-178.7-94.5000112.2S561 E602 M603 R604S561-D600 WeakPolarHBondContact CB-OD1 3.4Å; S561-D600 PolarHBondContact N-OD1 2.84Å; D600-E602 PolarHBondContact OD1-N 3.04Å; D600-E602 VanDerWaalsContact OD1-N 3.17Å; D600-M603 HydrophobicContact CB-CB 4.04Å; D600-M603 WeakPolarHBondContact OD1-CB 3.33Å; D600-M603 PolarHBondContact OD1-N 2.86Å; D600-R604 WeakPolarHBondContact O-CG 3.47Å; D600-R604 PolarHBondContact O-N 3.02Å; D600-R604 VanDerWaalsContact O-N 3.15Å
601M92.6Very high93.6Very high82 Ų8238.8 Ų38.840%0.40420%0.201SC..Hα-helixtrans-70-42.4-171.3-65.8-179177.200112.1R599 R604 M605 T651 V655R599-M601 PolarHBondContact O-N 3.4Å; M601-R604 PolarHBondContact O-N 3.29Å; M601-M605 WeakPolarHBondContact O-CB 3.4Å; M601-M605 PolarHBondContact O-N 3.2Å; M601-T651 HydrophobicContact CB-CG2 3.66Å; M601-T651 HydrophobicContact CG-CG2 4.5Å; M601-T651 HydrophobicContact SD-CG2 4.07Å; M601-V655 HydrophobicContact CB-CG2 3.86Å; M601-V655 WeakPolarHBondContact O-CG2 3.45Å
602E91.7Very high93.6Very high99 Ų9939 Ų3946%0.46320%0.203SC..Hα-helixtrans-69.4-38.8-178.7-74177.2179.800111.5S561 D600 M605 S606 T651S561-E602 VanDerWaalsContact CB-OE2 3.28Å; S561-E602 WeakPolarHBondContact CB-OE2 3.07Å; S561-E602 PolarHBondContact OG-OE2 3.44Å; S561-E602 VanDerWaalsContact OG-OE2 3.1Å; D600-E602 PolarHBondContact OD1-N 3.04Å; D600-E602 VanDerWaalsContact OD1-N 3.17Å; E602-M605 WeakPolarHBondContact O-CB 3.47Å; E602-M605 PolarHBondContact O-N 2.97Å; E602-S606 PolarHBondContact O-N 3.39Å; E602-T651 HydrophobicContact CG-CG2 4.34Å
603M92.9Very high93.5Very high0 Ų041.7 Ų41.70%021%0.213CC..Hα-helixtrans-57.9-49.6171.3-177.7-1766800111.1W559 R566 C594 R599 D600 M605 S606 V607W559-M603 HydrophobicContact CB-CE 4.47Å; W559-M603 HydrophobicContact CB-SD 3.47Å; W559-M603 WeakPolarHBondContact CB-SD 3.33Å; W559-M603 HydrophobicContact CE3-SD 4.22Å; R566-M603 HydrophobicContact CB-CG 4.44Å; C594-M603 WeakPolarHBondContact O-CE 3.34Å; R599-M603 HydrophobicContact CB-CE 3.94Å; D600-M603 HydrophobicContact CB-CB 4.04Å; D600-M603 WeakPolarHBondContact OD1-CB 3.33Å; D600-M603 PolarHBondContact OD1-N 2.86Å; M603-M605 VanDerWaalsContact C-N 3.33Å; M603-M605 PolarHBondContact O-N 3.31Å; M603-S606 WeakPolarHBondContact O-CB 3.29Å; M603-S606 PolarHBondContact O-N 2.92Å; M603-V607 HydrophobicContact CG-CG2 4.5Å; M603-V607 WeakPolarHBondContact O-CG2 3.39Å; M603-V607 PolarHBondContact O-N 3.08Å
604R94.6Very high93.5Very high18 Ų1840.4 Ų40.47%0.06821%0.207CC..Hα-helixtrans-57.8-45.7177.7-75.7-169.9-75.3154.2-11.2112.4C594 L595 Q596 P597 R599 D600 M601 S606 V607 F608 N643 V655C594-R604 WeakPolarHBondContact O-CG 3.45Å; L595-R604 HydrophobicContact CD2-CB 4.18Å; L595-R604 HydrophobicContact CD2-CG 4.16Å; Q596-R604 VanDerWaalsContact O-CD 3.32Å; Q596-R604 WeakPolarHBondContact O-CD 3.41Å; P597-R604 PolarHBondContact O-NH2 3.32Å; R599-R604 HydrophobicContact CB-CG 4.42Å; R599-R604 PolarHBondContact O-NE 3.49Å; R599-R604 VanDerWaalsContact O-NE 3.13Å; R599-R604 PolarHBondContact O-NH2 3.05Å; R599-R604 VanDerWaalsContact O-NH2 3.14Å; D600-R604 WeakPolarHBondContact O-CG 3.47Å; D600-R604 PolarHBondContact O-N 3.02Å; D600-R604 VanDerWaalsContact O-N 3.15Å; M601-R604 PolarHBondContact O-N 3.29Å; R604-S606 VanDerWaalsContact C-N 3.32Å; R604-S606 PolarHBondContact O-N 3.14Å; R604-V607 PolarHBondContact O-N 3.04Å; R604-F608 WeakPolarHBondContact O-CB 3.33Å; R604-F608 VanDerWaalsContact O-CD2 3.23Å; R604-F608 WeakPolarHBondContact O-CD2 3.39Å; R604-F608 PolarHBondContact O-N 2.98Å; R604-N643 WeakPolarHBondContact CD-OD1 3.47Å; R604-N643 PolarHBondContact NH1-OD1 3.01Å; R604-V655 HydrophobicContact CB-CG1 4.25Å
605M93Very high93.4Very high48 Ų4840.5 Ų40.524%0.23621%0.207CC..Hα-helixtrans-56.1-47.2176.5-168-167.6-51.300111.7M601 E602 M603 F608 T609 T651 A654 V655 S658M601-M605 WeakPolarHBondContact O-CB 3.4Å; M601-M605 PolarHBondContact O-N 3.2Å; E602-M605 WeakPolarHBondContact O-CB 3.47Å; E602-M605 PolarHBondContact O-N 2.97Å; M603-M605 VanDerWaalsContact C-N 3.33Å; M603-M605 PolarHBondContact O-N 3.31Å; M605-F608 PolarHBondContact O-N 3.01Å; M605-T609 WeakPolarHBondContact O-CB 3.48Å; M605-T609 PolarHBondContact O-N 2.6Å; M605-T609 PolarHBondContact O-OG1 3.38Å; M605-T651 HydrophobicContact CE-CG2 4.31Å; M605-A654 HydrophobicContact CE-CB 3.4Å; M605-A654 VanDerWaalsContact CE-CB 3.4Å; M605-A654 HydrophobicContact SD-CB 4Å; M605-V655 HydrophobicContact CB-CG2 4.22Å; M605-V655 HydrophobicContact CE-CG2 4.38Å; M605-S658 WeakPolarHBondContact CG-OG 3.44Å
606S92.8Very high93.2Very high41 Ų4144.8 Ų44.829%0.28723%0.229SC..Hα-helixtrans-62.2-45.5178.4-174.30000111.9R566 E602 M603 R604 T609 M610R566-S606 PolarHBondContact NH1-OG 2.73Å; E602-S606 PolarHBondContact O-N 3.39Å; M603-S606 WeakPolarHBondContact O-CB 3.29Å; M603-S606 PolarHBondContact O-N 2.92Å; R604-S606 VanDerWaalsContact C-N 3.32Å; R604-S606 PolarHBondContact O-N 3.14Å; S606-T609 PolarHBondContact O-N 2.99Å; S606-M610 PolarHBondContact O-N 3.47Å; S606-M610 VanDerWaalsContact O-N 3.09Å
607V95Very high92.9Very high4 Ų446.1 Ų46.12%0.02424%0.238CC..Hα-helixtrans-66.6-43.7-179.9174.80000110.7L591 L595 M603 R604 T609 M610 L611L591-V607 HydrophobicContact CD2-CG1 4.12Å; L595-V607 HydrophobicContact CD1-CG1 4.03Å; L595-V607 HydrophobicContact CD2-CB 3.84Å; L595-V607 HydrophobicContact CD2-CG1 3.76Å; L595-V607 HydrophobicContact CG-CG1 4Å; M603-V607 HydrophobicContact CG-CG2 4.5Å; M603-V607 WeakPolarHBondContact O-CG2 3.39Å; M603-V607 PolarHBondContact O-N 3.08Å; R604-V607 PolarHBondContact O-N 3.04Å; V607-T609 VanDerWaalsContact C-N 3.33Å; V607-T609 PolarHBondContact O-N 3.18Å; V607-M610 HydrophobicContact CG1-CE 4.04Å; V607-M610 PolarHBondContact O-N 3.39Å; V607-L611 HydrophobicContact CG1-CD1 4.07Å; V607-L611 HydrophobicContact CG1-CG 4.35Å; V607-L611 WeakPolarHBondContact O-CG 3.33Å; V607-L611 PolarHBondContact O-N 3.38Å
608F96.3Very high92.7Very high0 Ų043.8 Ų43.80%022%0.223CC..Hα-helixtrans-61.2-41.1175.3-83-54.8000112.9L595 R604 M605 M610 L611 A612 V639 L640 N643 V655 A659 C662L595-F608 HydrophobicContact CB-CZ 4.2Å; L595-F608 HydrophobicContact CD1-CD1 4.17Å; L595-F608 HydrophobicContact CD1-CE1 3.74Å; L595-F608 HydrophobicContact CD1-CZ 4Å; L595-F608 HydrophobicContact CD2-CD1 4.28Å; L595-F608 HydrophobicContact CD2-CD2 3.79Å; L595-F608 HydrophobicContact CD2-CE1 4.13Å; L595-F608 HydrophobicContact CD2-CE2 3.63Å; L595-F608 HydrophobicContact CD2-CG 4.1Å; L595-F608 HydrophobicContact CD2-CZ 3.8Å; L595-F608 HydrophobicContact CG-CE1 4.41Å; L595-F608 HydrophobicContact CG-CZ 4.22Å; R604-F608 WeakPolarHBondContact O-CB 3.33Å; R604-F608 VanDerWaalsContact O-CD2 3.23Å; R604-F608 WeakPolarHBondContact O-CD2 3.39Å; R604-F608 PolarHBondContact O-N 2.98Å; M605-F608 PolarHBondContact O-N 3.01Å; F608-M610 VanDerWaalsContact C-N 3.33Å; F608-M610 PolarHBondContact O-N 3.2Å; F608-L611 PolarHBondContact O-N 2.88Å; F608-A612 WeakPolarHBondContact O-CB 3.4Å; F608-A612 PolarHBondContact O-N 3.3Å; F608-V639 HydrophobicContact CE1-CG1 4.29Å; F608-V639 HydrophobicContact CZ-CG1 4.43Å; F608-L640 HydrophobicContact CD1-CD2 4.27Å; F608-L640 HydrophobicContact CE1-CD2 3.72Å; F608-N643 HydrophobicContact CE2-CB 3.59Å; F608-N643 VanDerWaalsContact CE2-CG 3.46Å; F608-N643 HydrophobicContact CZ-CB 3.61Å; F608-V655 HydrophobicContact CE2-CG1 4.49Å; F608-A659 HydrophobicContact CD2-CB 4.25Å; F608-A659 HydrophobicContact CE1-CB 4.43Å; F608-A659 HydrophobicContact CE2-CB 4.12Å; F608-A659 HydrophobicContact CG-CB 4.48Å; F608-A659 HydrophobicContact CZ-CB 4.22Å; F608-C662 HydrophobicContact CD1-CB 3.96Å
609T93.6Very high92.6Very high59 Ų5944.6 Ų44.636%0.36222%0.22SC..Hα-helixtrans-62.9-41.2178.4-59.40000111.5M605 S606 V607 K613M605-T609 WeakPolarHBondContact O-CB 3.48Å; M605-T609 PolarHBondContact O-N 2.6Å; M605-T609 PolarHBondContact O-OG1 3.38Å; S606-T609 PolarHBondContact O-N 2.99Å; V607-T609 VanDerWaalsContact C-N 3.33Å; V607-T609 PolarHBondContact O-N 3.18Å; T609-K613 PolarHBondContact O-N 3.09Å
610M94.7Very high92.3Very high7 Ų747.1 Ų47.13%0.03424%0.237CC..Hα-helixtrans-62.8-49.5172.4167.5-169.473.400111.5L569 H570 L573 S606 V607 F608 A612 K613 L614L569-M610 HydrophobicContact CD2-CE 4.28Å; L569-M610 HydrophobicContact CG-CE 4.46Å; H570-M610 VanDerWaalsContact CA-SD 3.58Å; H570-M610 HydrophobicContact CB-SD 4.02Å; L573-M610 HydrophobicContact CB-SD 4.25Å; L573-M610 HydrophobicContact CD1-CE 3.5Å; L573-M610 HydrophobicContact CD1-SD 3.82Å; S606-M610 PolarHBondContact O-N 3.47Å; S606-M610 VanDerWaalsContact O-N 3.09Å; V607-M610 HydrophobicContact CG1-CE 4.04Å; V607-M610 PolarHBondContact O-N 3.39Å; F608-M610 VanDerWaalsContact C-N 3.33Å; F608-M610 PolarHBondContact O-N 3.2Å; M610-A612 VanDerWaalsContact C-N 3.28Å; M610-A612 PolarHBondContact O-N 2.97Å; M610-K613 WeakPolarHBondContact O-CB 3.44Å; M610-K613 PolarHBondContact O-N 3.37Å; M610-L614 HydrophobicContact CG-CD1 4.15Å; M610-L614 PolarHBondContact O-N 2.81Å; M610-L614 VanDerWaalsContact O-N 3.08Å
611L94.2Very high92.2Very high1 Ų145 Ų451%0.00523%0.226CC..Hα-helixtrans-60.4-38.9-179-72175.7000112.1L591 L595 V607 F608 K613 L614 L615 L622 F635L591-L611 HydrophobicContact CD1-CD1 4.25Å; L591-L611 HydrophobicContact CD1-CD2 3.73Å; L591-L611 HydrophobicContact CD2-CD1 4.2Å; L591-L611 HydrophobicContact CD2-CD2 4.04Å; L591-L611 HydrophobicContact CD2-CG 4.49Å; L595-L611 HydrophobicContact CD1-CD1 3.66Å; V607-L611 HydrophobicContact CG1-CD1 4.07Å; V607-L611 HydrophobicContact CG1-CG 4.35Å; V607-L611 WeakPolarHBondContact O-CG 3.33Å; V607-L611 PolarHBondContact O-N 3.38Å; F608-L611 PolarHBondContact O-N 2.88Å; L611-K613 VanDerWaalsContact C-N 3.28Å; L611-K613 PolarHBondContact O-N 3.47Å; L611-L614 HydrophobicContact CD2-CD1 4.43Å; L611-L614 PolarHBondContact O-N 3.11Å; L611-L615 WeakPolarHBondContact O-CB 3.43Å; L611-L615 WeakPolarHBondContact O-CG 3.3Å; L611-L615 PolarHBondContact O-N 3.39Å; L611-L622 HydrophobicContact CD2-CD1 4.44Å; L611-F635 HydrophobicContact CD1-CE2 4.24Å; L611-F635 HydrophobicContact CD1-CZ 4.04Å
612A93.8Very high92.1Very high4 Ų441.2 Ų41.23%0.03321%0.207CC..Hα-helixtrans-57.5-42.6174.500000111.5F608 M610 L615 L616 C662 A665F608-A612 WeakPolarHBondContact O-CB 3.4Å; F608-A612 PolarHBondContact O-N 3.3Å; M610-A612 VanDerWaalsContact C-N 3.28Å; M610-A612 PolarHBondContact O-N 2.97Å; A612-L615 PolarHBondContact O-N 2.88Å; A612-L616 VanDerWaalsContact O-CG 3.29Å; A612-L616 WeakPolarHBondContact O-CG 3.34Å; A612-L616 PolarHBondContact O-N 2.91Å; A612-C662 HydrophobicContact CB-CB 4.31Å; A612-A665 HydrophobicContact CB-CB 4.47Å; A612-A665 WeakPolarHBondContact O-CB 3.35Å
613K92.3Very high92Very high134 Ų13437.5 Ų37.558%0.58319%0.191SC*.Hα-helixtrans-64.4-43.8176.5-67.3177-178.3179.10112.3T609 M610 L611 L616T609-K613 PolarHBondContact O-N 3.09Å; M610-K613 WeakPolarHBondContact O-CB 3.44Å; M610-K613 PolarHBondContact O-N 3.37Å; L611-K613 VanDerWaalsContact C-N 3.28Å; L611-K613 PolarHBondContact O-N 3.47Å; K613-L616 PolarHBondContact O-N 3.42Å
614L92.6Very high91.9Very high12 Ų1239 Ų396%0.06320%0.201CC..Hα-helixtrans-63.1-46177.2-63.2173.4000110.7L573 I580 M610 L611 L616 D617 A618 T621 L622L573-L614 HydrophobicContact CB-CD1 4.01Å; L573-L614 HydrophobicContact CD1-CD1 4.33Å; I580-L614 HydrophobicContact CD1-CD1 4.13Å; I580-L614 HydrophobicContact CD1-CD2 4.36Å; M610-L614 HydrophobicContact CG-CD1 4.15Å; M610-L614 PolarHBondContact O-N 2.81Å; M610-L614 VanDerWaalsContact O-N 3.08Å; L611-L614 HydrophobicContact CD2-CD1 4.43Å; L611-L614 PolarHBondContact O-N 3.11Å; L614-L616 VanDerWaalsContact C-N 3.31Å; L614-L616 PolarHBondContact O-N 2.99Å; L614-D617 CarbonylContact O-C 3.59Å; L614-D617 PolarHBondContact O-N 3.4Å; L614-A618 PolarHBondContact O-N 2.96Å; L614-A618 VanDerWaalsContact O-N 3.11Å; L614-T621 HydrophobicContact CD2-CG2 4.14Å; L614-T621 PolarHBondContact O-OG1 2.85Å; L614-L622 HydrophobicContact CB-CD1 3.96Å; L614-L622 HydrophobicContact CB-CG 4.2Å
615L91.8Very high91.6Very high1 Ų142.4 Ų42.41%0.00522%0.218CC..Hα-helixtrans-64.4-30.6179.5-72.7169.1000113.8L611 A612 D617 A618 L622 F628 C662 A665 L666L611-L615 WeakPolarHBondContact O-CB 3.43Å; L611-L615 WeakPolarHBondContact O-CG 3.3Å; L611-L615 PolarHBondContact O-N 3.39Å; A612-L615 PolarHBondContact O-N 2.88Å; L615-D617 PolarHBondContact O-N 3.27Å; L615-A618 WeakPolarHBondContact O-CB 3.22Å; L615-A618 PolarHBondContact O-N 3.29Å; L615-A618 VanDerWaalsContact O-N 3.15Å; L615-L622 HydrophobicContact CD2-CD1 3.71Å; L615-L622 HydrophobicContact CG-CD1 3.88Å; L615-F628 HydrophobicContact CD2-CE1 3.77Å; L615-F628 HydrophobicContact CD2-CZ 3.76Å; L615-C662 VanDerWaalsContact CD1-SG 3.56Å; L615-A665 HydrophobicContact CB-CB 3.78Å; L615-L666 HydrophobicContact CD1-CB 4.26Å; L615-L666 HydrophobicContact CD1-CD1 4.37Å; L615-L666 HydrophobicContact CD2-CD1 4.06Å
616L90.4Very high91.3Very high90 Ų9042 Ų4247%0.47123%0.225SC..Hα-helixtrans-61.1-27.3174.2-76.6171.9000112.8A612 K613 L614 A665 R669A612-L616 VanDerWaalsContact O-CG 3.29Å; A612-L616 WeakPolarHBondContact O-CG 3.34Å; A612-L616 PolarHBondContact O-N 2.91Å; K613-L616 PolarHBondContact O-N 3.42Å; L614-L616 VanDerWaalsContact C-N 3.31Å; L614-L616 PolarHBondContact O-N 2.99Å; L616-A665 HydrophobicContact CD2-CB 4.05Å; L616-A665 HydrophobicContact CG-CB 3.97Å; L616-R669 PolarHBondContact O-NE 2.92Å
617D88.7Confident91Very high79 Ų7945.2 Ų45.242%0.42224%0.236SC..THydrogen-bonded Turntrans-119.241.1173-166.323.5000111.4L614 L615 K619 N620 T621L614-D617 CarbonylContact O-C 3.59Å; L614-D617 PolarHBondContact O-N 3.4Å; L615-D617 PolarHBondContact O-N 3.27Å; D617-K619 PolarHBondContact O-N 3Å; D617-K619 VanDerWaalsContact O-N 3.14Å; D617-N620 PolarHBondContact O-N 3.19Å; D617-N620 PolarHBondContact OD1-ND2 3.19Å; D617-T621 PolarHBondContact O-N 2.89Å; D617-T621 PolarHBondContact O-OG1 3.48Å
618A88.1Confident90.6Very high3 Ų345 Ų453%0.02524%0.235CC..G310 helixtrans-53.2-40.3-172.600000113.1L614 L615 N620 T621 L622 D623L614-A618 PolarHBondContact O-N 2.96Å; L614-A618 VanDerWaalsContact O-N 3.11Å; L615-A618 WeakPolarHBondContact O-CB 3.22Å; L615-A618 PolarHBondContact O-N 3.29Å; L615-A618 VanDerWaalsContact O-N 3.15Å; A618-N620 PolarHBondContact O-N 3.43Å; A618-N620 VanDerWaalsContact O-N 3.16Å; A618-T621 WeakPolarHBondContact CA-OG1 3.24Å; A618-T621 CarbonylContact O-C 3.54Å; A618-T621 PolarHBondContact O-N 3.39Å; A618-L622 PolarHBondContact O-N 3.37Å; A618-D623 HydrophobicContact CB-CB 4.05Å; A618-D623 CarbonylContact O-C 3.57Å; A618-D623 WeakPolarHBondContact O-CA 3.28Å; A618-D623 PolarHBondContact O-N 3.49Å
619K88.1Confident90Very high157 Ų15750.3 Ų50.368%0.68326%0.255SS*.G310 helixtrans-61.1-25.1-178.8-67.6-173.3178.3-175.90114D617 S624D617-K619 PolarHBondContact O-N 3Å; D617-K619 VanDerWaalsContact O-N 3.14Å; K619-S624 WeakPolarHBondContact O-CA 3.46Å
620N88.8Confident89.6Confident94 Ų9452.7 Ų52.750%0.50327%0.265SS..G310 helixtrans-109.39.3178.3-57.5-55.7000112.2G577 P578 D617 A618G577-N620 CarbonylContact C-O 3.58Å; P578-N620 WeakPolarHBondContact CA-O 3.5Å; P578-N620 WeakPolarHBondContact CB-O 3.48Å; P578-N620 VanDerWaalsContact N-O 3.13Å; D617-N620 PolarHBondContact O-N 3.19Å; D617-N620 PolarHBondContact OD1-ND2 3.19Å; A618-N620 PolarHBondContact O-N 3.43Å; A618-N620 VanDerWaalsContact O-N 3.16Å
621T91.2Very high89.2Confident13 Ų1355 Ų558%0.0828%0.276CS..THydrogen-bonded Turntrans-137.5-102.9-177.660.60000111I580 G581 L614 D617 A618 D623 S624I580-T621 WeakPolarHBondContact CG1-O 3.42Å; G581-T621 PolarHBondContact N-O 3.3Å; L614-T621 HydrophobicContact CD2-CG2 4.14Å; L614-T621 PolarHBondContact O-OG1 2.85Å; D617-T621 PolarHBondContact O-N 2.89Å; D617-T621 PolarHBondContact O-OG1 3.48Å; A618-T621 WeakPolarHBondContact CA-OG1 3.24Å; A618-T621 CarbonylContact O-C 3.54Å; A618-T621 PolarHBondContact O-N 3.39Å; T621-D623 PolarHBondContact O-N 2.77Å; T621-S624 WeakPolarHBondContact O-CB 3.4Å; T621-S624 PolarHBondContact O-N 2.74Å; T621-S624 PolarHBondContact O-OG 3.37Å
622L90.4Very high89Confident2 Ų255 Ų551%0.0128%0.276CS..THydrogen-bonded Turntrans-65.2-36.2-173.9-72.1169.8000113.3I580 G581 L584 L587 L611 L614 L615 A618 F628I580-L622 HydrophobicContact CD1-CB 4.48Å; I580-L622 HydrophobicContact CD1-CD2 3.51Å; I580-L622 HydrophobicContact CD1-CG 3.74Å; I580-L622 HydrophobicContact CG1-CD2 4.11Å; G581-L622 WeakPolarHBondContact CA-O 3.47Å; L584-L622 WeakPolarHBondContact CD1-O 3.21Å; L584-L622 HydrophobicContact CD2-CD2 4.09Å; L584-L622 WeakPolarHBondContact CD2-O 3.33Å; L587-L622 HydrophobicContact CD2-CD2 3.69Å; L611-L622 HydrophobicContact CD2-CD1 4.44Å; L614-L622 HydrophobicContact CB-CD1 3.96Å; L614-L622 HydrophobicContact CB-CG 4.2Å; L615-L622 HydrophobicContact CD2-CD1 3.71Å; L615-L622 HydrophobicContact CG-CD1 3.88Å; A618-L622 PolarHBondContact O-N 3.37Å; L622-F628 HydrophobicContact CB-CD2 3.96Å; L622-F628 HydrophobicContact CB-CE2 4.29Å; L622-F628 HydrophobicContact CB-CG 4.43Å; L622-F628 HydrophobicContact CD1-CE2 4.23Å
623D89.9Confident88.8Confident21 Ų2157.9 Ų57.911%0.11229%0.288CS..THydrogen-bonded Turntrans-10525.8-178.6-161.335000112.3A618 T621 Q625 G626 H627 F628A618-D623 HydrophobicContact CB-CB 4.05Å; A618-D623 CarbonylContact O-C 3.57Å; A618-D623 WeakPolarHBondContact O-CA 3.28Å; A618-D623 PolarHBondContact O-N 3.49Å; T621-D623 PolarHBondContact O-N 2.77Å; D623-Q625 PolarHBondContact O-N 3.25Å; D623-G626 PolarHBondContact O-N 2.91Å; D623-G626 WeakPolarHBondContact OD1-CA 3.31Å; D623-H627 PolarHBondContact OD1-N 3.4Å; D623-F628 HydrophobicContact CB-CB 3.7Å; D623-F628 VanDerWaalsContact OD1-CB 3.26Å; D623-F628 WeakPolarHBondContact OD1-CB 3.4Å; D623-F628 PolarHBondContact OD1-N 2.95Å
624S90.2Very high88.7Confident31 Ų3156 Ų5622%0.21728%0.28CS..THydrogen-bonded Turntrans-59.6-29179.565.20000113.6P578 G581 K619 T621P578-S624 WeakPolarHBondContact O-CB 3.46Å; P578-S624 PolarHBondContact O-OG 3.01Å; G581-S624 WeakPolarHBondContact CA-OG 3.28Å; K619-S624 WeakPolarHBondContact O-CA 3.46Å; T621-S624 WeakPolarHBondContact O-CB 3.4Å; T621-S624 PolarHBondContact O-N 2.74Å; T621-S624 PolarHBondContact O-OG 3.37Å
625Q87.7Confident88.6Confident90 Ų9055.8 Ų55.842%0.42128%0.279SS..THydrogen-bonded Turntrans-96.6-2.2176.8-57.8-57.7-48.700113.1E582 D623 H627E582-Q625 HydrophobicContact CG-CG 3.88Å; D623-Q625 PolarHBondContact O-N 3.25Å; Q625-H627 PolarHBondContact O-N 3.47Å
626G86.8Confident88.7Confident38 Ų3855.8 Ų55.839%0.39228%0.279SS..SBendtrans72.91.4-174.500000115.3D623D623-G626 PolarHBondContact O-N 2.91Å; D623-G626 WeakPolarHBondContact OD1-CA 3.31Å
627H86.1Confident88.8Confident109 Ų10955.4 Ų55.451%0.50527%0.271SS..  trans-89.4-6.5-177.2-59.5146.3000113.8L584 D623 Q625 R629 D630L584-H627 HydrophobicContact CD1-CB 4.36Å; D623-H627 PolarHBondContact OD1-N 3.4Å; Q625-H627 PolarHBondContact O-N 3.47Å; H627-R629 PolarHBondContact O-N 3.3Å; H627-D630 WeakPolarHBondContact O-CB 3.43Å; H627-D630 PolarHBondContact O-N 3.48Å; H627-D630 VanDerWaalsContact O-N 3.07Å
628F87.2Confident88.9Confident1 Ų154.3 Ų54.30%0.00427%0.266CS..Hα-helixtrans-64.3-29.1179.2-176.6-95.5000111.4L584 M588 L615 L622 D623 D630 E631 S632 F635 L666 A671L584-F628 HydrophobicContact CD1-CB 3.97Å; L584-F628 HydrophobicContact CD1-CD2 4.3Å; L584-F628 HydrophobicContact CD2-CD2 4.1Å; M588-F628 HydrophobicContact CE-CD2 4.11Å; M588-F628 HydrophobicContact CE-CE2 3.68Å; L615-F628 HydrophobicContact CD2-CE1 3.77Å; L615-F628 HydrophobicContact CD2-CZ 3.76Å; L622-F628 HydrophobicContact CB-CD2 3.96Å; L622-F628 HydrophobicContact CB-CE2 4.29Å; L622-F628 HydrophobicContact CB-CG 4.43Å; L622-F628 HydrophobicContact CD1-CE2 4.23Å; D623-F628 HydrophobicContact CB-CB 3.7Å; D623-F628 VanDerWaalsContact OD1-CB 3.26Å; D623-F628 WeakPolarHBondContact OD1-CB 3.4Å; D623-F628 PolarHBondContact OD1-N 2.95Å; F628-D630 PolarHBondContact O-N 3.17Å; F628-E631 CarbonylContact O-C 3.58Å; F628-E631 PolarHBondContact O-N 2.98Å; F628-E631 VanDerWaalsContact O-N 3.09Å; F628-S632 WeakPolarHBondContact O-CB 3.38Å; F628-S632 PolarHBondContact O-N 3.28Å; F628-F635 HydrophobicContact CZ-CD1 4.37Å; F628-L666 HydrophobicContact CE1-CD1 3.6Å; F628-L666 HydrophobicContact CZ-CD1 4.23Å; F628-A671 HydrophobicContact CD1-CB 3.98Å; F628-A671 HydrophobicContact CE1-CB 4.12Å
629R83.3Confident89.2Confident111 Ų11154.4 Ų54.442%0.41927%0.266SS..Hα-helixtrans-56.4-30.1173.2-68.3178.2150.4-158.8-7.8113.7H627 E631 S632 G670 Q676H627-R629 PolarHBondContact O-N 3.3Å; R629-E631 VanDerWaalsContact C-N 3.3Å; R629-S632 PolarHBondContact O-OG 3.32Å; R629-G670 PolarHBondContact NE-O 3.31Å; R629-G670 VanDerWaalsContact NE-O 3.15Å; R629-G670 PolarHBondContact NH2-O 3.28Å; R629-Q676 PolarHBondContact O-NE2 3.05Å
630D85.9Confident89.4Confident109 Ų10947 Ų4758%0.58323%0.233SC*.Hα-helixtrans-75.1-25.7-179.5-59.3-37.4000111.7H627 F628H627-D630 WeakPolarHBondContact O-CB 3.43Å; H627-D630 PolarHBondContact O-N 3.48Å; H627-D630 VanDerWaalsContact O-N 3.07Å; F628-D630 PolarHBondContact O-N 3.17Å
631E86.8Confident89.7Confident55 Ų5543.1 Ų43.126%0.25721%0.213SC..Hα-helixtrans-102.1-10.7178.6-66.5-60.4144.300112.9M588 F628 R629 E633 K634 F635M588-E631 HydrophobicContact CG-CB 4.26Å; M588-E631 HydrophobicContact CG-CG 4.35Å; F628-E631 CarbonylContact O-C 3.58Å; F628-E631 PolarHBondContact O-N 2.98Å; F628-E631 VanDerWaalsContact O-N 3.09Å; R629-E631 VanDerWaalsContact C-N 3.3Å; E631-E633 VanDerWaalsContact C-N 3.34Å; E631-E633 PolarHBondContact O-N 2.73Å; E631-K634 PolarHBondContact O-N 3.21Å; E631-K634 IonicContact OE1-NZ 2.61Å; E631-K634 PolarHBondContact OE1-NZ 3.18Å; E631-K634 WeakPolarHBondContact OE2-CD 3.3Å; E631-K634 IonicContact OE2-NZ 3.31Å; E631-K634 PolarHBondContact OE2-NZ 3Å; E631-F635 WeakPolarHBondContact O-CB 3.48Å; E631-F635 PolarHBondContact O-N 3.44Å
632S88.4Confident89.9Confident0 Ų044.3 Ų44.30%022%0.221CC..Hα-helixtrans-63.6-34.1-172.466.60000113.8F628 R629 L636 A671 Q676F628-S632 WeakPolarHBondContact O-CB 3.38Å; F628-S632 PolarHBondContact O-N 3.28Å; R629-S632 PolarHBondContact O-OG 3.32Å; S632-L636 VanDerWaalsContact O-CB 3.3Å; S632-L636 WeakPolarHBondContact O-CB 3.39Å; S632-L636 PolarHBondContact O-N 2.77Å; S632-A671 WeakPolarHBondContact CB-O 3.22Å; S632-A671 PolarHBondContact OG-O 3.05Å; S632-Q676 PolarHBondContact OG-OE1 2.69Å; S632-Q676 VanDerWaalsContact OG-OE1 3.11Å
633E89.6Confident90.2Very high65 Ų6544.5 Ų44.530%0.30422%0.222SC..Hα-helixtrans-66.6-46.3175.3-170.6-166.3128.800111.4E631 L636 R637 Q676 L680E631-E633 VanDerWaalsContact C-N 3.34Å; E631-E633 PolarHBondContact O-N 2.73Å; E633-L636 PolarHBondContact O-N 3.06Å; E633-R637 VanDerWaalsContact O-CB 3.31Å; E633-R637 WeakPolarHBondContact O-CB 3.42Å; E633-R637 PolarHBondContact O-N 3.28Å; E633-R637 IonicContact OE1-NH1 3.63Å; E633-R637 PolarHBondContact OE1-NH1 3.46Å; E633-Q676 HydrophobicContact CB-CB 4.32Å; E633-Q676 HydrophobicContact CB-CG 4.1Å; E633-Q676 HydrophobicContact CG-CB 4.49Å; E633-L680 HydrophobicContact CG-CD1 3.76Å; E633-L680 HydrophobicContact CG-CG 4.42Å
634K90.3Very high90.4Very high94 Ų9443.5 Ų43.541%0.40922%0.217SC..Hα-helixtrans-65.1-42176.6-59.6-174.8-157.1141.70110.8E631 L636 R637 D638E631-K634 PolarHBondContact O-N 3.21Å; E631-K634 IonicContact OE1-NZ 2.61Å; E631-K634 PolarHBondContact OE1-NZ 3.18Å; E631-K634 WeakPolarHBondContact OE2-CD 3.3Å; E631-K634 IonicContact OE2-NZ 3.31Å; E631-K634 PolarHBondContact OE2-NZ 3Å; K634-L636 PolarHBondContact O-N 2.91Å; K634-R637 PolarHBondContact O-N 3.4Å; K634-D638 WeakPolarHBondContact O-CA 3.43Å; K634-D638 VanDerWaalsContact O-CB 3.24Å; K634-D638 WeakPolarHBondContact O-CB 3.41Å; K634-D638 PolarHBondContact O-N 3.07Å
635F92.2Very high90.6Very high8 Ų845 Ų454%0.03522%0.224CC..Hα-helixtrans-60.2-45.8175.2-178.6-99.8000111.4M588 L611 F628 E631 V639 L640 L666M588-F635 HydrophobicContact SD-CD2 4.11Å; L611-F635 HydrophobicContact CD1-CE2 4.24Å; L611-F635 HydrophobicContact CD1-CZ 4.04Å; F628-F635 HydrophobicContact CZ-CD1 4.37Å; E631-F635 WeakPolarHBondContact O-CB 3.48Å; E631-F635 PolarHBondContact O-N 3.44Å; F635-V639 HydrophobicContact CD2-CB 3.93Å; F635-V639 HydrophobicContact CD2-CG1 4.16Å; F635-V639 HydrophobicContact CD2-CG2 4Å; F635-V639 HydrophobicContact CE2-CB 4.02Å; F635-V639 HydrophobicContact CE2-CG1 3.73Å; F635-V639 HydrophobicContact CE2-CG2 4.36Å; F635-V639 HydrophobicContact CG-CB 4.47Å; F635-V639 HydrophobicContact CZ-CG1 4.23Å; F635-V639 WeakPolarHBondContact O-CA 3.24Å; F635-V639 WeakPolarHBondContact O-CB 3.46Å; F635-V639 PolarHBondContact O-N 3.38Å; F635-L640 HydrophobicContact CD1-CD1 3.92Å; F635-L640 HydrophobicContact CD1-CG 4.22Å; F635-L640 HydrophobicContact CE1-CD1 3.6Å; F635-L640 HydrophobicContact CE1-CD2 4.42Å; F635-L640 HydrophobicContact CE1-CG 3.75Å; F635-L640 HydrophobicContact CZ-CG 4.35Å; F635-L640 PolarHBondContact O-N 3.44Å; F635-L666 HydrophobicContact CD1-CD2 4.42Å
636L92.3Very high90.9Very high2 Ų247.6 Ų47.61%0.0123%0.23CC..Iπ-helixtrans-60.1-52.7176.1-176.158.3000110.6S632 E633 K634 L640 L641 L663 L666 L677 L680 L684S632-L636 VanDerWaalsContact O-CB 3.3Å; S632-L636 WeakPolarHBondContact O-CB 3.39Å; S632-L636 PolarHBondContact O-N 2.77Å; E633-L636 PolarHBondContact O-N 3.06Å; K634-L636 PolarHBondContact O-N 2.91Å; L636-L640 HydrophobicContact CD1-CB 3.99Å; L636-L640 HydrophobicContact CD1-CD1 3.77Å; L636-L640 PolarHBondContact O-N 3.37Å; L636-L641 WeakPolarHBondContact O-CG 3.34Å; L636-L641 PolarHBondContact O-N 3.03Å; L636-L663 HydrophobicContact CD1-CD1 3.75Å; L636-L666 HydrophobicContact CD1-CD2 4.35Å; L636-L677 HydrophobicContact CD2-CD1 4.3Å; L636-L680 HydrophobicContact CB-CD1 4.03Å; L636-L680 HydrophobicContact CD2-CB 4.34Å; L636-L680 HydrophobicContact CD2-CD1 3.74Å; L636-L680 HydrophobicContact CG-CD1 3.94Å; L636-L684 HydrophobicContact CD1-CD1 4.44Å
637R92.6Very high91.1Very high81 Ų8150.6 Ų50.631%0.30623%0.234SC..Iπ-helixtrans-67.2-47.4-174.9-173.7-175.763-132-6.1113.9E633 K634 P642 L680E633-R637 VanDerWaalsContact O-CB 3.31Å; E633-R637 WeakPolarHBondContact O-CB 3.42Å; E633-R637 PolarHBondContact O-N 3.28Å; E633-R637 IonicContact OE1-NH1 3.63Å; E633-R637 PolarHBondContact OE1-NH1 3.46Å; K634-R637 PolarHBondContact O-N 3.4Å; R637-P642 WeakPolarHBondContact O-CD 3.31Å; R637-L680 HydrophobicContact CB-CD1 4.15Å; R637-L680 HydrophobicContact CB-CD2 4.17Å; R637-L680 HydrophobicContact CG-CD2 4.17Å
638D91.5Very high91.2Very high57 Ų5749.1 Ų49.131%0.30524%0.241SC..Iπ-helixtrans-100.9-13.2-165.5-53.4-30.5000112.4H592 K634H592-D638 PolarHBondContact ND1-O 3.08Å; K634-D638 WeakPolarHBondContact O-CA 3.43Å; K634-D638 VanDerWaalsContact O-CB 3.24Å; K634-D638 WeakPolarHBondContact O-CB 3.41Å; K634-D638 PolarHBondContact O-N 3.07Å
639V93.3Very high91.3Very high5 Ų551.5 Ų51.53%0.0327%0.265CS..Iπ-helixtrans-119-53.4179.6-178.70000112.4H592 L595 F608 F635 N643H592-V639 HydrophobicContact CB-CG2 4.16Å; L595-V639 HydrophobicContact CB-CG1 3.65Å; L595-V639 HydrophobicContact CD1-CG1 3.37Å; L595-V639 HydrophobicContact CG-CG1 4.15Å; F608-V639 HydrophobicContact CE1-CG1 4.29Å; F608-V639 HydrophobicContact CZ-CG1 4.43Å; F635-V639 HydrophobicContact CD2-CB 3.93Å; F635-V639 HydrophobicContact CD2-CG1 4.16Å; F635-V639 HydrophobicContact CD2-CG2 4Å; F635-V639 HydrophobicContact CE2-CB 4.02Å; F635-V639 HydrophobicContact CE2-CG1 3.73Å; F635-V639 HydrophobicContact CE2-CG2 4.36Å; F635-V639 HydrophobicContact CG-CB 4.47Å; F635-V639 HydrophobicContact CZ-CG1 4.23Å; F635-V639 WeakPolarHBondContact O-CA 3.24Å; F635-V639 WeakPolarHBondContact O-CB 3.46Å; F635-V639 PolarHBondContact O-N 3.38Å; V639-N643 PolarHBondContact O-ND2 3.27Å
640L94.2Very high91.6Very high0 Ų057.2 Ų57.20%029%0.287CS..Iπ-helixtrans-76.2-52.9-175.3-78.4170.6000113.2F608 F635 L636 N643 L644 C662 L663 L666F608-L640 HydrophobicContact CD1-CD2 4.27Å; F608-L640 HydrophobicContact CE1-CD2 3.72Å; F635-L640 HydrophobicContact CD1-CD1 3.92Å; F635-L640 HydrophobicContact CD1-CG 4.22Å; F635-L640 HydrophobicContact CE1-CD1 3.6Å; F635-L640 HydrophobicContact CE1-CD2 4.42Å; F635-L640 HydrophobicContact CE1-CG 3.75Å; F635-L640 HydrophobicContact CZ-CG 4.35Å; F635-L640 PolarHBondContact O-N 3.44Å; L636-L640 HydrophobicContact CD1-CB 3.99Å; L636-L640 HydrophobicContact CD1-CD1 3.77Å; L636-L640 PolarHBondContact O-N 3.37Å; L640-N643 PolarHBondContact O-N 2.88Å; L640-L644 PolarHBondContact O-N 2.95Å; L640-C662 HydrophobicContact CD2-CB 3.92Å; L640-L663 HydrophobicContact CD1-CD1 4.44Å; L640-L666 HydrophobicContact CD1-CD2 3.58Å
641L94.8Very high91.8Very high13 Ų1355 Ų557%0.06828%0.277CS..Hα-helixtrans-54.2-45.8-175.7-64.3-178.5000113.1L636 N643 L644 K683 L684 L687L636-L641 WeakPolarHBondContact O-CG 3.34Å; L636-L641 PolarHBondContact O-N 3.03Å; L641-N643 PolarHBondContact O-N 3.38Å; L641-N643 VanDerWaalsContact O-N 3.14Å; L641-L644 PolarHBondContact O-N 3.32Å; L641-K683 HydrophobicContact CD1-CB 3.91Å; L641-L684 HydrophobicContact CD2-CB 4Å; L641-L684 HydrophobicContact CD2-CD1 3.53Å; L641-L684 HydrophobicContact CD2-CG 4.39Å; L641-L687 HydrophobicContact CB-CD1 4.04Å; L641-L687 HydrophobicContact CD2-CD1 3.89Å; L641-L687 WeakPolarHBondContact O-CD1 3.42Å
642P95.2Very high92Very high38 Ų3853.1 Ų53.125%0.24727%0.271CS..Hα-helixtrans-61.5-25.9179.8-23.835.8000113.8P597 R637P597-P642 HydrophobicContact CG-CB 3.5Å; P597-P642 VanDerWaalsContact CG-CB 3.5Å; R637-P642 WeakPolarHBondContact O-CD 3.31Å
643N95.5Very high92.1Very high6 Ų654 Ų543%0.03228%0.278CS..Hα-helixtrans-91.4-5.9179.6-72.2-82.9000113.7L595 R604 F608 V639 L640 L641 A659L595-N643 PolarHBondContact O-ND2 2.83Å; R604-N643 WeakPolarHBondContact CD-OD1 3.47Å; R604-N643 PolarHBondContact NH1-OD1 3.01Å; F608-N643 HydrophobicContact CE2-CB 3.59Å; F608-N643 VanDerWaalsContact CE2-CG 3.46Å; F608-N643 HydrophobicContact CZ-CB 3.61Å; V639-N643 PolarHBondContact O-ND2 3.27Å; L640-N643 PolarHBondContact O-N 2.88Å; L641-N643 PolarHBondContact O-N 3.38Å; L641-N643 VanDerWaalsContact O-N 3.14Å; N643-A659 HydrophobicContact CB-CB 4.03Å
644L95.3Very high92.3Very high1 Ų152.5 Ų52.51%0.00528%0.277CS..Hα-helixtrans-92-6.3172.3-67.1171.5000112.8L640 L641 W646 R656 A659 L660 L663 L684 L687L640-L644 PolarHBondContact O-N 2.95Å; L641-L644 PolarHBondContact O-N 3.32Å; L644-W646 PolarHBondContact O-N 3.09Å; L644-R656 HydrophobicContact CD2-CG 4.38Å; L644-R656 WeakPolarHBondContact O-CD 3.23Å; L644-A659 HydrophobicContact CD2-CB 3.88Å; L644-A659 HydrophobicContact CG-CB 4.37Å; L644-L660 HydrophobicContact CD2-CB 4.49Å; L644-L660 HydrophobicContact CD2-CD2 3.64Å; L644-L660 HydrophobicContact CD2-CG 3.66Å; L644-L663 HydrophobicContact CD1-CD2 4.03Å; L644-L684 HydrophobicContact CD1-CD1 4.03Å; L644-L687 HydrophobicContact CB-CB 3.96Å; L644-L687 HydrophobicContact CB-CD1 4.06Å
645V94.4Very high92.5Very high61 Ų6148.2 Ų48.237%0.3726%0.259SS..SBendtrans-66.2130.2175.7-179.90000110H647 L687V645-H647 PolarHBondContact O-N 3.44Å; V645-H647 PolarHBondContact O-ND1 2.82Å; V645-L687 HydrophobicContact CG2-CD2 4.06Å
646W93.5Very high92.6Very high145 Ų14548 Ų4855%0.54926%0.258SS..  trans-64.3134.7177.6-175.3102.1000111.3L644 A648 R656 E694L644-W646 PolarHBondContact O-N 3.09Å; W646-A648 HydrophobicContact CH2-CB 3.79Å; W646-A648 HydrophobicContact CZ2-CB 4.43Å; W646-A648 HydrophobicContact CZ3-CB 4.24Å; W646-R656 VanDerWaalsContact CD1-CZ 3.47Å; W646-E694 VanDerWaalsContact CD1-OE1 3.24Å; W646-E694 PolarHBondContact NE1-OE1 3.26Å
647H90.1Very high92.8Very high101 Ų10149 Ų4947%0.46826%0.264SS..  trans-141.9146172.2-63.884.2000108.6V645 A652V645-H647 PolarHBondContact O-N 3.44Å; V645-H647 PolarHBondContact O-ND1 2.82Å; H647-A652 HydrophobicContact CB-CB 3.91Å
648A88.4Confident92.9Very high79 Ų7945.8 Ų45.865%0.65325%0.254SS*.SBendtrans-67.6143.1179.400000112.1W646W646-A648 HydrophobicContact CH2-CB 3.79Å; W646-A648 HydrophobicContact CZ2-CB 4.43Å; W646-A648 HydrophobicContact CZ3-CB 4.24Å
649G90.8Very high93.2Very high50 Ų5043 Ų4352%0.51524%0.239SC..SBendtrans111.5149.3172.700000114.3T651 A652 A653G649-T651 PolarHBondContact O-N 3.33Å; G649-A652 PolarHBondContact O-N 3.43Å; G649-A653 PolarHBondContact O-N 2.7Å
650R88.8Confident93.3Very high231 Ų23142.8 Ų42.887%0.87224%0.238SC*.Hα-helixtrans-61.8-40.8-173.7-67.5-170.8-71176.7-2.3113.4A653 A654R650-A653 PolarHBondContact O-N 3.24Å; R650-A654 PolarHBondContact O-N 2.87Å
651T89.8Confident93.4Very high63 Ų6345 Ų4539%0.38725%0.253SS..Hα-helixtrans-67.1-41.8179.3-45.40000111.4M601 E602 M605 G649 A654 V655M601-T651 HydrophobicContact CB-CG2 3.66Å; M601-T651 HydrophobicContact CG-CG2 4.5Å; M601-T651 HydrophobicContact SD-CG2 4.07Å; E602-T651 HydrophobicContact CG-CG2 4.34Å; M605-T651 HydrophobicContact CE-CG2 4.31Å; G649-T651 PolarHBondContact O-N 3.33Å; T651-A654 PolarHBondContact O-N 2.97Å; T651-V655 WeakPolarHBondContact O-CG2 3.42Å; T651-V655 PolarHBondContact O-N 3.38Å
652A90.6Very high93.4Very high15 Ų1544.3 Ų44.312%0.12425%0.249CC..Hα-helixtrans-64.9-39.3176.300000112.2H647 G649 V655 R656H647-A652 HydrophobicContact CB-CB 3.91Å; G649-A652 PolarHBondContact O-N 3.43Å; A652-V655 PolarHBondContact O-N 2.9Å; A652-R656 PolarHBondContact O-N 3.04Å; A652-R656 VanDerWaalsContact O-N 3.14Å
653A91.9Very high93.4Very high18 Ų1842.5 Ų42.515%0.14924%0.238CC..Hα-helixtrans-59.2-45.9171.100000111.7G649 R650 V655 R656 T657 E694G649-A653 PolarHBondContact O-N 2.7Å; R650-A653 PolarHBondContact O-N 3.24Å; A653-V655 PolarHBondContact O-N 3.35Å; A653-R656 PolarHBondContact O-N 2.94Å; A653-T657 PolarHBondContact O-N 2.8Å; A653-T657 PolarHBondContact O-OG1 2.99Å; A653-E694 WeakPolarHBondContact CB-OE2 3.48Å
654A93Very high93.4Very high34 Ų3442.9 Ų42.928%0.28124%0.239SC..Hα-helixtrans-64.8-36.4178.800000113.9M605 R650 T651 R656 T657 S658M605-A654 HydrophobicContact CE-CB 3.4Å; M605-A654 VanDerWaalsContact CE-CB 3.4Å; M605-A654 HydrophobicContact SD-CB 4Å; R650-A654 PolarHBondContact O-N 2.87Å; T651-A654 PolarHBondContact O-N 2.97Å; A654-R656 VanDerWaalsContact C-N 3.35Å; A654-T657 WeakPolarHBondContact O-CB 3.49Å; A654-T657 PolarHBondContact O-N 2.77Å; A654-S658 PolarHBondContact O-N 3.15Å; A654-S658 PolarHBondContact O-OG 3.1Å
655V94.5Very high93.3Very high5 Ų543 Ų433%0.0324%0.241CC..Hα-helixtrans-60-47.2171.4174.50000110.4M601 R604 M605 F608 T651 A652 A653 T657 S658 A659M601-V655 HydrophobicContact CB-CG2 3.86Å; M601-V655 WeakPolarHBondContact O-CG2 3.45Å; R604-V655 HydrophobicContact CB-CG1 4.25Å; M605-V655 HydrophobicContact CB-CG2 4.22Å; M605-V655 HydrophobicContact CE-CG2 4.38Å; F608-V655 HydrophobicContact CE2-CG1 4.49Å; T651-V655 WeakPolarHBondContact O-CG2 3.42Å; T651-V655 PolarHBondContact O-N 3.38Å; A652-V655 PolarHBondContact O-N 2.9Å; A653-V655 PolarHBondContact O-N 3.35Å; V655-T657 PolarHBondContact O-N 2.75Å; V655-S658 WeakPolarHBondContact O-CB 3.12Å; V655-S658 PolarHBondContact O-N 2.85Å; V655-S658 VanDerWaalsContact O-N 3.1Å; V655-A659 PolarHBondContact O-N 3.19Å
656R94.5Very high93.2Very high4 Ų440.1 Ų40.12%0.01522%0.223CC..Hα-helixtrans-65-38178.5179.2159.244.4113.47112.5L644 W646 A652 A653 A654 S658 A659 L660 E694L644-R656 HydrophobicContact CD2-CG 4.38Å; L644-R656 WeakPolarHBondContact O-CD 3.23Å; W646-R656 VanDerWaalsContact CD1-CZ 3.47Å; A652-R656 PolarHBondContact O-N 3.04Å; A652-R656 VanDerWaalsContact O-N 3.14Å; A653-R656 PolarHBondContact O-N 2.94Å; A654-R656 VanDerWaalsContact C-N 3.35Å; R656-S658 VanDerWaalsContact C-N 3.27Å; R656-S658 PolarHBondContact O-N 3.17Å; R656-A659 PolarHBondContact O-N 3.13Å; R656-L660 HydrophobicContact CG-CD1 4.28Å; R656-L660 WeakPolarHBondContact O-CB 3.49Å; R656-L660 WeakPolarHBondContact O-CG 3.31Å; R656-L660 PolarHBondContact O-N 3.07Å; R656-E694 IonicContact CZ-OE1 3.73Å; R656-E694 IonicContact CZ-OE2 3.41Å; R656-E694 IonicContact NH1-OE1 3.86Å; R656-E694 PolarHBondContact NH1-OE1 3.31Å; R656-E694 IonicContact NH1-OE2 2.66Å; R656-E694 IonicContact NH2-OE1 3.47Å; R656-E694 PolarHBondContact NH2-OE1 3.03Å; R656-E694 IonicContact NH2-OE2 3.38Å; R656-E694 PolarHBondContact NH2-OE2 3Å
657T95.4Very high93.1Very high21 Ų2133.4 Ų33.413%0.12920%0.198CC..Hα-helixtrans-56.6-42.9170.4-48.10000111.6A653 A654 V655 L660 S661 M698 S699 L702A653-T657 PolarHBondContact O-N 2.8Å; A653-T657 PolarHBondContact O-OG1 2.99Å; A654-T657 WeakPolarHBondContact O-CB 3.49Å; A654-T657 PolarHBondContact O-N 2.77Å; V655-T657 PolarHBondContact O-N 2.75Å; T657-L660 PolarHBondContact O-N 3.36Å; T657-S661 PolarHBondContact O-N 2.99Å; T657-M698 HydrophobicContact CG2-CB 4.22Å; T657-M698 HydrophobicContact CG2-CG 3.8Å; T657-S699 PolarHBondContact OG1-OG 3.34Å; T657-L702 HydrophobicContact CG2-CD1 3.94Å
658S96.1Very high92.7Very high14 Ų1433.3 Ų33.310%0.09820%0.198CC..Hα-helixtrans-69.3-38.7178.9-54.90000111.7M605 A654 V655 R656 S661 C662M605-S658 WeakPolarHBondContact CG-OG 3.44Å; A654-S658 PolarHBondContact O-N 3.15Å; A654-S658 PolarHBondContact O-OG 3.1Å; V655-S658 WeakPolarHBondContact O-CB 3.12Å; V655-S658 PolarHBondContact O-N 2.85Å; V655-S658 VanDerWaalsContact O-N 3.1Å; R656-S658 VanDerWaalsContact C-N 3.27Å; R656-S658 PolarHBondContact O-N 3.17Å; S658-S661 WeakPolarHBondContact O-CB 3.35Å; S658-S661 PolarHBondContact O-N 3.36Å; S658-C662 PolarHBondContact O-N 3.14Å
659A96.7Very high92Very high0 Ų036.9 Ų36.90%019%0.194CC..Hα-helixtrans-64-40.3172.600000112.1F608 N643 L644 V655 R656 S661 C662 L663F608-A659 HydrophobicContact CD2-CB 4.25Å; F608-A659 HydrophobicContact CE1-CB 4.43Å; F608-A659 HydrophobicContact CE2-CB 4.12Å; F608-A659 HydrophobicContact CG-CB 4.48Å; F608-A659 HydrophobicContact CZ-CB 4.22Å; N643-A659 HydrophobicContact CB-CB 4.03Å; L644-A659 HydrophobicContact CD2-CB 3.88Å; L644-A659 HydrophobicContact CG-CB 4.37Å; V655-A659 PolarHBondContact O-N 3.19Å; R656-A659 PolarHBondContact O-N 3.13Å; A659-S661 VanDerWaalsContact C-N 3.35Å; A659-C662 WeakPolarHBondContact O-CB 3.4Å; A659-C662 PolarHBondContact O-N 3.48Å; A659-L663 WeakPolarHBondContact O-CB 3.47Å; A659-L663 PolarHBondContact O-N 3.22Å
660L96.1Very high91Very high0 Ų035.6 Ų35.60%018%0.181CC..Hα-helixtrans-63.5-39173.3-74164.6000112.1L644 R656 T657 C662 L663 L664 A691 L702L644-L660 HydrophobicContact CD2-CB 4.49Å; L644-L660 HydrophobicContact CD2-CD2 3.64Å; L644-L660 HydrophobicContact CD2-CG 3.66Å; R656-L660 HydrophobicContact CG-CD1 4.28Å; R656-L660 WeakPolarHBondContact O-CB 3.49Å; R656-L660 WeakPolarHBondContact O-CG 3.31Å; R656-L660 PolarHBondContact O-N 3.07Å; T657-L660 PolarHBondContact O-N 3.36Å; L660-C662 VanDerWaalsContact C-N 3.34Å; L660-L663 HydrophobicContact CD2-CD2 4.46Å; L660-L663 PolarHBondContact O-N 2.85Å; L660-L664 WeakPolarHBondContact O-CB 3.36Å; L660-L664 PolarHBondContact O-N 3.46Å; L660-A691 HydrophobicContact CD1-CB 3.67Å; L660-A691 HydrophobicContact CD2-CB 4.17Å; L660-A691 HydrophobicContact CG-CB 4.49Å; L660-L702 HydrophobicContact CB-CB 3.95Å; L660-L702 HydrophobicContact CB-CD1 4.3Å
661S96.3Very high90.6Very high45 Ų4524.6 Ų24.632%0.31514%0.14SC..Hα-helixtrans-61.6-44.5174.1-174.60000111.2T657 S658 A659 L664 A665T657-S661 PolarHBondContact O-N 2.99Å; S658-S661 WeakPolarHBondContact O-CB 3.35Å; S658-S661 PolarHBondContact O-N 3.36Å; A659-S661 VanDerWaalsContact C-N 3.35Å; S661-L664 PolarHBondContact O-N 3.13Å; S661-A665 PolarHBondContact O-N 3.38Å
662C95.5Very high90.4Very high0 Ų021.9 Ų21.90%012%0.123CC..Hα-helixtrans-63.8-43.4175.5-169.10000112F608 A612 L615 L640 S658 A659 L660 A665 L666F608-C662 HydrophobicContact CD1-CB 3.96Å; A612-C662 HydrophobicContact CB-CB 4.31Å; L615-C662 VanDerWaalsContact CD1-SG 3.56Å; L640-C662 HydrophobicContact CD2-CB 3.92Å; S658-C662 PolarHBondContact O-N 3.14Å; A659-C662 WeakPolarHBondContact O-CB 3.4Å; A659-C662 PolarHBondContact O-N 3.48Å; L660-C662 VanDerWaalsContact C-N 3.34Å; C662-A665 PolarHBondContact O-N 2.9Å; C662-L666 WeakPolarHBondContact O-CB 3.12Å; C662-L666 PolarHBondContact O-N 2.85Å
663L95.3Very high90.3Very high0 Ų023.1 Ų23.10%013%0.129CC..Hα-helixtrans-58.7-47.6173.9175.466.9000111.5L636 L640 L644 A659 L660 A665 L666 L667 L684 V688L636-L663 HydrophobicContact CD1-CD1 3.75Å; L640-L663 HydrophobicContact CD1-CD1 4.44Å; L644-L663 HydrophobicContact CD1-CD2 4.03Å; A659-L663 WeakPolarHBondContact O-CB 3.47Å; A659-L663 PolarHBondContact O-N 3.22Å; L660-L663 HydrophobicContact CD2-CD2 4.46Å; L660-L663 PolarHBondContact O-N 2.85Å; L663-A665 VanDerWaalsContact C-N 3.34Å; L663-A665 PolarHBondContact O-N 2.89Å; L663-L666 WeakPolarHBondContact O-CB 3.49Å; L663-L666 PolarHBondContact O-N 3.48Å; L663-L667 HydrophobicContact CD1-CD1 4.11Å; L663-L667 HydrophobicContact CD1-CG 4.26Å; L663-L667 HydrophobicContact CG-CD1 3.98Å; L663-L667 HydrophobicContact CG-CG 4.49Å; L663-L667 VanDerWaalsContact O-CG 3.31Å; L663-L667 WeakPolarHBondContact O-CG 3.32Å; L663-L667 PolarHBondContact O-N 3.3Å; L663-L684 HydrophobicContact CD1-CD1 4.13Å; L663-L684 HydrophobicContact CD1-CD2 4.44Å; L663-L684 HydrophobicContact CD2-CD1 3.93Å; L663-V688 HydrophobicContact CD2-CG2 3.74Å
664L94.8Very high90.1Very high13 Ų1325.3 Ų25.37%0.06814%0.142CC..Hα-helixtrans-62.4-42.8-179.9-17660.7000111.8L660 S661 L666 L667 H668 L702 R705 A709L660-L664 WeakPolarHBondContact O-CB 3.36Å; L660-L664 PolarHBondContact O-N 3.46Å; S661-L664 PolarHBondContact O-N 3.13Å; L664-L666 VanDerWaalsContact C-N 3.31Å; L664-L666 PolarHBondContact O-N 3.02Å; L664-L667 PolarHBondContact O-N 3.36Å; L664-H668 VanDerWaalsContact CD1-CE1 3.43Å; L664-H668 WeakPolarHBondContact CD1-CE1 3.19Å; L664-H668 WeakPolarHBondContact CD1-NE2 3.31Å; L664-H668 PolarHBondContact O-N 2.89Å; L664-L702 HydrophobicContact CD2-CD2 3.65Å; L664-R705 HydrophobicContact CD1-CB 3.8Å; L664-R705 HydrophobicContact CD2-CB 3.73Å; L664-R705 HydrophobicContact CG-CB 4.44Å; L664-A709 HydrophobicContact CD1-CB 4.35Å
665A93.3Very high89.9Confident4 Ų425.9 Ų25.93%0.03315%0.151CC..Hα-helixtrans-60.3-42.2175.400000111.6A612 L615 L616 S661 C662 L663 L667A612-A665 HydrophobicContact CB-CB 4.47Å; A612-A665 WeakPolarHBondContact O-CB 3.35Å; L615-A665 HydrophobicContact CB-CB 3.78Å; L616-A665 HydrophobicContact CD2-CB 4.05Å; L616-A665 HydrophobicContact CG-CB 3.97Å; S661-A665 PolarHBondContact O-N 3.38Å; C662-A665 PolarHBondContact O-N 2.9Å; L663-A665 VanDerWaalsContact C-N 3.34Å; L663-A665 PolarHBondContact O-N 2.89Å; A665-L667 VanDerWaalsContact C-N 3.35Å; A665-L667 PolarHBondContact O-N 3.36Å
666L91.9Very high89.6Confident0 Ų027.1 Ų27.10%016%0.156CC..Hα-helixtrans-60.1-41.8176.2-174.168.7000112.3L615 F628 F635 L636 L640 C662 L663 L664 A671 V672L615-L666 HydrophobicContact CD1-CB 4.26Å; L615-L666 HydrophobicContact CD1-CD1 4.37Å; L615-L666 HydrophobicContact CD2-CD1 4.06Å; F628-L666 HydrophobicContact CE1-CD1 3.6Å; F628-L666 HydrophobicContact CZ-CD1 4.23Å; F635-L666 HydrophobicContact CD1-CD2 4.42Å; L636-L666 HydrophobicContact CD1-CD2 4.35Å; L640-L666 HydrophobicContact CD1-CD2 3.58Å; C662-L666 WeakPolarHBondContact O-CB 3.12Å; C662-L666 PolarHBondContact O-N 2.85Å; L663-L666 WeakPolarHBondContact O-CB 3.49Å; L663-L666 PolarHBondContact O-N 3.48Å; L664-L666 VanDerWaalsContact C-N 3.31Å; L664-L666 PolarHBondContact O-N 3.02Å; L666-A671 HydrophobicContact CD1-CB 3.88Å; L666-V672 HydrophobicContact CD1-CG2 3.72Å; L666-V672 HydrophobicContact CD2-CG2 3.56Å; L666-V672 HydrophobicContact CG-CG2 3.43Å; L666-V672 VanDerWaalsContact CG-CG2 3.43Å
667L90.6Very high89.4Confident5 Ų526.9 Ų26.93%0.02616%0.155CC..Hα-helixtrans-73.8-40.3-178.2-65.5169.9000113L663 L664 A665 R669 L677 A709 L713L663-L667 HydrophobicContact CD1-CD1 4.11Å; L663-L667 HydrophobicContact CD1-CG 4.26Å; L663-L667 HydrophobicContact CG-CD1 3.98Å; L663-L667 HydrophobicContact CG-CG 4.49Å; L663-L667 VanDerWaalsContact O-CG 3.31Å; L663-L667 WeakPolarHBondContact O-CG 3.32Å; L663-L667 PolarHBondContact O-N 3.3Å; L664-L667 PolarHBondContact O-N 3.36Å; A665-L667 VanDerWaalsContact C-N 3.35Å; A665-L667 PolarHBondContact O-N 3.36Å; L667-R669 PolarHBondContact O-N 3.45Å; L667-L677 HydrophobicContact CD2-CD1 3.98Å; L667-L677 HydrophobicContact CD2-CD2 3.69Å; L667-L677 HydrophobicContact CD2-CG 4.5Å; L667-A709 HydrophobicContact CB-CB 3.73Å; L667-A709 HydrophobicContact CD1-CB 4.09Å; L667-L713 HydrophobicContact CB-CD1 4.31Å; L667-L713 HydrophobicContact CD2-CD1 3.98Å
668H83.3Confident89.2Confident98 Ų9828.8 Ų28.845%0.45416%0.164SC..Hα-helixtrans-72.3-21.4-172.4-79.3175.6000115.9L664L664-H668 VanDerWaalsContact CD1-CE1 3.43Å; L664-H668 WeakPolarHBondContact CD1-CE1 3.19Å; L664-H668 WeakPolarHBondContact CD1-NE2 3.31Å; L664-H668 PolarHBondContact O-N 2.89Å
669R72.4Confident88.9Confident155 Ų15531.7 Ų31.759%0.58519%0.185SC*.THydrogen-bonded Turntrans-111.710.2-171.7-66.5-60.6-165.1-157.40.7115L616 L667 A671L616-R669 PolarHBondContact O-NE 2.92Å; L667-R669 PolarHBondContact O-N 3.45Å; R669-A671 VanDerWaalsContact C-N 3.25Å; R669-A671 PolarHBondContact O-N 3.3Å
670G70.3Confident88.6Confident23 Ų2332.1 Ų32.124%0.23719%0.187CC..THydrogen-bonded Turntrans70.221.1174.400000114.4R629R629-G670 PolarHBondContact NE-O 3.31Å; R629-G670 VanDerWaalsContact NE-O 3.15Å; R629-G670 PolarHBondContact NH2-O 3.28Å
671A80.1Confident88.3Confident0 Ų032.8 Ų32.80%019%0.19CC..  trans-71.5-20.8173.500000112.2F628 S632 L666 R669F628-A671 HydrophobicContact CD1-CB 3.98Å; F628-A671 HydrophobicContact CE1-CB 4.12Å; S632-A671 WeakPolarHBondContact CB-O 3.22Å; S632-A671 PolarHBondContact OG-O 3.05Å; L666-A671 HydrophobicContact CD1-CB 3.88Å; R669-A671 VanDerWaalsContact C-N 3.25Å; R669-A671 PolarHBondContact O-N 3.3Å
672V86.8Confident88Confident5 Ų538.8 Ų38.83%0.0321%0.213CC..SBendtrans-110.3137169171.40000109.3L666 Q676 L677L666-V672 HydrophobicContact CD1-CG2 3.72Å; L666-V672 HydrophobicContact CD2-CG2 3.56Å; L666-V672 HydrophobicContact CG-CG2 3.43Å; L666-V672 VanDerWaalsContact CG-CG2 3.43Å; V672-Q676 HydrophobicContact CG1-CB 4.18Å; V672-L677 HydrophobicContact CG1-CB 3.92Å
673T87.6Confident87.8Confident41 Ų4144.9 Ų44.925%0.25224%0.24SC..  trans-81.5150.5174.266.40000111.6G675 Q676 L677T673-G675 PolarHBondContact O-N 2.93Å; T673-Q676 PolarHBondContact O-N 3.14Å; T673-Q676 VanDerWaalsContact OG1-CG 3.22Å; T673-Q676 WeakPolarHBondContact OG1-CG 3.34Å; T673-Q676 PolarHBondContact OG1-N 3.32Å; T673-Q676 PolarHBondContact OG1-OE1 3.25Å; T673-L677 PolarHBondContact O-N 2.84Å; T673-L677 VanDerWaalsContact O-N 3.07Å
674P88.3Confident87.7Confident65 Ų6545 Ų4542%0.42224%0.241SC..Hα-helixtrans-53.9-37.8176.1-28.936.3000113.6L677 L678 V714P674-L677 PolarHBondContact O-N 3.48Å; P674-L678 WeakPolarHBondContact O-CB 3.41Å; P674-L678 WeakPolarHBondContact O-CG 3.37Å; P674-L678 PolarHBondContact O-N 2.71Å; P674-V714 HydrophobicContact CB-CG1 3.83Å; P674-V714 VanDerWaalsContact O-CG1 3.24Å; P674-V714 WeakPolarHBondContact O-CG1 3.38Å
675G87.4Confident87.6Confident46 Ų4645.2 Ų45.247%0.47424%0.243SC..Hα-helixtrans-64.8-43.3178.300000113.5T673 L678 S679T673-G675 PolarHBondContact O-N 2.93Å; G675-L678 PolarHBondContact O-N 3.32Å; G675-S679 PolarHBondContact O-N 2.88Å; G675-S679 VanDerWaalsContact O-N 3.09Å
676Q89.2Confident87.6Confident30 Ų3048.6 Ų48.614%0.1426%0.264CS..Hα-helixtrans-64.9-42175.7-71.1165.9-40.200111.3R629 S632 E633 V672 T673 S679 L680R629-Q676 PolarHBondContact O-NE2 3.05Å; S632-Q676 PolarHBondContact OG-OE1 2.69Å; S632-Q676 VanDerWaalsContact OG-OE1 3.11Å; E633-Q676 HydrophobicContact CB-CB 4.32Å; E633-Q676 HydrophobicContact CB-CG 4.1Å; E633-Q676 HydrophobicContact CG-CB 4.49Å; V672-Q676 HydrophobicContact CG1-CB 4.18Å; T673-Q676 PolarHBondContact O-N 3.14Å; T673-Q676 VanDerWaalsContact OG1-CG 3.22Å; T673-Q676 WeakPolarHBondContact OG1-CG 3.34Å; T673-Q676 PolarHBondContact OG1-N 3.32Å; T673-Q676 PolarHBondContact OG1-OE1 3.25Å; Q676-S679 PolarHBondContact O-N 3.25Å; Q676-S679 PolarHBondContact O-OG 3.38Å; Q676-L680 PolarHBondContact O-N 2.92Å
677L90.6Very high87.8Confident0 Ų050.2 Ų50.20%027%0.273CS..Hα-helixtrans-63.9-43.5177.5-175.559.2000111.7L636 L667 V672 T673 P674 S679 L680 E681 L684 T710 L713 V714L636-L677 HydrophobicContact CD2-CD1 4.3Å; L667-L677 HydrophobicContact CD2-CD1 3.98Å; L667-L677 HydrophobicContact CD2-CD2 3.69Å; L667-L677 HydrophobicContact CD2-CG 4.5Å; V672-L677 HydrophobicContact CG1-CB 3.92Å; T673-L677 PolarHBondContact O-N 2.84Å; T673-L677 VanDerWaalsContact O-N 3.07Å; P674-L677 PolarHBondContact O-N 3.48Å; L677-S679 VanDerWaalsContact C-N 3.32Å; L677-S679 PolarHBondContact O-N 3.16Å; L677-L680 CarbonylContact O-C 3.5Å; L677-L680 PolarHBondContact O-N 3Å; L677-E681 PolarHBondContact O-N 3.38Å; L677-L684 HydrophobicContact CD1-CD2 3.59Å; L677-T710 HydrophobicContact CD2-CG2 4.17Å; L677-L713 HydrophobicContact CD2-CB 4.06Å; L677-L713 HydrophobicContact CD2-CD1 3.91Å; L677-V714 HydrophobicContact CB-CG1 4.07Å; L677-V714 HydrophobicContact CD2-CG1 3.98Å; L677-V714 HydrophobicContact CD2-CG2 3.96Å; L677-V714 HydrophobicContact CG-CG1 4.19Å; L677-V714 HydrophobicContact CG-CG2 4.17Å
678L90.5Very high88Confident60 Ų6050 Ų5031%0.31427%0.272SS..Hα-helixtrans-57.3-43.8174.7-81.3163.7000112P674 G675 L680 E681 V714 L718P674-L678 WeakPolarHBondContact O-CB 3.41Å; P674-L678 WeakPolarHBondContact O-CG 3.37Å; P674-L678 PolarHBondContact O-N 2.71Å; G675-L678 PolarHBondContact O-N 3.32Å; L678-L680 PolarHBondContact O-N 3.42Å; L678-L680 VanDerWaalsContact O-N 3.16Å; L678-E681 PolarHBondContact O-N 3.1Å; L678-V714 HydrophobicContact CD1-CB 4.46Å; L678-V714 HydrophobicContact CD1-CG1 4.23Å; L678-V714 HydrophobicContact CD2-CB 3.85Å; L678-V714 HydrophobicContact CD2-CG1 4.31Å; L678-V714 HydrophobicContact CD2-CG2 4.42Å; L678-V714 HydrophobicContact CG-CB 3.82Å; L678-V714 HydrophobicContact CG-CG1 3.7Å; L678-L718 HydrophobicContact CD2-CD2 3.72Å
679S89.9Confident88.6Confident76 Ų7646.5 Ų46.553%0.53126%0.256SS..Hα-helixtrans-63.4-20.9-179.576.70000114.3G675 Q676 L677G675-S679 PolarHBondContact O-N 2.88Å; G675-S679 VanDerWaalsContact O-N 3.09Å; Q676-S679 PolarHBondContact O-N 3.25Å; Q676-S679 PolarHBondContact O-OG 3.38Å; L677-S679 VanDerWaalsContact C-N 3.32Å; L677-S679 PolarHBondContact O-N 3.16Å
680L90.8Very high89.6Confident8 Ų841 Ų414%0.04224%0.242CC..Hα-helixtrans-112.61.4-178.4-68.1174.2000113E633 L636 R637 Q676 L677 L678 E682 K683 L684E633-L680 HydrophobicContact CG-CD1 3.76Å; E633-L680 HydrophobicContact CG-CG 4.42Å; L636-L680 HydrophobicContact CB-CD1 4.03Å; L636-L680 HydrophobicContact CD2-CB 4.34Å; L636-L680 HydrophobicContact CD2-CD1 3.74Å; L636-L680 HydrophobicContact CG-CD1 3.94Å; R637-L680 HydrophobicContact CB-CD1 4.15Å; R637-L680 HydrophobicContact CB-CD2 4.17Å; R637-L680 HydrophobicContact CG-CD2 4.17Å; Q676-L680 PolarHBondContact O-N 2.92Å; L677-L680 CarbonylContact O-C 3.5Å; L677-L680 PolarHBondContact O-N 3Å; L678-L680 PolarHBondContact O-N 3.42Å; L678-L680 VanDerWaalsContact O-N 3.16Å; L680-E682 PolarHBondContact O-N 3.39Å; L680-K683 PolarHBondContact O-N 3.18Å; L680-K683 VanDerWaalsContact O-N 3.11Å; L680-L684 WeakPolarHBondContact O-CB 3.49Å; L680-L684 PolarHBondContact O-N 2.82Å
681E89.3Confident90.8Very high15 Ų1539.9 Ų39.97%0.0723%0.23CC..Hα-helixtrans-61.1-43.8-172.6-171.2-85.5162.900112L677 L678 K683 L684 S685 L718L677-E681 PolarHBondContact O-N 3.38Å; L678-E681 PolarHBondContact O-N 3.1Å; E681-K683 PolarHBondContact O-N 3.04Å; E681-K683 VanDerWaalsContact O-N 3.11Å; E681-L684 PolarHBondContact O-N 3.48Å; E681-L684 VanDerWaalsContact O-N 3.08Å; E681-S685 VanDerWaalsContact O-CB 3.27Å; E681-S685 WeakPolarHBondContact O-CB 3.3Å; E681-S685 PolarHBondContact O-N 3.18Å; E681-S685 VanDerWaalsContact OE1-CB 3.25Å; E681-S685 WeakPolarHBondContact OE1-CB 3.17Å; E681-S685 PolarHBondContact OE1-OG 2.89Å; E681-L718 HydrophobicContact CB-CD2 4.25Å; E681-L718 HydrophobicContact CG-CD2 3.63Å
682E89.5Confident91.4Very high171 Ų17139.9 Ų39.980%0.79923%0.23SC*.Hα-helixtrans-58.1-30178.8-67.1-171.2161.300113L680 P686L680-E682 PolarHBondContact O-N 3.39Å; E682-P686 WeakPolarHBondContact O-CD 3.4Å; E682-P686 WeakPolarHBondContact O-CG 3.19Å
683K92.4Very high91.7Very high127 Ų12743.9 Ų43.955%0.55225%0.251SS*.Hα-helixtrans-88.8-34.3177.7-64.4-179-179.4175.10112.4L641 L680 E681 L687L641-K683 HydrophobicContact CD1-CB 3.91Å; L680-K683 PolarHBondContact O-N 3.18Å; L680-K683 VanDerWaalsContact O-N 3.11Å; E681-K683 PolarHBondContact O-N 3.04Å; E681-K683 VanDerWaalsContact O-N 3.11Å; K683-L687 WeakPolarHBondContact O-CG 3.48Å
684L93.3Very high91.7Very high4 Ų442.4 Ų42.42%0.02124%0.242CC..Hα-helixtrans-75.8-44.9-177.3179.864.5000111.9L636 L641 L644 L663 L677 L680 E681 L687 V688L636-L684 HydrophobicContact CD1-CD1 4.44Å; L641-L684 HydrophobicContact CD2-CB 4Å; L641-L684 HydrophobicContact CD2-CD1 3.53Å; L641-L684 HydrophobicContact CD2-CG 4.39Å; L644-L684 HydrophobicContact CD1-CD1 4.03Å; L663-L684 HydrophobicContact CD1-CD1 4.13Å; L663-L684 HydrophobicContact CD1-CD2 4.44Å; L663-L684 HydrophobicContact CD2-CD1 3.93Å; L677-L684 HydrophobicContact CD1-CD2 3.59Å; L680-L684 WeakPolarHBondContact O-CB 3.49Å; L680-L684 PolarHBondContact O-N 2.82Å; E681-L684 PolarHBondContact O-N 3.48Å; E681-L684 VanDerWaalsContact O-N 3.08Å; L684-L687 PolarHBondContact O-N 3.46Å; L684-L687 VanDerWaalsContact O-N 3.12Å; L684-V688 HydrophobicContact CD1-CG2 3.78Å; L684-V688 HydrophobicContact CG-CG2 4Å; L684-V688 PolarHBondContact O-N 2.91Å
685S92.2Very high91.8Very high16 Ų1647.1 Ų47.111%0.11226%0.263CS..Hα-helixtrans-56.9-49.1-171.9-171.50000112.9E681 L687 V688 L689E681-S685 VanDerWaalsContact O-CB 3.27Å; E681-S685 WeakPolarHBondContact O-CB 3.3Å; E681-S685 PolarHBondContact O-N 3.18Å; E681-S685 VanDerWaalsContact OE1-CB 3.25Å; E681-S685 WeakPolarHBondContact OE1-CB 3.17Å; E681-S685 PolarHBondContact OE1-OG 2.89Å; S685-L687 VanDerWaalsContact C-N 3.27Å; S685-L687 PolarHBondContact O-N 3.42Å; S685-V688 PolarHBondContact O-N 3.11Å; S685-L689 WeakPolarHBondContact O-CB 3.42Å; S685-L689 WeakPolarHBondContact O-CG 3.41Å; S685-L689 PolarHBondContact O-N 3.14Å
686P93.8Very high92Very high75 Ų7547 Ų4749%0.48726%0.255SS..Hα-helixtrans-59.5-35.5177.5-23.134.4000113.6E682 S690E682-P686 WeakPolarHBondContact O-CD 3.4Å; E682-P686 WeakPolarHBondContact O-CG 3.19Å; P686-S690 WeakPolarHBondContact O-CB 3.23Å; P686-S690 PolarHBondContact O-N 3.14Å
687L95.9Very high92.2Very high34 Ų3449.8 Ų49.818%0.17827%0.268CS..Hα-helixtrans-72.1-43.5-178.7-58.4179.6000111.3L641 L644 V645 K683 L684 S685 S690 A691L641-L687 HydrophobicContact CB-CD1 4.04Å; L641-L687 HydrophobicContact CD2-CD1 3.89Å; L641-L687 WeakPolarHBondContact O-CD1 3.42Å; L644-L687 HydrophobicContact CB-CB 3.96Å; L644-L687 HydrophobicContact CB-CD1 4.06Å; V645-L687 HydrophobicContact CG2-CD2 4.06Å; K683-L687 WeakPolarHBondContact O-CG 3.48Å; L684-L687 PolarHBondContact O-N 3.46Å; L684-L687 VanDerWaalsContact O-N 3.12Å; S685-L687 VanDerWaalsContact C-N 3.27Å; S685-L687 PolarHBondContact O-N 3.42Å; L687-S690 PolarHBondContact O-N 2.99Å; L687-S690 PolarHBondContact O-OG 3Å; L687-A691 PolarHBondContact O-N 3.22Å
688V95.3Very high92.4Very high2 Ų254.8 Ų54.81%0.01229%0.293CS..Hα-helixtrans-69.9-38.5177.5-175.30000111.1L663 L684 S685 A691 L692 A703 L707L663-V688 HydrophobicContact CD2-CG2 3.74Å; L684-V688 HydrophobicContact CD1-CG2 3.78Å; L684-V688 HydrophobicContact CG-CG2 4Å; L684-V688 PolarHBondContact O-N 2.91Å; S685-V688 PolarHBondContact O-N 3.11Å; V688-A691 WeakPolarHBondContact O-CB 3.5Å; V688-A691 PolarHBondContact O-N 3.06Å; V688-A691 VanDerWaalsContact O-N 3.12Å; V688-L692 PolarHBondContact O-N 3.24Å; V688-A703 HydrophobicContact CG1-CB 4.18Å; V688-L707 HydrophobicContact CB-CD2 4.2Å; V688-L707 HydrophobicContact CG1-CD1 4.32Å; V688-L707 HydrophobicContact CG1-CD2 3.84Å; V688-L707 HydrophobicContact CG1-CG 3.66Å
689L94.8Very high92.6Very high23 Ų2352 Ų5212%0.1228%0.278CS..Hα-helixtrans-61.6-43.6174.3-68.2171.7000111.1S685 A691 L692 L707 I726 E729S685-L689 WeakPolarHBondContact O-CB 3.42Å; S685-L689 WeakPolarHBondContact O-CG 3.41Å; S685-L689 PolarHBondContact O-N 3.14Å; L689-A691 PolarHBondContact O-N 3.02Å; L689-A691 VanDerWaalsContact O-N 3.17Å; L689-L692 HydrophobicContact CD2-CD1 3.95Å; L689-L692 VanDerWaalsContact O-CB 3.26Å; L689-L692 WeakPolarHBondContact O-CB 3.33Å; L689-L692 PolarHBondContact O-N 3.36Å; L689-L707 HydrophobicContact CD2-CD1 3.87Å; L689-L707 HydrophobicContact CD2-CD2 4.36Å; L689-I726 HydrophobicContact CD2-CG2 4.49Å; L689-E729 HydrophobicContact CD2-CB 3.83Å; L689-E729 HydrophobicContact CD2-CG 4.07Å
690S94.4Very high92.9Very high40 Ų4049.5 Ų49.528%0.2826%0.257SS..Hα-helixtrans-60.3-27.7175.579.80000113.3P686 L687 L692 D693P686-S690 WeakPolarHBondContact O-CB 3.23Å; P686-S690 PolarHBondContact O-N 3.14Å; L687-S690 PolarHBondContact O-N 2.99Å; L687-S690 PolarHBondContact O-OG 3Å; S690-L692 VanDerWaalsContact C-N 3.28Å; S690-L692 PolarHBondContact O-N 3.35Å; S690-D693 PolarHBondContact O-N 3.16Å
691A94.3Very high93.2Very high0 Ų049.4 Ų49.40%026%0.256CS..G310 helixtrans-76.8-13.2177.500000113.7L660 L687 V688 L689 D693 E694 A703L660-A691 HydrophobicContact CD1-CB 3.67Å; L660-A691 HydrophobicContact CD2-CB 4.17Å; L660-A691 HydrophobicContact CG-CB 4.49Å; L687-A691 PolarHBondContact O-N 3.22Å; V688-A691 WeakPolarHBondContact O-CB 3.5Å; V688-A691 PolarHBondContact O-N 3.06Å; V688-A691 VanDerWaalsContact O-N 3.12Å; L689-A691 PolarHBondContact O-N 3.02Å; L689-A691 VanDerWaalsContact O-N 3.17Å; A691-D693 PolarHBondContact O-N 3.39Å; A691-E694 WeakPolarHBondContact O-CG 3.49Å; A691-E694 PolarHBondContact O-N 2.93Å; A691-A703 HydrophobicContact CB-CB 3.86Å
692L94.3Very high93.6Very high0 Ų049.3 Ų49.30%026%0.257CS..G310 helixtrans-66.2-29.7171.8-64.8172.2000111.3V688 L689 S690 E694 R700 A703 C704 L707 E729 L730 R733V688-L692 PolarHBondContact O-N 3.24Å; L689-L692 HydrophobicContact CD2-CD1 3.95Å; L689-L692 VanDerWaalsContact O-CB 3.26Å; L689-L692 WeakPolarHBondContact O-CB 3.33Å; L689-L692 PolarHBondContact O-N 3.36Å; S690-L692 VanDerWaalsContact C-N 3.28Å; S690-L692 PolarHBondContact O-N 3.35Å; L692-E694 VanDerWaalsContact C-N 3.33Å; L692-E694 PolarHBondContact O-N 3.04Å; L692-R700 WeakPolarHBondContact O-CD 3.38Å; L692-R700 WeakPolarHBondContact O-CG 3.43Å; L692-A703 HydrophobicContact CD2-CB 3.74Å; L692-A703 HydrophobicContact CG-CB 4.22Å; L692-C704 HydrophobicContact CD2-CB 4.45Å; L692-C704 WeakPolarHBondContact CD2-SG 3.43Å; L692-L707 HydrophobicContact CD1-CD1 3.78Å; L692-L707 HydrophobicContact CD2-CD1 4.19Å; L692-L707 HydrophobicContact CG-CD1 4.24Å; L692-E729 HydrophobicContact CD1-CB 3.82Å; L692-L730 HydrophobicContact CD1-CD2 4.35Å; L692-R733 VanDerWaalsContact C-NH1 3.31Å; L692-R733 HydrophobicContact CB-CG 4.3Å; L692-R733 HydrophobicContact CD2-CG 4.26Å; L692-R733 PolarHBondContact O-NH1 2.78Å
693D91.4Very high93.9Very high88 Ų8841.2 Ų41.247%0.47122%0.219SC..G310 helixtrans-90.214.6-178.9-69.2-44000114.4S690 A691 R733S690-D693 PolarHBondContact O-N 3.16Å; A691-D693 PolarHBondContact O-N 3.39Å; D693-R733 IonicContact OD1-CZ 2.84Å; D693-R733 IonicContact OD1-NH1 3.57Å; D693-R733 PolarHBondContact OD1-NH1 2.93Å; D693-R733 IonicContact OD1-NH2 3.25Å; D693-R733 PolarHBondContact OD1-NH2 3.37Å
694E89.1Confident94.1Very high11 Ų1135.1 Ų35.15%0.05119%0.192CC..  trans-68.1145.5176.7-80.8-60.6109.400114W646 A653 R656 A691 L692 S696 R700W646-E694 VanDerWaalsContact CD1-OE1 3.24Å; W646-E694 PolarHBondContact NE1-OE1 3.26Å; A653-E694 WeakPolarHBondContact CB-OE2 3.48Å; R656-E694 IonicContact CZ-OE1 3.73Å; R656-E694 IonicContact CZ-OE2 3.41Å; R656-E694 IonicContact NH1-OE1 3.86Å; R656-E694 PolarHBondContact NH1-OE1 3.31Å; R656-E694 IonicContact NH1-OE2 2.66Å; R656-E694 IonicContact NH2-OE1 3.47Å; R656-E694 PolarHBondContact NH2-OE1 3.03Å; R656-E694 IonicContact NH2-OE2 3.38Å; R656-E694 PolarHBondContact NH2-OE2 3Å; A691-E694 WeakPolarHBondContact O-CG 3.49Å; A691-E694 PolarHBondContact O-N 2.93Å; L692-E694 VanDerWaalsContact C-N 3.33Å; L692-E694 PolarHBondContact O-N 3.04Å; E694-S696 PolarHBondContact O-N 3.25Å; E694-R700 HydrophobicContact CB-CG 4.17Å; E694-R700 WeakPolarHBondContact O-CD 3.49Å; E694-R700 VanDerWaalsContact O-CG 3.26Å; E694-R700 WeakPolarHBondContact O-CG 3.43Å; E694-R700 PolarHBondContact O-NH1 3.29Å
695D88.9Confident94.3Very high164 Ų16440.1 Ų40.188%0.87721%0.211SC*.SBendtrans-60.5-34.1171.6-67.2-33.8000112.2Q697 R700D695-Q697 PolarHBondContact O-N 3.01Å; D695-R700 VanDerWaalsContact C-NH1 3.29Å; D695-R700 PolarHBondContact O-NH1 3.01Å
696S91.2Very high94.4Very high43 Ų4339.4 Ų39.430%0.30121%0.206SC..  trans-75.6117.8-178.3160.50000112E694 M698 S699 R700E694-S696 PolarHBondContact O-N 3.25Å; S696-M698 PolarHBondContact O-N 3.04Å; S696-S699 WeakPolarHBondContact CB-OG 3.43Å; S696-S699 WeakPolarHBondContact O-CB 3.41Å; S696-S699 PolarHBondContact O-N 3.39Å; S696-S699 PolarHBondContact OG-N 3.27Å; S696-S699 PolarHBondContact OG-OG 2.85Å; S696-R700 PolarHBondContact O-N 2.76Å
697Q94.7Very high94.5Very high88 Ų8836 Ų3641%0.41118%0.184SC..Hα-helixtrans-50.9-43.9173.7174.8-173.7-2100112.1D695 S699 R700 L701 S738 V741D695-Q697 PolarHBondContact O-N 3.01Å; Q697-S699 VanDerWaalsContact C-N 3.29Å; Q697-S699 PolarHBondContact O-N 2.72Å; Q697-R700 PolarHBondContact O-N 3.28Å; Q697-L701 WeakPolarHBondContact O-CB 3.35Å; Q697-L701 PolarHBondContact O-N 3.48Å; Q697-S738 VanDerWaalsContact CD-OG 3.25Å; Q697-S738 PolarHBondContact NE2-OG 3.31Å; Q697-V741 HydrophobicContact CG-CG2 3.96Å
698M95.2Very high94.5Very high106 Ų10634.9 Ų34.952%0.52218%0.178SC..Hα-helixtrans-62.6-38.5-178.8-17761.97600111.5T657 S696 L701 L702T657-M698 HydrophobicContact CG2-CB 4.22Å; T657-M698 HydrophobicContact CG2-CG 3.8Å; S696-M698 PolarHBondContact O-N 3.04Å; M698-L701 PolarHBondContact O-N 3.26Å; M698-L702 HydrophobicContact CG-CD1 3.97Å; M698-L702 HydrophobicContact CG-CG 4.37Å; M698-L702 WeakPolarHBondContact O-CB 3.5Å; M698-L702 VanDerWaalsContact O-CG 3.23Å; M698-L702 WeakPolarHBondContact O-CG 3.38Å; M698-L702 PolarHBondContact O-N 3.07Å; M698-L702 HydrophobicContact SD-CD1 4.25Å; M698-L702 HydrophobicContact SD-CG 4.18Å
699S94.4Very high94.4Very high0 Ų034.9 Ų34.90%018%0.178CC..Hα-helixtrans-66.2-46.7179.5-47.40000110.8T657 S696 Q697 L701 L702 A703T657-S699 PolarHBondContact OG1-OG 3.34Å; S696-S699 WeakPolarHBondContact CB-OG 3.43Å; S696-S699 WeakPolarHBondContact O-CB 3.41Å; S696-S699 PolarHBondContact O-N 3.39Å; S696-S699 PolarHBondContact OG-N 3.27Å; S696-S699 PolarHBondContact OG-OG 2.85Å; Q697-S699 VanDerWaalsContact C-N 3.29Å; Q697-S699 PolarHBondContact O-N 2.72Å; S699-L701 VanDerWaalsContact C-N 3.33Å; S699-L701 PolarHBondContact O-N 3.49Å; S699-L702 PolarHBondContact O-N 3.46Å; S699-A703 WeakPolarHBondContact O-CB 3.42Å; S699-A703 PolarHBondContact O-N 2.84Å
700R96.4Very high94.3Very high25 Ų2534.2 Ų34.29%0.09418%0.175CC..Hα-helixtrans-60.5-43.6176.1-57.2-162.6-63.5-86.96.4111.6L692 E694 D695 S696 Q697 A703 C704 D736 V741L692-R700 WeakPolarHBondContact O-CD 3.38Å; L692-R700 WeakPolarHBondContact O-CG 3.43Å; E694-R700 HydrophobicContact CB-CG 4.17Å; E694-R700 WeakPolarHBondContact O-CD 3.49Å; E694-R700 VanDerWaalsContact O-CG 3.26Å; E694-R700 WeakPolarHBondContact O-CG 3.43Å; E694-R700 PolarHBondContact O-NH1 3.29Å; D695-R700 VanDerWaalsContact C-NH1 3.29Å; D695-R700 PolarHBondContact O-NH1 3.01Å; S696-R700 PolarHBondContact O-N 2.76Å; Q697-R700 PolarHBondContact O-N 3.28Å; R700-A703 PolarHBondContact O-N 3.33Å; R700-C704 PolarHBondContact O-N 2.87Å; R700-C704 PolarHBondContact O-SG 3.47Å; R700-C704 VanDerWaalsContact O-SG 3.4Å; R700-D736 WeakPolarHBondContact CD-OD2 3.42Å; R700-D736 IonicContact CZ-OD1 3.3Å; R700-D736 IonicContact CZ-OD2 3.35Å; R700-D736 IonicContact NE-OD1 3.11Å; R700-D736 IonicContact NE-OD2 2.69Å; R700-D736 PolarHBondContact NE-OD2 3.15Å; R700-D736 IonicContact NH2-OD1 2.63Å; R700-D736 PolarHBondContact NH2-OD1 3.15Å; R700-D736 IonicContact NH2-OD2 3.2Å; R700-D736 PolarHBondContact NH2-OD2 3.32Å; R700-V741 HydrophobicContact CB-CG1 4.01Å; R700-V741 HydrophobicContact CB-CG2 4.23Å
701L97.2Very high94.3Very high5 Ų532.6 Ų32.63%0.02616%0.164CC..Hα-helixtrans-61.1-47.9177-178.360.7000112.1Q697 M698 S699 A703 C704 R705 E740 V741 A744Q697-L701 WeakPolarHBondContact O-CB 3.35Å; Q697-L701 PolarHBondContact O-N 3.48Å; M698-L701 PolarHBondContact O-N 3.26Å; S699-L701 VanDerWaalsContact C-N 3.33Å; S699-L701 PolarHBondContact O-N 3.49Å; L701-A703 VanDerWaalsContact C-N 3.32Å; L701-A703 PolarHBondContact O-N 3.03Å; L701-C704 PolarHBondContact O-N 2.98Å; L701-R705 WeakPolarHBondContact O-CG 3.29Å; L701-R705 PolarHBondContact O-N 3.23Å; L701-E740 HydrophobicContact CD1-CB 4.23Å; L701-E740 WeakPolarHBondContact CD1-O 3.22Å; L701-E740 HydrophobicContact CD2-CB 4.42Å; L701-V741 HydrophobicContact CB-CG2 3.99Å; L701-A744 HydrophobicContact CD1-CB 3.64Å
702L96.7Very high94.2Very high14 Ų1439.5 Ų39.57%0.07320%0.196CC..Hα-helixtrans-65.8-35.3178.6-69.5172.8000111.8T657 L660 L664 M698 S699 R705 S706T657-L702 HydrophobicContact CG2-CD1 3.94Å; L660-L702 HydrophobicContact CB-CB 3.95Å; L660-L702 HydrophobicContact CB-CD1 4.3Å; L664-L702 HydrophobicContact CD2-CD2 3.65Å; M698-L702 HydrophobicContact CG-CD1 3.97Å; M698-L702 HydrophobicContact CG-CG 4.37Å; M698-L702 WeakPolarHBondContact O-CB 3.5Å; M698-L702 VanDerWaalsContact O-CG 3.23Å; M698-L702 WeakPolarHBondContact O-CG 3.38Å; M698-L702 PolarHBondContact O-N 3.07Å; M698-L702 HydrophobicContact SD-CD1 4.25Å; M698-L702 HydrophobicContact SD-CG 4.18Å; S699-L702 PolarHBondContact O-N 3.46Å; L702-R705 PolarHBondContact O-N 3.4Å; L702-S706 VanDerWaalsContact O-CB 3.3Å; L702-S706 WeakPolarHBondContact O-CB 3.48Å; L702-S706 PolarHBondContact O-N 3.01Å; L702-S706 PolarHBondContact O-OG 3.32Å
703A96.6Very high94Very high0 Ų042.1 Ų42.10%021%0.21CC..Hα-helixtrans-64.3-49.6173.800000111.6V688 A691 L692 S699 R700 L701 R705 S706 L707V688-A703 HydrophobicContact CG1-CB 4.18Å; A691-A703 HydrophobicContact CB-CB 3.86Å; L692-A703 HydrophobicContact CD2-CB 3.74Å; L692-A703 HydrophobicContact CG-CB 4.22Å; S699-A703 WeakPolarHBondContact O-CB 3.42Å; S699-A703 PolarHBondContact O-N 2.84Å; R700-A703 PolarHBondContact O-N 3.33Å; L701-A703 VanDerWaalsContact C-N 3.32Å; L701-A703 PolarHBondContact O-N 3.03Å; A703-R705 VanDerWaalsContact C-N 3.3Å; A703-R705 PolarHBondContact O-N 3.04Å; A703-S706 PolarHBondContact O-N 3.17Å; A703-S706 VanDerWaalsContact O-N 3.14Å; A703-L707 WeakPolarHBondContact O-CG 3.49Å; A703-L707 PolarHBondContact O-N 2.94Å
704C97.1Very high94.1Very high0 Ų038 Ų380%019%0.187CC..Hα-helixtrans-56.1-43.5174.8-71.30000112.2L692 R700 L701 S708 A744L692-C704 HydrophobicContact CD2-CB 4.45Å; L692-C704 WeakPolarHBondContact CD2-SG 3.43Å; R700-C704 PolarHBondContact O-N 2.87Å; R700-C704 PolarHBondContact O-SG 3.47Å; R700-C704 VanDerWaalsContact O-SG 3.4Å; L701-C704 PolarHBondContact O-N 2.98Å; C704-S708 PolarHBondContact O-N 2.91Å; C704-S708 PolarHBondContact O-OG 3.32Å; C704-A744 HydrophobicContact CB-CB 3.74Å
705R96.3Very high94.1Very high109 Ų10937.5 Ų37.541%0.41119%0.185SC..Hα-helixtrans-68.9-37.3178.1-71.2177.9178.7-177.81.8112.3L664 L701 L702 A703 S708 A709 A744L664-R705 HydrophobicContact CD1-CB 3.8Å; L664-R705 HydrophobicContact CD2-CB 3.73Å; L664-R705 HydrophobicContact CG-CB 4.44Å; L701-R705 WeakPolarHBondContact O-CG 3.29Å; L701-R705 PolarHBondContact O-N 3.23Å; L702-R705 PolarHBondContact O-N 3.4Å; A703-R705 VanDerWaalsContact C-N 3.3Å; A703-R705 PolarHBondContact O-N 3.04Å; R705-S708 WeakPolarHBondContact O-CB 3.34Å; R705-S708 PolarHBondContact O-N 2.82Å; R705-A709 WeakPolarHBondContact O-CB 3.46Å; R705-A709 PolarHBondContact O-N 3.02Å; R705-A744 HydrophobicContact CG-CB 4.31Å
706S95.6Very high94.1Very high0 Ų033.4 Ų33.40%017%0.166CC..Hα-helixtrans-65.8-42.5176.3-59.50000110.8L702 A703 A709 T710L702-S706 VanDerWaalsContact O-CB 3.3Å; L702-S706 WeakPolarHBondContact O-CB 3.48Å; L702-S706 PolarHBondContact O-N 3.01Å; L702-S706 PolarHBondContact O-OG 3.32Å; A703-S706 PolarHBondContact O-N 3.17Å; A703-S706 VanDerWaalsContact O-N 3.14Å; S706-A709 PolarHBondContact O-N 3.4Å; S706-T710 WeakPolarHBondContact O-CB 3.35Å; S706-T710 PolarHBondContact O-N 2.96Å; S706-T710 PolarHBondContact O-OG1 3.18Å; S706-T710 VanDerWaalsContact O-OG1 3.05Å
707L94.9Very high94Very high5 Ų535 Ų353%0.02618%0.178CC..Hα-helixtrans-62.6-42.4173-69.8171.4000111.9V688 L689 L692 A703 A709 T710 L711 I726 L730V688-L707 HydrophobicContact CB-CD2 4.2Å; V688-L707 HydrophobicContact CG1-CD1 4.32Å; V688-L707 HydrophobicContact CG1-CD2 3.84Å; V688-L707 HydrophobicContact CG1-CG 3.66Å; L689-L707 HydrophobicContact CD2-CD1 3.87Å; L689-L707 HydrophobicContact CD2-CD2 4.36Å; L692-L707 HydrophobicContact CD1-CD1 3.78Å; L692-L707 HydrophobicContact CD2-CD1 4.19Å; L692-L707 HydrophobicContact CG-CD1 4.24Å; A703-L707 WeakPolarHBondContact O-CG 3.49Å; A703-L707 PolarHBondContact O-N 2.94Å; L707-A709 VanDerWaalsContact C-N 3.34Å; L707-A709 PolarHBondContact O-N 3.42Å; L707-T710 PolarHBondContact O-N 3.5Å; L707-L711 WeakPolarHBondContact O-CB 3.27Å; L707-L711 VanDerWaalsContact O-CG 3.27Å; L707-L711 WeakPolarHBondContact O-CG 3.48Å; L707-L711 PolarHBondContact O-N 3.43Å; L707-I726 HydrophobicContact CD2-CG2 4.5Å; L707-L730 HydrophobicContact CD1-CD2 3.72Å; L707-L730 HydrophobicContact CD1-CG 4.39Å
708S95Very high93.7Very high9 Ų931.5 Ų31.56%0.06316%0.162CC..Hα-helixtrans-56.1-49.7173.8-60.80000111.2C704 R705 T710 L711 Q712 A748 L751C704-S708 PolarHBondContact O-N 2.91Å; C704-S708 PolarHBondContact O-OG 3.32Å; R705-S708 WeakPolarHBondContact O-CB 3.34Å; R705-S708 PolarHBondContact O-N 2.82Å; S708-T710 PolarHBondContact O-N 3.33Å; S708-L711 PolarHBondContact O-N 2.93Å; S708-Q712 WeakPolarHBondContact O-CB 3.43Å; S708-Q712 PolarHBondContact O-N 3.45Å; S708-A748 WeakPolarHBondContact OG-CA 3.38Å; S708-A748 VanDerWaalsContact OG-CB 3.29Å; S708-A748 WeakPolarHBondContact OG-CB 3.33Å; S708-L751 WeakPolarHBondContact O-CD1 3.29Å
709A94.1Very high93.4Very high2 Ų232.2 Ų32.22%0.01716%0.163CC..Hα-helixtrans-64.1-40.5179.800000112L664 L667 R705 S706 L707 Q712 L713L664-A709 HydrophobicContact CD1-CB 4.35Å; L667-A709 HydrophobicContact CB-CB 3.73Å; L667-A709 HydrophobicContact CD1-CB 4.09Å; R705-A709 WeakPolarHBondContact O-CB 3.46Å; R705-A709 PolarHBondContact O-N 3.02Å; S706-A709 PolarHBondContact O-N 3.4Å; L707-A709 VanDerWaalsContact C-N 3.34Å; L707-A709 PolarHBondContact O-N 3.42Å; A709-Q712 PolarHBondContact O-N 3.36Å; A709-L713 WeakPolarHBondContact O-CB 3.38Å; A709-L713 VanDerWaalsContact O-CG 3.3Å; A709-L713 WeakPolarHBondContact O-CG 3.36Å; A709-L713 PolarHBondContact O-N 3.24Å
710T92.9Very high92.9Very high10 Ų1034.4 Ų34.46%0.06117%0.174CC..Hα-helixtrans-61.9-49.1174.3-62.70000111.5L677 S706 L707 S708 Q712 L713 V714L677-T710 HydrophobicContact CD2-CG2 4.17Å; S706-T710 WeakPolarHBondContact O-CB 3.35Å; S706-T710 PolarHBondContact O-N 2.96Å; S706-T710 PolarHBondContact O-OG1 3.18Å; S706-T710 VanDerWaalsContact O-OG1 3.05Å; L707-T710 PolarHBondContact O-N 3.5Å; S708-T710 PolarHBondContact O-N 3.33Å; T710-Q712 VanDerWaalsContact C-N 3.28Å; T710-Q712 PolarHBondContact O-N 3.39Å; T710-L713 PolarHBondContact O-N 3.43Å; T710-L713 VanDerWaalsContact O-N 3.13Å; T710-V714 HydrophobicContact CG2-CG2 3.8Å; T710-V714 WeakPolarHBondContact O-CG2 3.48Å; T710-V714 PolarHBondContact O-N 3.46Å
711L93.4Very high92.4Very high6 Ų639.3 Ų39.33%0.03120%0.198CC..Hα-helixtrans-60.4-39.3177.3-71.4167000111.6L707 S708 L713 G715 L718 L723 I726 A748 L751 W752L707-L711 WeakPolarHBondContact O-CB 3.27Å; L707-L711 VanDerWaalsContact O-CG 3.27Å; L707-L711 WeakPolarHBondContact O-CG 3.48Å; L707-L711 PolarHBondContact O-N 3.43Å; S708-L711 PolarHBondContact O-N 2.93Å; L711-L713 VanDerWaalsContact C-N 3.34Å; L711-L713 PolarHBondContact O-N 2.88Å; L711-G715 WeakPolarHBondContact O-CA 3.41Å; L711-G715 PolarHBondContact O-N 3.18Å; L711-L718 HydrophobicContact CD2-CD1 4.38Å; L711-L723 HydrophobicContact CD2-CD2 3.75Å; L711-I726 HydrophobicContact CD1-CG2 4.49Å; L711-I726 HydrophobicContact CD2-CD1 4.43Å; L711-A748 WeakPolarHBondContact CD1-O 3.48Å; L711-L751 HydrophobicContact CB-CB 4.07Å; L711-L751 HydrophobicContact CD1-CB 4.45Å; L711-W752 HydrophobicContact CD1-CB 3.98Å
712Q92.8Very high91.9Very high144 Ų14439.9 Ų39.967%0.67320%0.203SC*.Hα-helixtrans-65.1-36.4176.1-173.5177.13.400112.9S708 A709 T710 L751S708-Q712 WeakPolarHBondContact O-CB 3.43Å; S708-Q712 PolarHBondContact O-N 3.45Å; A709-Q712 PolarHBondContact O-N 3.36Å; T710-Q712 VanDerWaalsContact C-N 3.28Å; T710-Q712 PolarHBondContact O-N 3.39Å; Q712-L751 HydrophobicContact CB-CD2 4.43Å
713L90.8Very high91.6Very high56 Ų5639.3 Ų39.329%0.29320%0.2SC..Hα-helixtrans-82.4-40.1-177.2-73.2171.2000113.4L667 L677 A709 T710 L711L667-L713 HydrophobicContact CB-CD1 4.31Å; L667-L713 HydrophobicContact CD2-CD1 3.98Å; L677-L713 HydrophobicContact CD2-CB 4.06Å; L677-L713 HydrophobicContact CD2-CD1 3.91Å; A709-L713 WeakPolarHBondContact O-CB 3.38Å; A709-L713 VanDerWaalsContact O-CG 3.3Å; A709-L713 WeakPolarHBondContact O-CG 3.36Å; A709-L713 PolarHBondContact O-N 3.24Å; T710-L713 PolarHBondContact O-N 3.43Å; T710-L713 VanDerWaalsContact O-N 3.13Å; L711-L713 VanDerWaalsContact C-N 3.34Å; L711-L713 PolarHBondContact O-N 2.88Å
714V92.2Very high91.3Very high0 Ų040.2 Ų40.20%021%0.205CC..Hα-helixtrans-133.8-2.5-169.1-62.50000114.4P674 L677 L678 T710 T716 S717 L718P674-V714 HydrophobicContact CB-CG1 3.83Å; P674-V714 VanDerWaalsContact O-CG1 3.24Å; P674-V714 WeakPolarHBondContact O-CG1 3.38Å; L677-V714 HydrophobicContact CB-CG1 4.07Å; L677-V714 HydrophobicContact CD2-CG1 3.98Å; L677-V714 HydrophobicContact CD2-CG2 3.96Å; L677-V714 HydrophobicContact CG-CG1 4.19Å; L677-V714 HydrophobicContact CG-CG2 4.17Å; L678-V714 HydrophobicContact CD1-CB 4.46Å; L678-V714 HydrophobicContact CD1-CG1 4.23Å; L678-V714 HydrophobicContact CD2-CB 3.85Å; L678-V714 HydrophobicContact CD2-CG1 4.31Å; L678-V714 HydrophobicContact CD2-CG2 4.42Å; L678-V714 HydrophobicContact CG-CB 3.82Å; L678-V714 HydrophobicContact CG-CG1 3.7Å; T710-V714 HydrophobicContact CG2-CG2 3.8Å; T710-V714 WeakPolarHBondContact O-CG2 3.48Å; T710-V714 PolarHBondContact O-N 3.46Å; V714-T716 VanDerWaalsContact C-N 3.33Å; V714-T716 PolarHBondContact O-N 3.29Å; V714-S717 CarbonylContact O-C 3.28Å; V714-S717 WeakPolarHBondContact O-CA 3.18Å; V714-S717 WeakPolarHBondContact O-CB 3.43Å; V714-S717 PolarHBondContact O-N 3.38Å; V714-L718 HydrophobicContact CG2-CD2 4.12Å; V714-L718 HydrophobicContact CG2-CG 4.39Å; V714-L718 WeakPolarHBondContact O-CG 3.4Å; V714-L718 PolarHBondContact O-N 3.12Å
715G89.8Confident91Very high1 Ų146.8 Ų46.81%0.0123%0.234CC..G310 helixtrans-55.1-42.2-17100000114.3L711 S717 L718 S755L711-G715 WeakPolarHBondContact O-CA 3.41Å; L711-G715 PolarHBondContact O-N 3.18Å; G715-S717 PolarHBondContact O-N 2.85Å; G715-L718 PolarHBondContact O-N 3.05Å; G715-L718 VanDerWaalsContact O-N 3.17Å; G715-S755 VanDerWaalsContact C-CB 3.5Å; G715-S755 WeakPolarHBondContact CA-OG 3.26Å
716T89.1Confident90.8Very high78 Ų7841.7 Ų41.748%0.47922%0.215SC..G310 helixtrans-65.3-18.3177.555.30000114.1V714 T757V714-T716 VanDerWaalsContact C-N 3.33Å; V714-T716 PolarHBondContact O-N 3.29Å; T716-T757 HydrophobicContact CG2-CG2 3.67Å
717S89.6Confident90.7Very high78 Ų7841.8 Ų41.855%0.54522%0.215SC..G310 helixtrans-102.9-1.8-178.9-54.80000112.5V714 G715V714-S717 CarbonylContact O-C 3.28Å; V714-S717 WeakPolarHBondContact O-CA 3.18Å; V714-S717 WeakPolarHBondContact O-CB 3.43Å; V714-S717 PolarHBondContact O-N 3.38Å; G715-S717 PolarHBondContact O-N 2.85Å
718L88.9Confident90.7Very high14 Ų1443.1 Ų43.17%0.07322%0.224CC..SBendtrans-78.8147.7177-64.1-178.7000111.5L678 E681 L711 V714 G715 L723 I726L678-L718 HydrophobicContact CD2-CD2 3.72Å; E681-L718 HydrophobicContact CB-CD2 4.25Å; E681-L718 HydrophobicContact CG-CD2 3.63Å; L711-L718 HydrophobicContact CD2-CD1 4.38Å; V714-L718 HydrophobicContact CG2-CD2 4.12Å; V714-L718 HydrophobicContact CG2-CG 4.39Å; V714-L718 WeakPolarHBondContact O-CG 3.4Å; V714-L718 PolarHBondContact O-N 3.12Å; G715-L718 PolarHBondContact O-N 3.05Å; G715-L718 VanDerWaalsContact O-N 3.17Å; L718-L723 HydrophobicContact CB-CD1 4.43Å; L718-L723 HydrophobicContact CB-CD2 4.16Å; L718-L723 HydrophobicContact CB-CG 3.97Å; L718-L723 HydrophobicContact CD1-CD2 3.99Å; L718-I726 HydrophobicContact CD1-CD1 4.38Å
719H86.9Confident90.7Very high120 Ų12044.8 Ų44.856%0.55623%0.231SC*.  trans-69.2147.1173.1-166.558.1000111.1E721 A722 L723H719-E721 PolarHBondContact O-N 3.07Å; H719-A722 WeakPolarHBondContact O-CB 3.47Å; H719-A722 PolarHBondContact O-N 3.36Å; H719-L723 PolarHBondContact O-N 2.85Å; H719-L723 VanDerWaalsContact O-N 3.11Å
720H84.8Confident90.8Very high47 Ų4744.7 Ų44.722%0.21823%0.23CC..Hα-helixtrans-61.1-32.7-175.5-50.5137.4000112.8A722 L723 N724 G759 Y760H720-A722 VanDerWaalsContact C-N 3.33Å; H720-A722 PolarHBondContact O-N 3.08Å; H720-L723 PolarHBondContact O-N 3.11Å; H720-N724 VanDerWaalsContact O-CB 3.29Å; H720-N724 WeakPolarHBondContact O-CB 3.25Å; H720-N724 PolarHBondContact O-N 2.9Å; H720-N724 PolarHBondContact O-ND2 3.28Å; H720-G759 PolarHBondContact CE1-O 3.44Å; H720-Y760 HydrophobicContact CB-CD2 3.8Å; H720-Y760 HydrophobicContact CB-CE2 4.14Å; H720-Y760 AromaticContact CD2-CD2 3.6Å; H720-Y760 PolarHBondContact CE1-N 3.26Å; H720-Y760 VanDerWaalsContact CE1-N 3.34Å; H720-Y760 AromaticContact CG-CD2 3.61Å; H720-Y760 PolarHBondContact NE2-N 3.22Å
721E85.5Confident90.9Very high127 Ų12744.8 Ų44.859%0.59323%0.23SC*.Hα-helixtrans-64.2-36.3174.7-61.9-174.117300112.7H719 K725H719-E721 PolarHBondContact O-N 3.07Å; E721-K725 WeakPolarHBondContact O-CG 3.49Å; E721-K725 PolarHBondContact O-N 2.99Å
722A86.9Confident90.9Very high18 Ų1849.2 Ų49.215%0.14925%0.249CC..Hα-helixtrans-69.3-45.3176.300000110.5H719 H720 N724 K725 I726H719-A722 WeakPolarHBondContact O-CB 3.47Å; H719-A722 PolarHBondContact O-N 3.36Å; H720-A722 VanDerWaalsContact C-N 3.33Å; H720-A722 PolarHBondContact O-N 3.08Å; A722-N724 VanDerWaalsContact C-N 3.33Å; A722-N724 PolarHBondContact O-N 3.43Å; A722-K725 PolarHBondContact O-N 3.22Å; A722-K725 VanDerWaalsContact O-N 3.15Å; A722-I726 WeakPolarHBondContact O-CG1 3.17Å; A722-I726 PolarHBondContact O-N 3.12Å
723L89.8Confident91.1Very high2 Ų244 Ų441%0.0122%0.223CC..Hα-helixtrans-57.2-45.5173.2-71.6173.2000111.3L711 L718 H719 H720 K725 I726 Y727 W752 L756L711-L723 HydrophobicContact CD2-CD2 3.75Å; L718-L723 HydrophobicContact CB-CD1 4.43Å; L718-L723 HydrophobicContact CB-CD2 4.16Å; L718-L723 HydrophobicContact CB-CG 3.97Å; L718-L723 HydrophobicContact CD1-CD2 3.99Å; H719-L723 PolarHBondContact O-N 2.85Å; H719-L723 VanDerWaalsContact O-N 3.11Å; H720-L723 PolarHBondContact O-N 3.11Å; L723-K725 PolarHBondContact O-N 3.26Å; L723-I726 PolarHBondContact O-N 2.72Å; L723-Y727 PolarHBondContact O-N 3.41Å; L723-W752 VanDerWaalsContact C-NE1 3.28Å; L723-W752 PolarHBondContact O-NE1 2.94Å; L723-L756 HydrophobicContact CD1-CD2 4.2Å
724N91Very high91.2Very high18 Ų1841.4 Ų41.410%0.09621%0.209CC..Hα-helixtrans-68.7-14.8-178.9-71.7-18.9000113.7H720 A722 Y727 P728 Y760H720-N724 VanDerWaalsContact O-CB 3.29Å; H720-N724 WeakPolarHBondContact O-CB 3.25Å; H720-N724 PolarHBondContact O-N 2.9Å; H720-N724 PolarHBondContact O-ND2 3.28Å; A722-N724 VanDerWaalsContact C-N 3.33Å; A722-N724 PolarHBondContact O-N 3.43Å; N724-Y727 HydrophobicContact CB-CE1 4.41Å; N724-P728 WeakPolarHBondContact O-CD 3.39Å; N724-P728 WeakPolarHBondContact O-CG 3.27Å; N724-Y760 WeakPolarHBondContact OD1-CE2 3.47Å; N724-Y760 PolarHBondContact OD1-OH 2.66Å
725K90.9Very high91.2Very high138 Ų13846.9 Ų46.960%0.624%0.239SC*.Hα-helixtrans-83.9-24.6170.1-71168.6-172.7172.40113.2E721 A722 L723E721-K725 WeakPolarHBondContact O-CG 3.49Å; E721-K725 PolarHBondContact O-N 2.99Å; A722-K725 PolarHBondContact O-N 3.22Å; A722-K725 VanDerWaalsContact O-N 3.15Å; L723-K725 PolarHBondContact O-N 3.26Å
726I93.1Very high91.4Very high3 Ų347.6 Ų47.62%0.01524%0.243CC..Hα-helixtrans-83.5-49.7-173.1-66.9165.7000111.9L689 L707 L711 L718 A722 L723 P728 E729 L730L689-I726 HydrophobicContact CD2-CG2 4.49Å; L707-I726 HydrophobicContact CD2-CG2 4.5Å; L711-I726 HydrophobicContact CD1-CG2 4.49Å; L711-I726 HydrophobicContact CD2-CD1 4.43Å; L718-I726 HydrophobicContact CD1-CD1 4.38Å; A722-I726 WeakPolarHBondContact O-CG1 3.17Å; A722-I726 PolarHBondContact O-N 3.12Å; L723-I726 PolarHBondContact O-N 2.72Å; I726-P728 VanDerWaalsContact C-CD 3.4Å; I726-E729 PolarHBondContact O-N 2.58Å; I726-L730 HydrophobicContact CG2-CD1 3.76Å; I726-L730 HydrophobicContact CG2-CG 4.26Å; I726-L730 PolarHBondContact O-N 2.72Å
727Y93.1Very high91.6Very high1 Ų149.5 Ų49.50%0.00426%0.259CS..Hα-helixtrans-61.7-35.8-172.687.7-90.5000114.9L723 N724 E729 L730 L731 W752 H768 L772L723-Y727 PolarHBondContact O-N 3.41Å; N724-Y727 HydrophobicContact CB-CE1 4.41Å; Y727-E729 VanDerWaalsContact C-N 3.29Å; Y727-E729 PolarHBondContact O-N 3Å; Y727-L730 PolarHBondContact O-N 2.86Å; Y727-L731 HydrophobicContact CD2-CD1 3.7Å; Y727-L731 HydrophobicContact CD2-CG 4.29Å; Y727-L731 HydrophobicContact CE2-CD1 3.86Å; Y727-L731 WeakPolarHBondContact O-CG 3.32Å; Y727-L731 PolarHBondContact O-N 3.45Å; Y727-W752 AromaticContact CD1-CE2 3.82Å; Y727-W752 HydrophobicContact CD1-CH2 4.03Å; Y727-W752 AromaticContact CD1-CZ2 3.45Å; Y727-W752 HydrophobicContact CD1-CZ2 3.45Å; Y727-W752 VanDerWaalsContact CD1-CZ2 3.45Å; Y727-W752 HydrophobicContact CE1-CZ2 4.2Å; Y727-W752 HydrophobicContact CG-CD2 4.45Å; Y727-W752 HydrophobicContact CG-CH2 4.29Å; Y727-W752 AromaticContact CG-CZ2 3.95Å; Y727-W752 HydrophobicContact CG-CZ2 3.95Å; Y727-H768 HydrophobicContact CE1-CB 4Å; Y727-H768 AromaticContact CE1-ND1 3.5Å; Y727-H768 WeakPolarHBondContact CE1-ND1 3.09Å; Y727-H768 AromaticContact CZ-ND1 3.59Å; Y727-H768 VanDerWaalsContact OH-CA 3.27Å; Y727-H768 WeakPolarHBondContact OH-CA 3.5Å; Y727-H768 WeakPolarHBondContact OH-CB 3.14Å; Y727-H768 PolarHBondContact OH-ND1 3.5Å; Y727-H768 PolarHBondContact OH-O 3.15Å; Y727-L772 HydrophobicContact CD2-CB 4.33Å; Y727-L772 HydrophobicContact CD2-CD1 3.78Å; Y727-L772 HydrophobicContact CE2-CB 4.15Å; Y727-L772 HydrophobicContact CE2-CD1 4.42Å
728P94.5Very high91.8Very high33 Ų3346.3 Ų46.321%0.21424%0.236CC..Hα-helixtrans-64.5-37.3-179.3-20.534.7000111.8N724 I726 L731 K732N724-P728 WeakPolarHBondContact O-CD 3.39Å; N724-P728 WeakPolarHBondContact O-CG 3.27Å; I726-P728 VanDerWaalsContact C-CD 3.4Å; P728-L731 PolarHBondContact O-N 3.4Å; P728-K732 WeakPolarHBondContact O-CG 3.1Å; P728-K732 PolarHBondContact O-N 2.65Å
729E95.3Very high91.9Very high45 Ų4550.3 Ų50.321%0.2126%0.255CS..Hα-helixtrans-69.5-35.5177.3-59.2-53.8136.800111.9L689 L692 I726 Y727 K732L689-E729 HydrophobicContact CD2-CB 3.83Å; L689-E729 HydrophobicContact CD2-CG 4.07Å; L692-E729 HydrophobicContact CD1-CB 3.82Å; I726-E729 PolarHBondContact O-N 2.58Å; Y727-E729 VanDerWaalsContact C-N 3.29Å; Y727-E729 PolarHBondContact O-N 3Å; E729-K732 PolarHBondContact O-N 3.5Å; E729-K732 IonicContact OE1-NZ 2.87Å; E729-K732 PolarHBondContact OE1-NZ 3.47Å; E729-K732 WeakPolarHBondContact OE2-CE 3.5Å; E729-K732 IonicContact OE2-NZ 3.68Å; E729-K732 PolarHBondContact OE2-NZ 3.17Å
730L95.4Very high92.3Very high0 Ų049.9 Ų49.90%025%0.253CS..Hα-helixtrans-66.3-39.5172.6-67.9172.7000112.1L692 L707 I726 Y727 K732 R733 A748 V749L692-L730 HydrophobicContact CD1-CD2 4.35Å; L707-L730 HydrophobicContact CD1-CD2 3.72Å; L707-L730 HydrophobicContact CD1-CG 4.39Å; I726-L730 HydrophobicContact CG2-CD1 3.76Å; I726-L730 HydrophobicContact CG2-CG 4.26Å; I726-L730 PolarHBondContact O-N 2.72Å; Y727-L730 PolarHBondContact O-N 2.86Å; L730-K732 VanDerWaalsContact C-N 3.31Å; L730-K732 PolarHBondContact O-N 3.29Å; L730-R733 WeakPolarHBondContact O-CB 3.35Å; L730-R733 PolarHBondContact O-N 3.3Å; L730-A748 HydrophobicContact CD1-CB 3.56Å; L730-A748 HydrophobicContact CD2-CB 3.68Å; L730-A748 HydrophobicContact CG-CB 4.24Å; L730-V749 HydrophobicContact CB-CG2 3.74Å; L730-V749 HydrophobicContact CD1-CG2 4.24Å
731L94.9Very high92.8Very high11 Ų1147.7 Ų47.76%0.05824%0.243CC..Hα-helixtrans-60.7-39.9177.1-73.5176.8000112Y727 P728 R733 L734 V749 L772 Q775 L776Y727-L731 HydrophobicContact CD2-CD1 3.7Å; Y727-L731 HydrophobicContact CD2-CG 4.29Å; Y727-L731 HydrophobicContact CE2-CD1 3.86Å; Y727-L731 WeakPolarHBondContact O-CG 3.32Å; Y727-L731 PolarHBondContact O-N 3.45Å; P728-L731 PolarHBondContact O-N 3.4Å; L731-R733 PolarHBondContact O-N 3.21Å; L731-L734 HydrophobicContact CD2-CD1 3.68Å; L731-L734 WeakPolarHBondContact O-CB 3.41Å; L731-L734 PolarHBondContact O-N 3.02Å; L731-V749 HydrophobicContact CD2-CG2 4.42Å; L731-L772 HydrophobicContact CD1-CD1 4.02Å; L731-L772 HydrophobicContact CD2-CD1 3.97Å; L731-L772 HydrophobicContact CG-CD1 4.22Å; L731-Q775 HydrophobicContact CD1-CB 4.02Å; L731-Q775 HydrophobicContact CD1-CG 4.1Å; L731-Q775 HydrophobicContact CD2-CB 4.15Å; L731-L776 HydrophobicContact CD2-CD2 4.24Å; L731-L776 HydrophobicContact CD2-CG 4.4Å
732K94.6Very high93.3Very high99 Ų9943.1 Ų43.143%0.4322%0.22SC..THydrogen-bonded Turntrans-59.4-15.5174.4-63.8175.9-164.8166.90113.7P728 E729 L730P728-K732 WeakPolarHBondContact O-CG 3.1Å; P728-K732 PolarHBondContact O-N 2.65Å; E729-K732 PolarHBondContact O-N 3.5Å; E729-K732 IonicContact OE1-NZ 2.87Å; E729-K732 PolarHBondContact OE1-NZ 3.47Å; E729-K732 WeakPolarHBondContact OE2-CE 3.5Å; E729-K732 IonicContact OE2-NZ 3.68Å; E729-K732 PolarHBondContact OE2-NZ 3.17Å; L730-K732 VanDerWaalsContact C-N 3.31Å; L730-K732 PolarHBondContact O-N 3.29Å
733R95.2Very high93.7Very high36 Ų3643.5 Ų43.514%0.13622%0.222CC..THydrogen-bonded Turntrans-94.4-4176.8-64.2-57.185.5122.910.9113.5L692 D693 L730 L731 D735 D736 V741 A745L692-R733 VanDerWaalsContact C-NH1 3.31Å; L692-R733 HydrophobicContact CB-CG 4.3Å; L692-R733 HydrophobicContact CD2-CG 4.26Å; L692-R733 PolarHBondContact O-NH1 2.78Å; D693-R733 IonicContact OD1-CZ 2.84Å; D693-R733 IonicContact OD1-NH1 3.57Å; D693-R733 PolarHBondContact OD1-NH1 2.93Å; D693-R733 IonicContact OD1-NH2 3.25Å; D693-R733 PolarHBondContact OD1-NH2 3.37Å; L730-R733 WeakPolarHBondContact O-CB 3.35Å; L730-R733 PolarHBondContact O-N 3.3Å; L731-R733 PolarHBondContact O-N 3.21Å; R733-D735 PolarHBondContact O-N 3.01Å; R733-D736 VanDerWaalsContact O-CB 3.25Å; R733-D736 WeakPolarHBondContact O-CB 3.42Å; R733-D736 PolarHBondContact O-N 2.68Å; R733-V741 HydrophobicContact CB-CG1 4.31Å; R733-A745 HydrophobicContact CB-CB 3.63Å
734L93.7Very high94Very high0 Ų043.8 Ų43.80%023%0.225CC..THydrogen-bonded Turntrans-72.2-17.7168.2-60-177.4000112.3L731 R742 A745 L746 L776 H779L731-L734 HydrophobicContact CD2-CD1 3.68Å; L731-L734 WeakPolarHBondContact O-CB 3.41Å; L731-L734 PolarHBondContact O-N 3.02Å; L734-R742 VanDerWaalsContact O-CZ 3.27Å; L734-R742 PolarHBondContact O-NE 3.18Å; L734-R742 PolarHBondContact O-NH2 3.41Å; L734-A745 HydrophobicContact CD2-CB 4.23Å; L734-L746 HydrophobicContact CD2-CB 3.79Å; L734-L746 HydrophobicContact CD2-CD1 4.29Å; L734-L776 HydrophobicContact CD1-CD2 3.79Å; L734-H779 WeakPolarHBondContact CB-NE2 3.31Å; L734-H779 VanDerWaalsContact CD1-CD2 3.49Å; L734-H779 WeakPolarHBondContact CD1-CD2 3.25Å
735D92.2Very high94.3Very high115 Ų11543 Ų4362%0.61522%0.22SC*.THydrogen-bonded Turntrans-92.18.6170.5-67.1-52.7000113.8R733 H779R733-D735 PolarHBondContact O-N 3.01Å; D735-H779 IonicContact OD1-CE1 3.44Å; D735-H779 PolarHBondContact OD1-CE1 2.84Å; D735-H779 VanDerWaalsContact OD1-CE1 3.32Å
736D94.9Very high94.5Very high17 Ų1736.5 Ų36.59%0.09119%0.192CC..  trans-64.2147.1-177.8-157.5-74.9000112.2R700 R733 S738 V741 R742R700-D736 WeakPolarHBondContact CD-OD2 3.42Å; R700-D736 IonicContact CZ-OD1 3.3Å; R700-D736 IonicContact CZ-OD2 3.35Å; R700-D736 IonicContact NE-OD1 3.11Å; R700-D736 IonicContact NE-OD2 2.69Å; R700-D736 PolarHBondContact NE-OD2 3.15Å; R700-D736 IonicContact NH2-OD1 2.63Å; R700-D736 PolarHBondContact NH2-OD1 3.15Å; R700-D736 IonicContact NH2-OD2 3.2Å; R700-D736 PolarHBondContact NH2-OD2 3.32Å; R733-D736 VanDerWaalsContact O-CB 3.25Å; R733-D736 WeakPolarHBondContact O-CB 3.42Å; R733-D736 PolarHBondContact O-N 2.68Å; D736-S738 PolarHBondContact O-N 3.48Å; D736-S738 PolarHBondContact OD1-N 3.23Å; D736-V741 HydrophobicContact CB-CB 4.08Å; D736-V741 HydrophobicContact CB-CG1 3.95Å; D736-V741 WeakPolarHBondContact OD2-CG1 3.48Å; D736-R742 HydrophobicContact CB-CG 3.94Å; D736-R742 VanDerWaalsContact O-CD 3.25Å; D736-R742 WeakPolarHBondContact O-CD 3.46Å; D736-R742 WeakPolarHBondContact O-CG 3.42Å
737S92.2Very high94.6Very high117 Ų11744.5 Ų44.582%0.81822%0.222SC*.SBendtrans-66.4-21.6175.959.40000113.3
738S93.8Very high94.7Very high11 Ų1144.5 Ų44.58%0.07722%0.222CC..  trans-97.5119.2178.4174.50000112.7Q697 D736 E740 V741 R742Q697-S738 VanDerWaalsContact CD-OG 3.25Å; Q697-S738 PolarHBondContact NE2-OG 3.31Å; D736-S738 PolarHBondContact O-N 3.48Å; D736-S738 PolarHBondContact OD1-N 3.23Å; S738-E740 PolarHBondContact O-N 3.25Å; S738-E740 VanDerWaalsContact O-N 3.16Å; S738-E740 PolarHBondContact OG-N 3.06Å; S738-V741 PolarHBondContact O-N 3.46Å; S738-R742 WeakPolarHBondContact O-CG 3.45Å; S738-R742 PolarHBondContact O-N 2.59Å
739Q91.8Very high94.8Very high99 Ų9942.9 Ų42.946%0.46321%0.212SC..Hα-helixtrans-55.8-32.9174.8-166.4-174.11500113.1R742 S743 D784Q739-R742 PolarHBondContact O-N 3.49Å; Q739-S743 WeakPolarHBondContact O-CB 3.26Å; Q739-S743 PolarHBondContact O-N 2.88Å; Q739-S743 PolarHBondContact O-OG 3.11Å; Q739-D784 PolarHBondContact NE2-OD2 3.16Å
740E94.8Very high94.7Very high111 Ų11141.7 Ų41.752%0.51921%0.21SC..Hα-helixtrans-67-40.8177.2-63.6-176.8163.400112.1L701 S738 A744L701-E740 HydrophobicContact CD1-CB 4.23Å; L701-E740 WeakPolarHBondContact CD1-O 3.22Å; L701-E740 HydrophobicContact CD2-CB 4.42Å; S738-E740 PolarHBondContact O-N 3.25Å; S738-E740 VanDerWaalsContact O-N 3.16Å; S738-E740 PolarHBondContact OG-N 3.06Å; E740-A744 WeakPolarHBondContact O-CB 3.42Å; E740-A744 PolarHBondContact O-N 3.41Å
741V96.3Very high94.7Very high0 Ų043.5 Ų43.50%022%0.219CC..Hα-helixtrans-67.6-45.1176.8178.80000109.8Q697 R700 L701 R733 D736 S738 S743 A744 A745Q697-V741 HydrophobicContact CG-CG2 3.96Å; R700-V741 HydrophobicContact CB-CG1 4.01Å; R700-V741 HydrophobicContact CB-CG2 4.23Å; L701-V741 HydrophobicContact CB-CG2 3.99Å; R733-V741 HydrophobicContact CB-CG1 4.31Å; D736-V741 HydrophobicContact CB-CB 4.08Å; D736-V741 HydrophobicContact CB-CG1 3.95Å; D736-V741 WeakPolarHBondContact OD2-CG1 3.48Å; S738-V741 PolarHBondContact O-N 3.46Å; V741-S743 VanDerWaalsContact C-N 3.35Å; V741-S743 PolarHBondContact O-N 3.5Å; V741-A744 PolarHBondContact O-N 3.3Å; V741-A745 WeakPolarHBondContact O-CB 3.39Å; V741-A745 PolarHBondContact O-N 3.31Å
742R95.4Very high94.7Very high31 Ų3143 Ų4312%0.11722%0.216CC..Hα-helixtrans-55.6-49175.7-59.9176.474.9-170.91.5111.5L734 D736 S738 Q739 A744 A745 L746 D782 M787L734-R742 VanDerWaalsContact O-CZ 3.27Å; L734-R742 PolarHBondContact O-NE 3.18Å; L734-R742 PolarHBondContact O-NH2 3.41Å; D736-R742 HydrophobicContact CB-CG 3.94Å; D736-R742 VanDerWaalsContact O-CD 3.25Å; D736-R742 WeakPolarHBondContact O-CD 3.46Å; D736-R742 WeakPolarHBondContact O-CG 3.42Å; S738-R742 WeakPolarHBondContact O-CG 3.45Å; S738-R742 PolarHBondContact O-N 2.59Å; Q739-R742 PolarHBondContact O-N 3.49Å; R742-A744 PolarHBondContact O-N 3.19Å; R742-A745 PolarHBondContact O-N 2.88Å; R742-L746 WeakPolarHBondContact O-CB 3.49Å; R742-L746 PolarHBondContact O-N 3.42Å; R742-D782 IonicContact CZ-OD2 3.93Å; R742-D782 VanDerWaalsContact CZ-OD2 3.3Å; R742-D782 IonicContact NH1-OD1 2.69Å; R742-D782 PolarHBondContact NH1-OD1 3.15Å; R742-D782 IonicContact NH1-OD2 2.93Å; R742-D782 PolarHBondContact NH1-OD2 2.87Å; R742-D782 VanDerWaalsContact NH1-OD2 3.11Å; R742-D782 IonicContact NH2-OD1 2.71Å; R742-D782 IonicContact NH2-OD2 3Å; R742-D782 PolarHBondContact NH2-OD2 2.91Å; R742-M787 HydrophobicContact CB-CE 3.49Å; R742-M787 VanDerWaalsContact CB-CE 3.49Å
743S94.4Very high94.6Very high27 Ų2738.5 Ų38.519%0.18920%0.197CC..Hα-helixtrans-64.8-39.6179.5-55.30000112.1Q739 V741 R747Q739-S743 WeakPolarHBondContact O-CB 3.26Å; Q739-S743 PolarHBondContact O-N 2.88Å; Q739-S743 PolarHBondContact O-OG 3.11Å; V741-S743 VanDerWaalsContact C-N 3.35Å; V741-S743 PolarHBondContact O-N 3.5Å; S743-R747 PolarHBondContact O-N 3.18Å
744A96.2Very high94.4Very high8 Ų840.5 Ų40.57%0.06622%0.217CC..Hα-helixtrans-68.2-38.8176.400000112.5L701 C704 R705 E740 V741 R742 R747 A748L701-A744 HydrophobicContact CD1-CB 3.64Å; C704-A744 HydrophobicContact CB-CB 3.74Å; R705-A744 HydrophobicContact CG-CB 4.31Å; E740-A744 WeakPolarHBondContact O-CB 3.42Å; E740-A744 PolarHBondContact O-N 3.41Å; V741-A744 PolarHBondContact O-N 3.3Å; R742-A744 PolarHBondContact O-N 3.19Å; A744-R747 PolarHBondContact O-N 3.27Å; A744-A748 PolarHBondContact O-N 3.4Å
745A96.7Very high94.2Very high0 Ų040.7 Ų40.70%022%0.218CC..Hα-helixtrans-64.2-45.3175.100000111.2R733 L734 V741 R742 R747 A748 V749R733-A745 HydrophobicContact CB-CB 3.63Å; L734-A745 HydrophobicContact CD2-CB 4.23Å; V741-A745 WeakPolarHBondContact O-CB 3.39Å; V741-A745 PolarHBondContact O-N 3.31Å; R742-A745 PolarHBondContact O-N 2.88Å; A745-R747 VanDerWaalsContact C-N 3.32Å; A745-R747 PolarHBondContact O-N 3.13Å; A745-A748 WeakPolarHBondContact O-CA 3.42Å; A745-A748 WeakPolarHBondContact O-CB 3.25Å; A745-A748 PolarHBondContact O-N 2.71Å; A745-A748 VanDerWaalsContact O-N 3.07Å; A745-V749 WeakPolarHBondContact O-CG2 3.16Å; A745-V749 PolarHBondContact O-N 2.92Å
746L95.9Very high94.1Very high2 Ų236.4 Ų36.41%0.0120%0.195CC..Hα-helixtrans-61.8-39.6177.3-174.558.5000112.4L734 R742 V749 A750 L776 M787 Q790 V791 V794L734-L746 HydrophobicContact CD2-CB 3.79Å; L734-L746 HydrophobicContact CD2-CD1 4.29Å; R742-L746 WeakPolarHBondContact O-CB 3.49Å; R742-L746 PolarHBondContact O-N 3.42Å; L746-V749 WeakPolarHBondContact O-CB 3.44Å; L746-V749 PolarHBondContact O-N 3.27Å; L746-A750 PolarHBondContact O-N 2.87Å; L746-L776 HydrophobicContact CD1-CD2 3.77Å; L746-M787 HydrophobicContact CD2-SD 3.82Å; L746-Q790 HydrophobicContact CD2-CB 3.47Å; L746-Q790 VanDerWaalsContact CD2-CB 3.47Å; L746-V791 HydrophobicContact CD1-CG2 4.04Å; L746-V791 HydrophobicContact CD2-CB 4.37Å; L746-V791 HydrophobicContact CD2-CG2 3.55Å; L746-V791 HydrophobicContact CG-CG2 4.47Å; L746-V794 HydrophobicContact CD1-CB 4.05Å; L746-V794 HydrophobicContact CD1-CG1 4.23Å; L746-V794 HydrophobicContact CD1-CG2 3.67Å; L746-V794 HydrophobicContact CD2-CG2 4.49Å; L746-V794 HydrophobicContact CG-CG2 3.79Å
747R95.5Very high93.4Very high172 Ų17238.5 Ų38.565%0.64921%0.208SC*.Hα-helixtrans-61.8-42.1171.7-177.1177.2-65.6172.70.8112.2S743 A744 A745 V749 A750 L751S743-R747 PolarHBondContact O-N 3.18Å; A744-R747 PolarHBondContact O-N 3.27Å; A745-R747 VanDerWaalsContact C-N 3.32Å; A745-R747 PolarHBondContact O-N 3.13Å; R747-V749 VanDerWaalsContact C-N 3.31Å; R747-V749 PolarHBondContact O-N 3.43Å; R747-A750 WeakPolarHBondContact O-CB 2.98Å; R747-A750 PolarHBondContact O-N 2.98Å; R747-L751 HydrophobicContact CG-CD1 4.4Å; R747-L751 WeakPolarHBondContact O-CG 3.13Å; R747-L751 PolarHBondContact O-N 2.94Å
748A95.7Very high92.1Very high0 Ų037.4 Ų37.40%022%0.215CC..Hα-helixtrans-62.7-39.6175.600000111.3S708 L711 L730 A744 A745 L751 W752S708-A748 WeakPolarHBondContact OG-CA 3.38Å; S708-A748 VanDerWaalsContact OG-CB 3.29Å; S708-A748 WeakPolarHBondContact OG-CB 3.33Å; L711-A748 WeakPolarHBondContact CD1-O 3.48Å; L730-A748 HydrophobicContact CD1-CB 3.56Å; L730-A748 HydrophobicContact CD2-CB 3.68Å; L730-A748 HydrophobicContact CG-CB 4.24Å; A744-A748 PolarHBondContact O-N 3.4Å; A745-A748 WeakPolarHBondContact O-CA 3.42Å; A745-A748 WeakPolarHBondContact O-CB 3.25Å; A745-A748 PolarHBondContact O-N 2.71Å; A745-A748 VanDerWaalsContact O-N 3.07Å; A748-L751 PolarHBondContact O-N 3.5Å; A748-W752 WeakPolarHBondContact O-CB 3.42Å; A748-W752 PolarHBondContact O-N 3.26Å
749V95.9Very high90.8Very high0 Ų039.2 Ų39.20%024%0.236CC..Hα-helixtrans-63.1-40.9173.8172.60000111.6L730 L731 A745 L746 R747 L751 W752 L753 L772 L776 V794L730-V749 HydrophobicContact CB-CG2 3.74Å; L730-V749 HydrophobicContact CD1-CG2 4.24Å; L731-V749 HydrophobicContact CD2-CG2 4.42Å; A745-V749 WeakPolarHBondContact O-CG2 3.16Å; A745-V749 PolarHBondContact O-N 2.92Å; L746-V749 WeakPolarHBondContact O-CB 3.44Å; L746-V749 PolarHBondContact O-N 3.27Å; R747-V749 VanDerWaalsContact C-N 3.31Å; R747-V749 PolarHBondContact O-N 3.43Å; V749-L751 VanDerWaalsContact C-N 3.34Å; V749-L751 PolarHBondContact O-N 2.93Å; V749-W752 WeakPolarHBondContact O-CB 3.45Å; V749-W752 PolarHBondContact O-N 2.89Å; V749-L753 PolarHBondContact O-N 3.03Å; V749-L772 HydrophobicContact CG1-CD1 3.76Å; V749-L776 HydrophobicContact CG1-CD1 4.28Å; V749-L776 HydrophobicContact CG1-CD2 4.44Å; V749-V794 HydrophobicContact CG1-CG1 4.15Å
750A94.3Very high90.3Very high20 Ų2035 Ų3517%0.16522%0.215CC..Hα-helixtrans-61.4-43.1174.900000111.9L746 R747 W752 L753 S754 V794L746-A750 PolarHBondContact O-N 2.87Å; R747-A750 WeakPolarHBondContact O-CB 2.98Å; R747-A750 PolarHBondContact O-N 2.98Å; A750-W752 VanDerWaalsContact C-N 3.34Å; A750-L753 WeakPolarHBondContact O-CB 3.26Å; A750-L753 PolarHBondContact O-N 3.43Å; A750-S754 PolarHBondContact O-N 2.95Å; A750-V794 HydrophobicContact CB-CG1 4.24Å; A750-V794 HydrophobicContact CB-CG2 3.74Å
751L94.4Very high89.8Confident37 Ų3732.9 Ų32.919%0.19421%0.208CC..Hα-helixtrans-67-37.2176.2-71.8167.2000111.9S708 L711 Q712 R747 A748 V749 S754 S755S708-L751 WeakPolarHBondContact O-CD1 3.29Å; L711-L751 HydrophobicContact CB-CB 4.07Å; L711-L751 HydrophobicContact CD1-CB 4.45Å; Q712-L751 HydrophobicContact CB-CD2 4.43Å; R747-L751 HydrophobicContact CG-CD1 4.4Å; R747-L751 WeakPolarHBondContact O-CG 3.13Å; R747-L751 PolarHBondContact O-N 2.94Å; A748-L751 PolarHBondContact O-N 3.5Å; V749-L751 VanDerWaalsContact C-N 3.34Å; V749-L751 PolarHBondContact O-N 2.93Å; L751-S754 WeakPolarHBondContact CA-OG 3.42Å; L751-S754 PolarHBondContact O-N 3.27Å; L751-S754 PolarHBondContact O-OG 2.86Å; L751-S755 PolarHBondContact O-N 3.21Å; L751-S755 PolarHBondContact O-OG 2.92Å
752W94.7Very high88.9Confident0 Ų035 Ų350%022%0.221CC..Hα-helixtrans-59.3-47.1172.2179.692.4000111.4L711 L723 Y727 A748 V749 A750 S754 S755 L756 L769 L772L711-W752 HydrophobicContact CD1-CB 3.98Å; L723-W752 VanDerWaalsContact C-NE1 3.28Å; L723-W752 PolarHBondContact O-NE1 2.94Å; Y727-W752 AromaticContact CD1-CE2 3.82Å; Y727-W752 HydrophobicContact CD1-CH2 4.03Å; Y727-W752 AromaticContact CD1-CZ2 3.45Å; Y727-W752 HydrophobicContact CD1-CZ2 3.45Å; Y727-W752 VanDerWaalsContact CD1-CZ2 3.45Å; Y727-W752 HydrophobicContact CE1-CZ2 4.2Å; Y727-W752 HydrophobicContact CG-CD2 4.45Å; Y727-W752 HydrophobicContact CG-CH2 4.29Å; Y727-W752 AromaticContact CG-CZ2 3.95Å; Y727-W752 HydrophobicContact CG-CZ2 3.95Å; A748-W752 WeakPolarHBondContact O-CB 3.42Å; A748-W752 PolarHBondContact O-N 3.26Å; V749-W752 WeakPolarHBondContact O-CB 3.45Å; V749-W752 PolarHBondContact O-N 2.89Å; A750-W752 VanDerWaalsContact C-N 3.34Å; W752-S754 VanDerWaalsContact C-N 3.32Å; W752-S754 PolarHBondContact O-N 2.87Å; W752-S755 WeakPolarHBondContact O-CA 3.2Å; W752-S755 VanDerWaalsContact O-CB 3.26Å; W752-S755 WeakPolarHBondContact O-CB 3.43Å; W752-S755 PolarHBondContact O-N 3.34Å; W752-L756 HydrophobicContact CE3-CD1 4.33Å; W752-L756 HydrophobicContact CH2-CD1 3.88Å; W752-L756 HydrophobicContact CH2-CD2 4Å; W752-L756 HydrophobicContact CH2-CG 4.45Å; W752-L756 HydrophobicContact CZ2-CD2 3.96Å; W752-L756 HydrophobicContact CZ3-CD1 3.69Å; W752-L756 HydrophobicContact CZ3-CD2 4.31Å; W752-L756 HydrophobicContact CZ3-CG 4.32Å; W752-L769 HydrophobicContact CH2-CD2 4.25Å; W752-L769 HydrophobicContact CZ3-CD2 4.37Å; W752-L772 HydrophobicContact CE3-CD2 4.21Å; W752-L772 HydrophobicContact CH2-CD2 4.46Å; W752-L772 HydrophobicContact CZ3-CD2 3.6Å
753L92.1Very high88.3Confident5 Ų540 Ų403%0.02625%0.246CC..Hα-helixtrans-59-42.9175.2-82.3169.3000111.8V749 A750 S755 L756 L772 V794 V801V749-L753 PolarHBondContact O-N 3.03Å; A750-L753 WeakPolarHBondContact O-CB 3.26Å; A750-L753 PolarHBondContact O-N 3.43Å; L753-S755 PolarHBondContact O-N 3.23Å; L753-L756 HydrophobicContact CD2-CD1 4.14Å; L753-L756 WeakPolarHBondContact O-CB 3.42Å; L753-L756 WeakPolarHBondContact O-CG 3.35Å; L753-L756 PolarHBondContact O-N 2.8Å; L753-L772 HydrophobicContact CD1-CD2 4.39Å; L753-L772 HydrophobicContact CD2-CD2 3.68Å; L753-L772 HydrophobicContact CG-CD2 4.11Å; L753-V794 HydrophobicContact CD1-CG1 3.71Å; L753-V801 HydrophobicContact CD2-CG2 4.23Å
754S90.8Very high87.7Confident79 Ų7945.3 Ų45.355%0.55227%0.272SS*.Hα-helixtrans-68.4-16.1176.771.50000114A750 L751 W752 L756A750-S754 PolarHBondContact O-N 2.95Å; L751-S754 WeakPolarHBondContact CA-OG 3.42Å; L751-S754 PolarHBondContact O-N 3.27Å; L751-S754 PolarHBondContact O-OG 2.86Å; W752-S754 VanDerWaalsContact C-N 3.32Å; W752-S754 PolarHBondContact O-N 2.87Å; S754-L756 VanDerWaalsContact C-N 3.35Å
755S90.9Very high87.1Confident3 Ų345.7 Ų45.72%0.02127%0.274CS..THydrogen-bonded Turntrans-83.7-11.7178-59.70000112.9G715 L751 W752 L753 T757G715-S755 VanDerWaalsContact C-CB 3.5Å; G715-S755 WeakPolarHBondContact CA-OG 3.26Å; L751-S755 PolarHBondContact O-N 3.21Å; L751-S755 PolarHBondContact O-OG 2.92Å; W752-S755 WeakPolarHBondContact O-CA 3.2Å; W752-S755 VanDerWaalsContact O-CB 3.26Å; W752-S755 WeakPolarHBondContact O-CB 3.43Å; W752-S755 PolarHBondContact O-N 3.34Å; L753-S755 PolarHBondContact O-N 3.23Å; S755-T757 PolarHBondContact O-N 2.85Å
756L88.9Confident86.6Confident25 Ų2546.8 Ų46.813%0.13128%0.283CS..  trans-7492.6177.7-53.5-177.6000109.6L723 W752 L753 S754 Y760 L769 V801L723-L756 HydrophobicContact CD1-CD2 4.2Å; W752-L756 HydrophobicContact CE3-CD1 4.33Å; W752-L756 HydrophobicContact CH2-CD1 3.88Å; W752-L756 HydrophobicContact CH2-CD2 4Å; W752-L756 HydrophobicContact CH2-CG 4.45Å; W752-L756 HydrophobicContact CZ2-CD2 3.96Å; W752-L756 HydrophobicContact CZ3-CD1 3.69Å; W752-L756 HydrophobicContact CZ3-CD2 4.31Å; W752-L756 HydrophobicContact CZ3-CG 4.32Å; L753-L756 HydrophobicContact CD2-CD1 4.14Å; L753-L756 WeakPolarHBondContact O-CB 3.42Å; L753-L756 WeakPolarHBondContact O-CG 3.35Å; L753-L756 PolarHBondContact O-N 2.8Å; S754-L756 VanDerWaalsContact C-N 3.35Å; L756-Y760 HydrophobicContact CB-CD1 4.41Å; L756-Y760 HydrophobicContact CB-CG 4.32Å; L756-Y760 HydrophobicContact CD1-CD1 4.22Å; L756-Y760 HydrophobicContact CD1-CE1 4.06Å; L756-Y760 HydrophobicContact CD2-CD1 4.18Å; L756-Y760 HydrophobicContact CD2-CD2 3.63Å; L756-Y760 HydrophobicContact CD2-CE1 4.24Å; L756-Y760 HydrophobicContact CD2-CE2 3.69Å; L756-Y760 HydrophobicContact CD2-CG 3.88Å; L756-L769 HydrophobicContact CD1-CD2 4.07Å; L756-V801 HydrophobicContact CD1-CG1 3.74Å; L756-V801 HydrophobicContact CD1-CG2 4.25Å
757T80.8Confident86.4Confident62 Ų6250.9 Ų50.938%0.3831%0.31SS..  trans-91.9179.5178.2640000111.7T716 S755 G759 Y760T716-T757 HydrophobicContact CG2-CG2 3.67Å; S755-T757 PolarHBondContact O-N 2.85Å; T757-G759 PolarHBondContact O-N 2.76Å; T757-Y760 WeakPolarHBondContact O-CB 3.45Å; T757-Y760 PolarHBondContact O-N 3.38Å
758G65Low86.2Confident93 Ų9346 Ų4696%0.95929%0.294SS*.THydrogen-bonded Turntrans-59.9-4.6-172.900000116.9
759G66.1Low85.9Confident49 Ų4946 Ų4651%0.50529%0.294SS..THydrogen-bonded Turntrans-77.4-27.3167.300000113.7H720 T757 D761H720-G759 PolarHBondContact CE1-O 3.44Å; T757-G759 PolarHBondContact O-N 2.76Å; G759-D761 PolarHBondContact O-N 3.3Å
760Y82.1Confident85.8Confident10 Ų1049 Ų494%0.03931%0.308CS..SBendtrans-78.5105.1-174.9-168.8-89.8000109.5H720 N724 L756 T757 P762 C765 L769H720-Y760 HydrophobicContact CB-CD2 3.8Å; H720-Y760 HydrophobicContact CB-CE2 4.14Å; H720-Y760 AromaticContact CD2-CD2 3.6Å; H720-Y760 PolarHBondContact CE1-N 3.26Å; H720-Y760 VanDerWaalsContact CE1-N 3.34Å; H720-Y760 AromaticContact CG-CD2 3.61Å; H720-Y760 PolarHBondContact NE2-N 3.22Å; N724-Y760 WeakPolarHBondContact OD1-CE2 3.47Å; N724-Y760 PolarHBondContact OD1-OH 2.66Å; L756-Y760 HydrophobicContact CB-CD1 4.41Å; L756-Y760 HydrophobicContact CB-CG 4.32Å; L756-Y760 HydrophobicContact CD1-CD1 4.22Å; L756-Y760 HydrophobicContact CD1-CE1 4.06Å; L756-Y760 HydrophobicContact CD2-CD1 4.18Å; L756-Y760 HydrophobicContact CD2-CD2 3.63Å; L756-Y760 HydrophobicContact CD2-CE1 4.24Å; L756-Y760 HydrophobicContact CD2-CE2 3.69Å; L756-Y760 HydrophobicContact CD2-CG 3.88Å; T757-Y760 WeakPolarHBondContact O-CB 3.45Å; T757-Y760 PolarHBondContact O-N 3.38Å; Y760-P762 WeakPolarHBondContact O-CD 3.49Å; Y760-C765 HydrophobicContact CD1-CB 4.35Å; Y760-C765 HydrophobicContact CE1-CB 3.51Å; Y760-C765 HydrophobicContact CE2-CB 4.12Å; Y760-C765 WeakPolarHBondContact OH-CB 3.25Å; Y760-L769 HydrophobicContact CE1-CD1 4.14Å; Y760-L769 HydrophobicContact CE1-CD2 4.19Å; Y760-L769 HydrophobicContact CE1-CG 4.18Å
761D82.9Confident85.8Confident68 Ų6851.5 Ų51.536%0.36432%0.318SS..  trans-74.6110.1178.1-175.1-26.3000110G759 E763 L764 C765G759-D761 PolarHBondContact O-N 3.3Å; D761-E763 PolarHBondContact O-N 3.46Å; D761-E763 WeakPolarHBondContact OD1-CB 3.35Å; D761-E763 PolarHBondContact OD1-N 2.83Å; D761-L764 HydrophobicContact CB-CB 4Å; D761-L764 HydrophobicContact CB-CD1 3.96Å; D761-L764 HydrophobicContact CB-CG 4.21Å; D761-L764 PolarHBondContact O-N 2.74Å; D761-L764 PolarHBondContact OD1-N 3.2Å; D761-L764 VanDerWaalsContact OD2-CD1 3.23Å; D761-L764 WeakPolarHBondContact OD2-CD1 3.34Å; D761-L764 WeakPolarHBondContact OD2-CG 3.43Å; D761-C765 WeakPolarHBondContact O-CB 3.34Å; D761-C765 PolarHBondContact O-N 2.87Å
762P78.6Confident85.8Confident43 Ų4349.8 Ų49.828%0.27931%0.309SS..THydrogen-bonded Turntrans-66.5-24.8-176.7-19.434.5000113.3Y760 A766 L769 H802Y760-P762 WeakPolarHBondContact O-CD 3.49Å; P762-A766 VanDerWaalsContact O-CA 3.29Å; P762-A766 WeakPolarHBondContact O-CA 3.37Å; P762-A766 WeakPolarHBondContact O-CB 3.34Å; P762-A766 PolarHBondContact O-N 3.34Å; P762-L769 HydrophobicContact CB-CD1 4.12Å; P762-H802 HydrophobicContact CB-CB 4.46Å
763E81.8Confident85.8Confident138 Ų13849.8 Ų49.865%0.64531%0.309SS*.THydrogen-bonded Turntrans-80.9-43.2-179.5-65.9-69.4168.600110.6D761 C765 A766 H802D761-E763 PolarHBondContact O-N 3.46Å; D761-E763 WeakPolarHBondContact OD1-CB 3.35Å; D761-E763 PolarHBondContact OD1-N 2.83Å; E763-C765 VanDerWaalsContact C-N 3.33Å; E763-C765 PolarHBondContact O-N 2.98Å; E763-A766 WeakPolarHBondContact O-CB 3.31Å; E763-A766 PolarHBondContact O-N 3.39Å; E763-H802 IonicContact OE1-NE2 2.71Å
764L82.9Confident85.9Confident137 Ų13753.1 Ų53.172%0.71733%0.325SS*.THydrogen-bonded Turntrans-67.4-34.4174.2-71.3172.7000112.3D761D761-L764 HydrophobicContact CB-CB 4Å; D761-L764 HydrophobicContact CB-CD1 3.96Å; D761-L764 HydrophobicContact CB-CG 4.21Å; D761-L764 PolarHBondContact O-N 2.74Å; D761-L764 PolarHBondContact OD1-N 3.2Å; D761-L764 VanDerWaalsContact OD2-CD1 3.23Å; D761-L764 WeakPolarHBondContact OD2-CD1 3.34Å; D761-L764 WeakPolarHBondContact OD2-CG 3.43Å
765C84.1Confident86.1Confident17 Ų1752.6 Ų52.612%0.11531%0.313CS..THydrogen-bonded Turntrans-96.412178.3-630000113.6Y760 D761 E763 P767 H768 L769Y760-C765 HydrophobicContact CD1-CB 4.35Å; Y760-C765 HydrophobicContact CE1-CB 3.51Å; Y760-C765 HydrophobicContact CE2-CB 4.12Å; Y760-C765 WeakPolarHBondContact OH-CB 3.25Å; D761-C765 WeakPolarHBondContact O-CB 3.34Å; D761-C765 PolarHBondContact O-N 2.87Å; E763-C765 VanDerWaalsContact C-N 3.33Å; E763-C765 PolarHBondContact O-N 2.98Å; C765-P767 VanDerWaalsContact C-N 3.3Å; C765-H768 WeakPolarHBondContact O-CB 3.33Å; C765-H768 PolarHBondContact O-N 3.11Å; C765-L769 PolarHBondContact O-N 3.38Å
766A85.9Confident86.3Confident22 Ų2252.4 Ų52.418%0.18231%0.312CS..Hα-helixtrans-51.9-38.2-179.200000114.1P762 E763 H768 L769 Q770P762-A766 VanDerWaalsContact O-CA 3.29Å; P762-A766 WeakPolarHBondContact O-CA 3.37Å; P762-A766 WeakPolarHBondContact O-CB 3.34Å; P762-A766 PolarHBondContact O-N 3.34Å; E763-A766 WeakPolarHBondContact O-CB 3.31Å; E763-A766 PolarHBondContact O-N 3.39Å; A766-H768 VanDerWaalsContact C-N 3.3Å; A766-H768 PolarHBondContact O-N 3.4Å; A766-L769 PolarHBondContact O-N 3.21Å; A766-Q770 VanDerWaalsContact O-CB 3.24Å; A766-Q770 WeakPolarHBondContact O-CB 3.21Å; A766-Q770 PolarHBondContact O-N 3.04Å
767P90.6Very high86.6Confident89 Ų8951.2 Ų51.258%0.57831%0.306SS*.Hα-helixtrans-61.3-35.9175.6-24.535.3000113.7C765 L771C765-P767 VanDerWaalsContact C-N 3.3Å; P767-L771 WeakPolarHBondContact O-CB 3.46Å; P767-L771 PolarHBondContact O-N 2.67Å
768H90.9Very high87.3Confident70 Ų7053 Ų5332%0.32431%0.312SS..Hα-helixtrans-69.9-45.7177.9-75.3-72.4000111.4Y727 C765 A766 L771 L772Y727-H768 HydrophobicContact CE1-CB 4Å; Y727-H768 AromaticContact CE1-ND1 3.5Å; Y727-H768 WeakPolarHBondContact CE1-ND1 3.09Å; Y727-H768 AromaticContact CZ-ND1 3.59Å; Y727-H768 VanDerWaalsContact OH-CA 3.27Å; Y727-H768 WeakPolarHBondContact OH-CA 3.5Å; Y727-H768 WeakPolarHBondContact OH-CB 3.14Å; Y727-H768 PolarHBondContact OH-ND1 3.5Å; Y727-H768 PolarHBondContact OH-O 3.15Å; C765-H768 WeakPolarHBondContact O-CB 3.33Å; C765-H768 PolarHBondContact O-N 3.11Å; A766-H768 VanDerWaalsContact C-N 3.3Å; A766-H768 PolarHBondContact O-N 3.4Å; H768-L771 PolarHBondContact O-N 3.49Å; H768-L772 WeakPolarHBondContact O-CB 3.38Å; H768-L772 PolarHBondContact O-N 2.98Å
769L90.9Very high88.6Confident0 Ų048.8 Ų48.80%027%0.268CS..Hα-helixtrans-65.3-39.2176.5-66.2176.8000111.9W752 L756 Y760 P762 C765 A766 L772 F773 V801 H802 L805W752-L769 HydrophobicContact CH2-CD2 4.25Å; W752-L769 HydrophobicContact CZ3-CD2 4.37Å; L756-L769 HydrophobicContact CD1-CD2 4.07Å; Y760-L769 HydrophobicContact CE1-CD1 4.14Å; Y760-L769 HydrophobicContact CE1-CD2 4.19Å; Y760-L769 HydrophobicContact CE1-CG 4.18Å; P762-L769 HydrophobicContact CB-CD1 4.12Å; C765-L769 PolarHBondContact O-N 3.38Å; A766-L769 PolarHBondContact O-N 3.21Å; L769-L772 WeakPolarHBondContact O-CB 3.38Å; L769-L772 PolarHBondContact O-N 3.47Å; L769-F773 HydrophobicContact CB-CE2 4.17Å; L769-F773 WeakPolarHBondContact O-CB 3.37Å; L769-F773 VanDerWaalsContact O-CD2 3.23Å; L769-F773 WeakPolarHBondContact O-CD2 3.38Å; L769-F773 VanDerWaalsContact O-CG 3.22Å; L769-F773 WeakPolarHBondContact O-CG 3.45Å; L769-F773 PolarHBondContact O-N 3.47Å; L769-V801 HydrophobicContact CD1-CG1 4.05Å; L769-V801 HydrophobicContact CD2-CG1 4.16Å; L769-H802 HydrophobicContact CD1-CB 3.94Å; L769-L805 HydrophobicContact CB-CD2 3.92Å
770Q92.6Very high90Very high62 Ų6246.5 Ų46.529%0.2924%0.244SC..Hα-helixtrans-61.4-48175.7-173.5176.711.700110.8A766 L772 F773 Q774 L805 E809A766-Q770 VanDerWaalsContact O-CB 3.24Å; A766-Q770 WeakPolarHBondContact O-CB 3.21Å; A766-Q770 PolarHBondContact O-N 3.04Å; Q770-L772 VanDerWaalsContact C-N 3.34Å; Q770-L772 PolarHBondContact O-N 3.43Å; Q770-F773 PolarHBondContact O-N 3.49Å; Q770-Q774 HydrophobicContact CG-CG 4.45Å; Q770-Q774 WeakPolarHBondContact O-CB 3.23Å; Q770-Q774 VanDerWaalsContact O-CG 3.25Å; Q770-Q774 WeakPolarHBondContact O-CG 3.49Å; Q770-Q774 PolarHBondContact O-N 3Å; Q770-L805 HydrophobicContact CB-CD1 4.25Å; Q770-L805 HydrophobicContact CB-CD2 4.14Å; Q770-L805 HydrophobicContact CG-CD1 4.28Å; Q770-E809 HydrophobicContact CG-CG 4.33Å; Q770-E809 PolarHBondContact NE2-OE1 2.86Å
771L93.7Very high90.5Very high73 Ų7347.4 Ų47.438%0.38225%0.25SC..Hα-helixtrans-58.5-47.2175.9178.463.9000111.1P767 H768 F773 Q774 Q775P767-L771 WeakPolarHBondContact O-CB 3.46Å; P767-L771 PolarHBondContact O-N 2.67Å; H768-L771 PolarHBondContact O-N 3.49Å; L771-F773 PolarHBondContact O-N 3.17Å; L771-Q774 PolarHBondContact O-N 3.32Å; L771-Q775 HydrophobicContact CD1-CG 4.17Å; L771-Q775 VanDerWaalsContact O-CG 3.3Å; L771-Q775 WeakPolarHBondContact O-CG 3.24Å; L771-Q775 PolarHBondContact O-N 3.41Å
772L94.8Very high90.9Very high0 Ų044.9 Ų44.90%024%0.236CC..Hα-helixtrans-56.5-52.3178.1178.378.8000111.7Y727 L731 V749 W752 L753 H768 L769 Q770 Q774 Q775 L776Y727-L772 HydrophobicContact CD2-CB 4.33Å; Y727-L772 HydrophobicContact CD2-CD1 3.78Å; Y727-L772 HydrophobicContact CE2-CB 4.15Å; Y727-L772 HydrophobicContact CE2-CD1 4.42Å; L731-L772 HydrophobicContact CD1-CD1 4.02Å; L731-L772 HydrophobicContact CD2-CD1 3.97Å; L731-L772 HydrophobicContact CG-CD1 4.22Å; V749-L772 HydrophobicContact CG1-CD1 3.76Å; W752-L772 HydrophobicContact CE3-CD2 4.21Å; W752-L772 HydrophobicContact CH2-CD2 4.46Å; W752-L772 HydrophobicContact CZ3-CD2 3.6Å; L753-L772 HydrophobicContact CD1-CD2 4.39Å; L753-L772 HydrophobicContact CD2-CD2 3.68Å; L753-L772 HydrophobicContact CG-CD2 4.11Å; H768-L772 WeakPolarHBondContact O-CB 3.38Å; H768-L772 PolarHBondContact O-N 2.98Å; L769-L772 WeakPolarHBondContact O-CB 3.38Å; L769-L772 PolarHBondContact O-N 3.47Å; Q770-L772 VanDerWaalsContact C-N 3.34Å; Q770-L772 PolarHBondContact O-N 3.43Å; L772-Q774 PolarHBondContact O-N 3.03Å; L772-Q775 PolarHBondContact O-N 3.44Å; L772-L776 HydrophobicContact CD1-CD1 4.18Å; L772-L776 HydrophobicContact CD1-CG 4.48Å; L772-L776 HydrophobicContact CG-CD1 3.99Å; L772-L776 WeakPolarHBondContact O-CB 3.47Å; L772-L776 WeakPolarHBondContact O-CG 3.25Å; L772-L776 PolarHBondContact O-N 3.44Å
773F95.2Very high91.3Very high0 Ų047.8 Ų47.80%026%0.255CS..Hα-helixtrans-64.3-41.4-178.4-63.9-30.9000112L769 Q770 L771 Q775 L776 L777 L795 H802 L805 L806L769-F773 HydrophobicContact CB-CE2 4.17Å; L769-F773 WeakPolarHBondContact O-CB 3.37Å; L769-F773 VanDerWaalsContact O-CD2 3.23Å; L769-F773 WeakPolarHBondContact O-CD2 3.38Å; L769-F773 VanDerWaalsContact O-CG 3.22Å; L769-F773 WeakPolarHBondContact O-CG 3.45Å; L769-F773 PolarHBondContact O-N 3.47Å; Q770-F773 PolarHBondContact O-N 3.49Å; L771-F773 PolarHBondContact O-N 3.17Å; F773-Q775 VanDerWaalsContact C-N 3.34Å; F773-Q775 PolarHBondContact O-N 3.29Å; F773-L776 PolarHBondContact O-N 3.1Å; F773-L777 VanDerWaalsContact O-CB 3.25Å; F773-L777 WeakPolarHBondContact O-CB 3.13Å; F773-L777 WeakPolarHBondContact O-CD1 3.48Å; F773-L777 WeakPolarHBondContact O-CG 3.49Å; F773-L777 PolarHBondContact O-N 3.42Å; F773-L795 HydrophobicContact CD1-CD2 4.12Å; F773-H802 HydrophobicContact CE2-CB 4.35Å; F773-L805 HydrophobicContact CD2-CD2 4.24Å; F773-L805 HydrophobicContact CD2-CG 4.16Å; F773-L805 HydrophobicContact CE2-CD2 4.24Å; F773-L805 HydrophobicContact CE2-CG 4.36Å; F773-L806 HydrophobicContact CB-CD1 3.83Å; F773-L806 HydrophobicContact CD1-CD1 3.82Å; F773-L806 HydrophobicContact CD2-CB 3.87Å; F773-L806 HydrophobicContact CD2-CD1 4.07Å; F773-L806 HydrophobicContact CE1-CD1 4.4Å; F773-L806 HydrophobicContact CE1-CD2 4.41Å; F773-L806 HydrophobicContact CE2-CB 3.79Å; F773-L806 HydrophobicContact CG-CB 4.31Å; F773-L806 HydrophobicContact CG-CD1 3.65Å; F773-L806 HydrophobicContact CG-CG 4.48Å; F773-L806 HydrophobicContact CZ-CB 4.17Å
774Q94.3Very high91.7Very high76 Ų7643.2 Ų43.236%0.35524%0.235SC..Hα-helixtrans-60-43.8176.1-74.9175.2-700112.1Q770 L771 L772 L778 E809Q770-Q774 HydrophobicContact CG-CG 4.45Å; Q770-Q774 WeakPolarHBondContact O-CB 3.23Å; Q770-Q774 VanDerWaalsContact O-CG 3.25Å; Q770-Q774 WeakPolarHBondContact O-CG 3.49Å; Q770-Q774 PolarHBondContact O-N 3Å; L771-Q774 PolarHBondContact O-N 3.32Å; L772-Q774 PolarHBondContact O-N 3.03Å; Q774-L778 PolarHBondContact O-N 3.15Å; Q774-L778 VanDerWaalsContact O-N 3.13Å; Q774-E809 HydrophobicContact CG-CG 4.44Å; Q774-E809 VanDerWaalsContact CG-OE2 3.3Å; Q774-E809 WeakPolarHBondContact CG-OE2 3.29Å; Q774-E809 PolarHBondContact NE2-OE2 3.35Å
775Q95.4Very high91.9Very high67 Ų6740.3 Ų40.331%0.31323%0.226SC..Hα-helixtrans-69.2-43.5178.2-65.3-57-65.500112L731 L771 L772 F773 L777 L778 H779L731-Q775 HydrophobicContact CD1-CB 4.02Å; L731-Q775 HydrophobicContact CD1-CG 4.1Å; L731-Q775 HydrophobicContact CD2-CB 4.15Å; L771-Q775 HydrophobicContact CD1-CG 4.17Å; L771-Q775 VanDerWaalsContact O-CG 3.3Å; L771-Q775 WeakPolarHBondContact O-CG 3.24Å; L771-Q775 PolarHBondContact O-N 3.41Å; L772-Q775 PolarHBondContact O-N 3.44Å; F773-Q775 VanDerWaalsContact C-N 3.34Å; F773-Q775 PolarHBondContact O-N 3.29Å; Q775-L777 PolarHBondContact O-N 3.13Å; Q775-L778 WeakPolarHBondContact O-CB 3.4Å; Q775-L778 PolarHBondContact O-N 3.29Å; Q775-H779 PolarHBondContact O-CD2 2.97Å; Q775-H779 PolarHBondContact O-N 3.46Å
776L95.6Very high92.2Very high0 Ų041.9 Ų41.90%024%0.237CC..Hα-helixtrans-63.8-40.3176.2-72.2177.9000111.8L731 L734 L746 V749 L772 F773 L778 H779 L780 V791 V794 L795L731-L776 HydrophobicContact CD2-CD2 4.24Å; L731-L776 HydrophobicContact CD2-CG 4.4Å; L734-L776 HydrophobicContact CD1-CD2 3.79Å; L746-L776 HydrophobicContact CD1-CD2 3.77Å; V749-L776 HydrophobicContact CG1-CD1 4.28Å; V749-L776 HydrophobicContact CG1-CD2 4.44Å; L772-L776 HydrophobicContact CD1-CD1 4.18Å; L772-L776 HydrophobicContact CD1-CG 4.48Å; L772-L776 HydrophobicContact CG-CD1 3.99Å; L772-L776 WeakPolarHBondContact O-CB 3.47Å; L772-L776 WeakPolarHBondContact O-CG 3.25Å; L772-L776 PolarHBondContact O-N 3.44Å; F773-L776 PolarHBondContact O-N 3.1Å; L776-L778 VanDerWaalsContact C-N 3.29Å; L776-L778 PolarHBondContact O-N 3.38Å; L776-H779 CarbonylContact O-C 3.45Å; L776-H779 PolarHBondContact O-N 3.2Å; L776-H779 VanDerWaalsContact O-N 3.09Å; L776-L780 PolarHBondContact O-N 3.38Å; L776-V791 HydrophobicContact CB-CG1 4.28Å; L776-V791 HydrophobicContact CD2-CG1 4.5Å; L776-V791 WeakPolarHBondContact O-CG1 3.48Å; L776-V794 HydrophobicContact CD1-CG1 3.98Å; L776-L795 HydrophobicContact CB-CD1 4.27Å; L776-L795 HydrophobicContact CB-CD2 3.56Å; L776-L795 HydrophobicContact CB-CG 3.97Å; L776-L795 HydrophobicContact CD1-CD2 3.83Å; L776-L795 HydrophobicContact CD1-CG 4.34Å; L776-L795 HydrophobicContact CG-CD2 4.37Å
777L95.3Very high92.5Very high0 Ų040.8 Ų40.80%023%0.228CC..Hα-helixtrans-63.2-35.1175.9-75165.8000112F773 Q775 H779 L780 L795 L806 E809 A810 V813 H817 L826F773-L777 VanDerWaalsContact O-CB 3.25Å; F773-L777 WeakPolarHBondContact O-CB 3.13Å; F773-L777 WeakPolarHBondContact O-CD1 3.48Å; F773-L777 WeakPolarHBondContact O-CG 3.49Å; F773-L777 PolarHBondContact O-N 3.42Å; Q775-L777 PolarHBondContact O-N 3.13Å; L777-H779 VanDerWaalsContact C-N 3.31Å; L777-H779 PolarHBondContact O-N 2.94Å; L777-L780 HydrophobicContact CD2-CD2 3.95Å; L777-L780 VanDerWaalsContact O-CB 3.26Å; L777-L780 WeakPolarHBondContact O-CB 3.23Å; L777-L780 PolarHBondContact O-N 2.94Å; L777-L780 VanDerWaalsContact O-N 3.12Å; L777-L795 HydrophobicContact CD2-CD1 3.84Å; L777-L795 HydrophobicContact CG-CD1 4.21Å; L777-L806 HydrophobicContact CD1-CD1 4.4Å; L777-E809 HydrophobicContact CD1-CB 3.79Å; L777-A810 HydrophobicContact CD1-CB 4.31Å; L777-A810 HydrophobicContact CD2-CB 4.06Å; L777-V813 HydrophobicContact CB-CG2 4.09Å; L777-V813 HydrophobicContact CD1-CG2 4.11Å; L777-V813 HydrophobicContact CD2-CG2 4.28Å; L777-V813 HydrophobicContact CG-CG2 4.39Å; L777-H817 PolarHBondContact O-CE1 3.44Å; L777-H817 PolarHBondContact O-NE2 3.33Å; L777-L826 HydrophobicContact CD2-CD2 3.97Å
778L94.1Very high92.6Very high98 Ų9837.8 Ų37.851%0.51321%0.207SC..Hα-helixtrans-59.6-42.7171.3-177.4148.4000111.5Q774 Q775 L776 L780 D781Q774-L778 PolarHBondContact O-N 3.15Å; Q774-L778 VanDerWaalsContact O-N 3.13Å; Q775-L778 WeakPolarHBondContact O-CB 3.4Å; Q775-L778 PolarHBondContact O-N 3.29Å; L776-L778 VanDerWaalsContact C-N 3.29Å; L776-L778 PolarHBondContact O-N 3.38Å; L778-L780 VanDerWaalsContact C-N 3.32Å; L778-D781 PolarHBondContact O-N 3.11Å
779H93.6Very high92.7Very high5 Ų538.6 Ų38.62%0.02321%0.213CC..Hα-helixtrans-78-11.2175.3-63.9-65.1000114.3L734 D735 Q775 L776 L777 D781 D782 V791L734-H779 WeakPolarHBondContact CB-NE2 3.31Å; L734-H779 VanDerWaalsContact CD1-CD2 3.49Å; L734-H779 WeakPolarHBondContact CD1-CD2 3.25Å; D735-H779 IonicContact OD1-CE1 3.44Å; D735-H779 PolarHBondContact OD1-CE1 2.84Å; D735-H779 VanDerWaalsContact OD1-CE1 3.32Å; Q775-H779 PolarHBondContact O-CD2 2.97Å; Q775-H779 PolarHBondContact O-N 3.46Å; L776-H779 CarbonylContact O-C 3.45Å; L776-H779 PolarHBondContact O-N 3.2Å; L776-H779 VanDerWaalsContact O-N 3.09Å; L777-H779 VanDerWaalsContact C-N 3.31Å; L777-H779 PolarHBondContact O-N 2.94Å; H779-D781 PolarHBondContact O-N 3.22Å; H779-D782 VanDerWaalsContact O-CB 3.23Å; H779-D782 WeakPolarHBondContact O-CB 3.36Å; H779-D782 PolarHBondContact O-N 3.42Å; H779-D782 VanDerWaalsContact O-N 3.16Å; H779-V791 HydrophobicContact CB-CG2 4Å
780L94.1Very high92.8Very high1 Ų141.5 Ų41.51%0.00523%0.227CC..Hα-helixtrans-68.2-22.5169.3-167.966.1000110.8L776 L777 L778 Q788 V791 L792 L795 H822 L826L776-L780 PolarHBondContact O-N 3.38Å; L777-L780 HydrophobicContact CD2-CD2 3.95Å; L777-L780 VanDerWaalsContact O-CB 3.26Å; L777-L780 WeakPolarHBondContact O-CB 3.23Å; L777-L780 PolarHBondContact O-N 2.94Å; L777-L780 VanDerWaalsContact O-N 3.12Å; L778-L780 VanDerWaalsContact C-N 3.32Å; L780-Q788 WeakPolarHBondContact O-CG 3.47Å; L780-Q788 PolarHBondContact O-NE2 2.96Å; L780-V791 HydrophobicContact CB-CG1 4.08Å; L780-V791 HydrophobicContact CD1-CB 4.37Å; L780-V791 HydrophobicContact CD1-CG1 4.11Å; L780-L792 HydrophobicContact CD1-CB 3.73Å; L780-L792 HydrophobicContact CD1-CD1 4.31Å; L780-L795 HydrophobicContact CB-CD1 4.3Å; L780-L795 HydrophobicContact CD1-CD1 4.26Å; L780-L795 HydrophobicContact CD2-CD1 3.96Å; L780-L795 HydrophobicContact CG-CD1 4.42Å; L780-H822 HydrophobicContact CD1-CB 3.83Å; L780-H822 HydrophobicContact CD2-CB 4.1Å; L780-H822 HydrophobicContact CG-CB 3.79Å; L780-L826 HydrophobicContact CD2-CD2 4.46Å
781D93.1Very high92.9Very high30 Ų3038.5 Ų38.516%0.1621%0.213CC..THydrogen-bonded Turntrans-97.528.8170.3-162.220.6000113L778 H779 H817 R818L778-D781 PolarHBondContact O-N 3.11Å; H779-D781 PolarHBondContact O-N 3.22Å; D781-H817 HydrophobicContact CB-CB 4.1Å; D781-H817 VanDerWaalsContact OD2-CA 3.25Å; D781-H817 WeakPolarHBondContact OD2-CA 3.47Å; D781-R818 VanDerWaalsContact O-CZ 3.22Å; D781-R818 PolarHBondContact O-NE 3.09Å; D781-R818 PolarHBondContact O-NH2 3.22Å; D781-R818 WeakPolarHBondContact OD1-CB 3.4Å; D781-R818 IonicContact OD1-CZ 3.95Å; D781-R818 PolarHBondContact OD1-N 3.1Å; D781-R818 IonicContact OD1-NE 3.32Å; D781-R818 PolarHBondContact OD1-NE 3.23Å; D781-R818 IonicContact OD1-NH2 3.23Å; D781-R818 PolarHBondContact OD1-NH2 3.02Å; D781-R818 WeakPolarHBondContact OD2-CG 3.33Å; D781-R818 PolarHBondContact OD2-N 3.13Å; D781-R818 IonicContact OD2-NE 2.74Å
782D91.6Very high93Very high15 Ų1535.4 Ų35.48%0.0820%0.197CC..  trans-65.6144.5175.8-162.8-92.4000112.6R742 H779 D784 M787 Q788 R818R742-D782 IonicContact CZ-OD2 3.93Å; R742-D782 VanDerWaalsContact CZ-OD2 3.3Å; R742-D782 IonicContact NH1-OD1 2.69Å; R742-D782 PolarHBondContact NH1-OD1 3.15Å; R742-D782 IonicContact NH1-OD2 2.93Å; R742-D782 PolarHBondContact NH1-OD2 2.87Å; R742-D782 VanDerWaalsContact NH1-OD2 3.11Å; R742-D782 IonicContact NH2-OD1 2.71Å; R742-D782 IonicContact NH2-OD2 3Å; R742-D782 PolarHBondContact NH2-OD2 2.91Å; H779-D782 VanDerWaalsContact O-CB 3.23Å; H779-D782 WeakPolarHBondContact O-CB 3.36Å; H779-D782 PolarHBondContact O-N 3.42Å; H779-D782 VanDerWaalsContact O-N 3.16Å; D782-D784 PolarHBondContact O-N 3.39Å; D782-D784 WeakPolarHBondContact OD1-CB 3.39Å; D782-D784 PolarHBondContact OD1-N 2.95Å; D782-M787 HydrophobicContact CB-CB 4.09Å; D782-M787 HydrophobicContact CB-CG 3.98Å; D782-Q788 HydrophobicContact CB-CG 4.18Å; D782-Q788 VanDerWaalsContact O-CG 3.24Å; D782-Q788 WeakPolarHBondContact O-CG 3.34Å; D782-Q788 PolarHBondContact O-NE2 2.74Å; D782-R818 PolarHBondContact O-NH2 3.4Å
783P87.1Confident93Very high103 Ų10340 Ų4067%0.66922%0.218SC*.SBendtrans-60.5-24.6173.624.2-36000114.9
784D88.9Confident92.9Very high43 Ų4340.3 Ų40.323%0.2322%0.22CC..SBendtrans-88.5113.6177.217528.6000111.9Q739 D782 S786 M787 Q788Q739-D784 PolarHBondContact NE2-OD2 3.16Å; D782-D784 PolarHBondContact O-N 3.39Å; D782-D784 WeakPolarHBondContact OD1-CB 3.39Å; D782-D784 PolarHBondContact OD1-N 2.95Å; D784-S786 PolarHBondContact O-N 2.89Å; D784-S786 VanDerWaalsContact O-N 3.15Å; D784-S786 PolarHBondContact OD1-N 3.28Å; D784-S786 VanDerWaalsContact OD1-N 3.15Å; D784-M787 HydrophobicContact CB-CB 4.15Å; D784-M787 WeakPolarHBondContact O-CB 3.34Å; D784-M787 PolarHBondContact O-N 3.01Å; D784-M787 PolarHBondContact OD2-N 2.63Å; D784-Q788 WeakPolarHBondContact O-CG 3.4Å; D784-Q788 PolarHBondContact O-N 3.11Å; D784-Q788 VanDerWaalsContact O-N 3.08Å
785S88.9Confident93Very high75 Ų7536.7 Ų36.752%0.52420%0.203SC..Hα-helixtrans-53.5-34.7177.355.80000114M787 Q788 D789S785-M787 VanDerWaalsContact C-N 3.34Å; S785-M787 PolarHBondContact O-N 3.08Å; S785-Q788 PolarHBondContact O-N 3.26Å; S785-D789 PolarHBondContact O-N 3Å
786S90.3Very high92.8Very high50 Ų5035.5 Ų35.535%0.3520%0.197SC..Hα-helixtrans-66.4-37.5177.8177.50000111.8D784 Q790D784-S786 PolarHBondContact O-N 2.89Å; D784-S786 VanDerWaalsContact O-N 3.15Å; D784-S786 PolarHBondContact OD1-N 3.28Å; D784-S786 VanDerWaalsContact OD1-N 3.15Å; S786-Q790 VanDerWaalsContact O-CG 3.31Å; S786-Q790 WeakPolarHBondContact O-CG 3.32Å; S786-Q790 PolarHBondContact O-N 3.19Å; S786-Q790 VanDerWaalsContact O-N 3.13Å; S786-Q790 PolarHBondContact O-NE2 3.46Å; S786-Q790 PolarHBondContact OG-NE2 3.03Å
787M91Very high92.5Very high0 Ų039.9 Ų39.90%022%0.22CC..Hα-helixtrans-67.9-44.4174.3-172.557.755.900110.9R742 L746 D782 D784 S785 D789 Q790 V791R742-M787 HydrophobicContact CB-CE 3.49Å; R742-M787 VanDerWaalsContact CB-CE 3.49Å; L746-M787 HydrophobicContact CD2-SD 3.82Å; D782-M787 HydrophobicContact CB-CB 4.09Å; D782-M787 HydrophobicContact CB-CG 3.98Å; D784-M787 HydrophobicContact CB-CB 4.15Å; D784-M787 WeakPolarHBondContact O-CB 3.34Å; D784-M787 PolarHBondContact O-N 3.01Å; D784-M787 PolarHBondContact OD2-N 2.63Å; S785-M787 VanDerWaalsContact C-N 3.34Å; S785-M787 PolarHBondContact O-N 3.08Å; M787-D789 VanDerWaalsContact C-N 3.31Å; M787-D789 PolarHBondContact O-N 2.95Å; M787-Q790 PolarHBondContact O-N 2.99Å; M787-V791 HydrophobicContact CG-CG2 4.22Å; M787-V791 WeakPolarHBondContact O-CB 3.47Å; M787-V791 VanDerWaalsContact O-CG2 3.22Å; M787-V791 WeakPolarHBondContact O-CG2 3.5Å; M787-V791 PolarHBondContact O-N 3.38Å; M787-V791 HydrophobicContact SD-CG2 4.08Å
788Q92.9Very high92.2Very high26 Ų2639.9 Ų39.912%0.12122%0.22CC..Hα-helixtrans-57.2-45.2177.5-60-174.9-70.300111.8L780 D782 D784 S785 V791 L792L780-Q788 WeakPolarHBondContact O-CG 3.47Å; L780-Q788 PolarHBondContact O-NE2 2.96Å; D782-Q788 HydrophobicContact CB-CG 4.18Å; D782-Q788 VanDerWaalsContact O-CG 3.24Å; D782-Q788 WeakPolarHBondContact O-CG 3.34Å; D782-Q788 PolarHBondContact O-NE2 2.74Å; D784-Q788 WeakPolarHBondContact O-CG 3.4Å; D784-Q788 PolarHBondContact O-N 3.11Å; D784-Q788 VanDerWaalsContact O-N 3.08Å; S785-Q788 PolarHBondContact O-N 3.26Å; Q788-V791 PolarHBondContact O-N 2.95Å; Q788-L792 WeakPolarHBondContact O-CB 3.2Å; Q788-L792 PolarHBondContact O-N 3.42Å
789D92.8Very high92Very high87 Ų8735.2 Ų35.247%0.46520%0.196SC..Hα-helixtrans-66.3-42.9179.5-69.2-16.2000111.8S785 M787 L792 E793 H822S785-D789 PolarHBondContact O-N 3Å; M787-D789 VanDerWaalsContact C-N 3.31Å; M787-D789 PolarHBondContact O-N 2.95Å; D789-L792 PolarHBondContact O-N 3.46Å; D789-E793 PolarHBondContact O-N 3.25Å; D789-H822 IonicContact OD1-CD2 3.26Å; D789-H822 IonicContact OD1-NE2 3.96Å; D789-H822 PolarHBondContact OD1-NE2 3.26Å
790Q93.6Very high91.6Very high60 Ų6039.6 Ų39.628%0.2823%0.227SC..Hα-helixtrans-63.4-43.4175.8-71.6176.767.600111.8L746 S786 M787 L792 E793 V794L746-Q790 HydrophobicContact CD2-CB 3.47Å; L746-Q790 VanDerWaalsContact CD2-CB 3.47Å; S786-Q790 VanDerWaalsContact O-CG 3.31Å; S786-Q790 WeakPolarHBondContact O-CG 3.32Å; S786-Q790 PolarHBondContact O-N 3.19Å; S786-Q790 VanDerWaalsContact O-N 3.13Å; S786-Q790 PolarHBondContact O-NE2 3.46Å; S786-Q790 PolarHBondContact OG-NE2 3.03Å; M787-Q790 PolarHBondContact O-N 2.99Å; Q790-L792 VanDerWaalsContact C-N 3.34Å; Q790-E793 PolarHBondContact O-N 3.36Å; Q790-V794 WeakPolarHBondContact O-CG2 3.46Å; Q790-V794 PolarHBondContact O-N 3.2Å; Q790-V794 VanDerWaalsContact O-N 3.11Å
791V95.4Very high91.3Very high0 Ų040.9 Ų40.90%024%0.235CC..Hα-helixtrans-65.3-40.3179.8172.20000110.7L746 L776 H779 L780 M787 Q788 E793 V794 L795L746-V791 HydrophobicContact CD1-CG2 4.04Å; L746-V791 HydrophobicContact CD2-CB 4.37Å; L746-V791 HydrophobicContact CD2-CG2 3.55Å; L746-V791 HydrophobicContact CG-CG2 4.47Å; L776-V791 HydrophobicContact CB-CG1 4.28Å; L776-V791 HydrophobicContact CD2-CG1 4.5Å; L776-V791 WeakPolarHBondContact O-CG1 3.48Å; H779-V791 HydrophobicContact CB-CG2 4Å; L780-V791 HydrophobicContact CB-CG1 4.08Å; L780-V791 HydrophobicContact CD1-CB 4.37Å; L780-V791 HydrophobicContact CD1-CG1 4.11Å; M787-V791 HydrophobicContact CG-CG2 4.22Å; M787-V791 WeakPolarHBondContact O-CB 3.47Å; M787-V791 VanDerWaalsContact O-CG2 3.22Å; M787-V791 WeakPolarHBondContact O-CG2 3.5Å; M787-V791 PolarHBondContact O-N 3.38Å; M787-V791 HydrophobicContact SD-CG2 4.08Å; Q788-V791 PolarHBondContact O-N 2.95Å; V791-E793 VanDerWaalsContact C-N 3.31Å; V791-E793 PolarHBondContact O-N 3.01Å; V791-V794 PolarHBondContact O-N 3.24Å; V791-L795 HydrophobicContact CG1-CD1 3.91Å; V791-L795 HydrophobicContact CG1-CG 4.31Å; V791-L795 WeakPolarHBondContact O-CB 3.33Å; V791-L795 WeakPolarHBondContact O-CG 3.41Å; V791-L795 PolarHBondContact O-N 2.71Å
792L94.4Very high91.1Very high7 Ų740.2 Ų40.24%0.03723%0.231CC..Hα-helixtrans-56.2-46.4175178.959.5000111.2L780 Q788 D789 Q790 V794 L795 K796 L825 L826L780-L792 HydrophobicContact CD1-CB 3.73Å; L780-L792 HydrophobicContact CD1-CD1 4.31Å; Q788-L792 WeakPolarHBondContact O-CB 3.2Å; Q788-L792 PolarHBondContact O-N 3.42Å; D789-L792 PolarHBondContact O-N 3.46Å; Q790-L792 VanDerWaalsContact C-N 3.34Å; L792-V794 PolarHBondContact O-N 2.69Å; L792-L795 PolarHBondContact O-N 3.47Å; L792-K796 HydrophobicContact CD1-CG 4.49Å; L792-K796 HydrophobicContact CG-CD 4.46Å; L792-K796 VanDerWaalsContact O-CG 3.32Å; L792-K796 WeakPolarHBondContact O-CG 3.25Å; L792-K796 PolarHBondContact O-N 2.9Å; L792-L825 HydrophobicContact CD2-CB 4.13Å; L792-L825 HydrophobicContact CD2-CD1 4.16Å; L792-L826 HydrophobicContact CD1-CB 3.76Å; L792-L826 HydrophobicContact CD1-CD1 4.3Å
793E94.8Very high91Very high96 Ų9641.5 Ų41.545%0.44924%0.24SC..Hα-helixtrans-64.7-38.4177.9-66.5-54.6120.300112.4D789 Q790 V791 K796 N797D789-E793 PolarHBondContact O-N 3.25Å; Q790-E793 PolarHBondContact O-N 3.36Å; V791-E793 VanDerWaalsContact C-N 3.31Å; V791-E793 PolarHBondContact O-N 3.01Å; E793-K796 PolarHBondContact O-N 3.46Å; E793-K796 IonicContact OE1-NZ 2.85Å; E793-K796 PolarHBondContact OE1-NZ 3.49Å; E793-N797 PolarHBondContact O-N 3Å
794V94.7Very high91.1Very high8 Ų839.8 Ų39.85%0.04823%0.231CC..Hα-helixtrans-64.8-42.1174.2179.40000111.7L746 V749 A750 L753 L776 Q790 V791 L792 N797 G798L746-V794 HydrophobicContact CD1-CB 4.05Å; L746-V794 HydrophobicContact CD1-CG1 4.23Å; L746-V794 HydrophobicContact CD1-CG2 3.67Å; L746-V794 HydrophobicContact CD2-CG2 4.49Å; L746-V794 HydrophobicContact CG-CG2 3.79Å; V749-V794 HydrophobicContact CG1-CG1 4.15Å; A750-V794 HydrophobicContact CB-CG1 4.24Å; A750-V794 HydrophobicContact CB-CG2 3.74Å; L753-V794 HydrophobicContact CD1-CG1 3.71Å; L776-V794 HydrophobicContact CD1-CG1 3.98Å; Q790-V794 WeakPolarHBondContact O-CG2 3.46Å; Q790-V794 PolarHBondContact O-N 3.2Å; Q790-V794 VanDerWaalsContact O-N 3.11Å; V791-V794 PolarHBondContact O-N 3.24Å; L792-V794 PolarHBondContact O-N 2.69Å; V794-N797 WeakPolarHBondContact O-CB 3.17Å; V794-N797 PolarHBondContact O-N 3.3Å; V794-G798 PolarHBondContact O-N 3.18Å
795L94.6Very high91.2Very high0 Ų038.3 Ų38.30%022%0.223CC..Hα-helixtrans-66.3-37.8176.6-75.7172.5000112.3F773 L776 L777 L780 V791 L792 N797 G798 S799 L806 L826F773-L795 HydrophobicContact CD1-CD2 4.12Å; L776-L795 HydrophobicContact CB-CD1 4.27Å; L776-L795 HydrophobicContact CB-CD2 3.56Å; L776-L795 HydrophobicContact CB-CG 3.97Å; L776-L795 HydrophobicContact CD1-CD2 3.83Å; L776-L795 HydrophobicContact CD1-CG 4.34Å; L776-L795 HydrophobicContact CG-CD2 4.37Å; L777-L795 HydrophobicContact CD2-CD1 3.84Å; L777-L795 HydrophobicContact CG-CD1 4.21Å; L780-L795 HydrophobicContact CB-CD1 4.3Å; L780-L795 HydrophobicContact CD1-CD1 4.26Å; L780-L795 HydrophobicContact CD2-CD1 3.96Å; L780-L795 HydrophobicContact CG-CD1 4.42Å; V791-L795 HydrophobicContact CG1-CD1 3.91Å; V791-L795 HydrophobicContact CG1-CG 4.31Å; V791-L795 WeakPolarHBondContact O-CB 3.33Å; V791-L795 WeakPolarHBondContact O-CG 3.41Å; V791-L795 PolarHBondContact O-N 2.71Å; L792-L795 PolarHBondContact O-N 3.47Å; L795-N797 VanDerWaalsContact C-N 3.33Å; L795-N797 PolarHBondContact O-N 3.5Å; L795-G798 CarbonylContact O-C 3.6Å; L795-G798 PolarHBondContact O-N 2.69Å; L795-G798 VanDerWaalsContact O-N 3.15Å; L795-S799 PolarHBondContact O-N 2.94Å; L795-L806 HydrophobicContact CD2-CD1 3.83Å; L795-L806 WeakPolarHBondContact O-CD2 3.25Å; L795-L826 HydrophobicContact CB-CD1 3.83Å; L795-L826 HydrophobicContact CB-CD2 3.88Å; L795-L826 HydrophobicContact CD1-CD2 3.88Å; L795-L826 HydrophobicContact CG-CD2 4.4Å
796K92.8Very high91.4Very high42 Ų4234.8 Ų34.818%0.18320%0.198CC..Hα-helixtrans-59-45.1171.2-74.2175.1-177.4165.70111L792 E793 G798 S799 L826 H829L792-K796 HydrophobicContact CD1-CG 4.49Å; L792-K796 HydrophobicContact CG-CD 4.46Å; L792-K796 VanDerWaalsContact O-CG 3.32Å; L792-K796 WeakPolarHBondContact O-CG 3.25Å; L792-K796 PolarHBondContact O-N 2.9Å; E793-K796 PolarHBondContact O-N 3.46Å; E793-K796 IonicContact OE1-NZ 2.85Å; E793-K796 PolarHBondContact OE1-NZ 3.49Å; K796-G798 VanDerWaalsContact C-N 3.33Å; K796-G798 PolarHBondContact O-N 3.4Å; K796-S799 WeakPolarHBondContact O-CB 3.34Å; K796-S799 PolarHBondContact O-N 3.44Å; K796-S799 PolarHBondContact O-OG 2.99Å; K796-L826 HydrophobicContact CG-CD1 4.06Å; K796-H829 HydrophobicContact CG-CB 4.16Å
797N88.6Confident91.5Very high91 Ų9135.5 Ų35.549%0.48720%0.196SC..Hα-helixtrans-63.1-39.8173.6-67.1-18.4000111.9E793 V794 L795 S799 S800E793-N797 PolarHBondContact O-N 3Å; V794-N797 WeakPolarHBondContact O-CB 3.17Å; V794-N797 PolarHBondContact O-N 3.3Å; L795-N797 VanDerWaalsContact C-N 3.33Å; L795-N797 PolarHBondContact O-N 3.5Å; N797-S799 PolarHBondContact O-N 2.86Å; N797-S800 PolarHBondContact O-N 3.37Å; N797-S800 PolarHBondContact O-OG 3.37Å
798G88.4Confident91.6Very high0 Ų041.9 Ų41.90%022%0.22CC..Hα-helixtrans-62.5-26.5175.600000113.9V794 L795 K796 S800 V801V794-G798 PolarHBondContact O-N 3.18Å; L795-G798 CarbonylContact O-C 3.6Å; L795-G798 PolarHBondContact O-N 2.69Å; L795-G798 VanDerWaalsContact O-N 3.15Å; K796-G798 VanDerWaalsContact C-N 3.33Å; K796-G798 PolarHBondContact O-N 3.4Å; G798-S800 PolarHBondContact O-N 3.41Å; G798-V801 WeakPolarHBondContact O-CB 3.36Å; G798-V801 PolarHBondContact O-N 2.9Å
799S89.6Confident91.7Very high1 Ų141.3 Ų41.31%0.00722%0.217CC..THydrogen-bonded Turntrans-64-22.8178.976.30000114L795 K796 N797 V801 P803 L833L795-S799 PolarHBondContact O-N 2.94Å; K796-S799 WeakPolarHBondContact O-CB 3.34Å; K796-S799 PolarHBondContact O-N 3.44Å; K796-S799 PolarHBondContact O-OG 2.99Å; N797-S799 PolarHBondContact O-N 2.86Å; S799-V801 VanDerWaalsContact C-N 3.29Å; S799-P803 WeakPolarHBondContact O-CA 3.22Å; S799-P803 VanDerWaalsContact O-CB 3.25Å; S799-P803 WeakPolarHBondContact O-CB 3.49Å; S799-P803 VanDerWaalsContact O-CD 3.31Å; S799-P803 WeakPolarHBondContact O-CD 3.26Å; S799-L833 WeakPolarHBondContact OG-CD1 3.3Å
800S86.6Confident91.7Very high96 Ų9637.2 Ų37.267%0.67120%0.195SC*.THydrogen-bonded Turntrans-75.9-17.617466.30000113.4N797 G798N797-S800 PolarHBondContact O-N 3.37Å; N797-S800 PolarHBondContact O-OG 3.37Å; G798-S800 PolarHBondContact O-N 3.41Å
801V87.2Confident91.6Very high28 Ų2839 Ų3917%0.1720%0.204CC..THydrogen-bonded Turntrans-85.6-47.8-177.7-177.80000111L753 L756 L769 G798 S799L753-V801 HydrophobicContact CD2-CG2 4.23Å; L756-V801 HydrophobicContact CD1-CG1 3.74Å; L756-V801 HydrophobicContact CD1-CG2 4.25Å; L769-V801 HydrophobicContact CD1-CG1 4.05Å; L769-V801 HydrophobicContact CD2-CG1 4.16Å; G798-V801 WeakPolarHBondContact O-CB 3.36Å; G798-V801 PolarHBondContact O-N 2.9Å; S799-V801 VanDerWaalsContact C-N 3.29Å
802H89.3Confident91.5Very high16 Ų1641.5 Ų41.57%0.07422%0.224CC..  trans-15078.7177.8-161.7-27.8000111.3P762 E763 L769 F773 S804 L805 L806P762-H802 HydrophobicContact CB-CB 4.46Å; E763-H802 IonicContact OE1-NE2 2.71Å; L769-H802 HydrophobicContact CD1-CB 3.94Å; F773-H802 HydrophobicContact CE2-CB 4.35Å; H802-S804 PolarHBondContact CE1-OG 2.93Å; H802-S804 PolarHBondContact ND1-OG 2.96Å; H802-S804 PolarHBondContact O-N 3.34Å; H802-L805 HydrophobicContact CB-CB 4.27Å; H802-L805 WeakPolarHBondContact ND1-CB 3.23Å; H802-L805 PolarHBondContact ND1-N 3.26Å; H802-L805 PolarHBondContact O-N 3.31Å; H802-L806 PolarHBondContact O-N 3.26Å; H802-L806 VanDerWaalsContact O-N 3.15Å
803P88.6Confident91.4Very high42 Ų4242.6 Ų42.627%0.27323%0.231SC..Hα-helixtrans-62.9-41.2-169.419.7-30.4000113.7S799 L806 Q807 I830S799-P803 WeakPolarHBondContact O-CA 3.22Å; S799-P803 VanDerWaalsContact O-CB 3.25Å; S799-P803 WeakPolarHBondContact O-CB 3.49Å; S799-P803 VanDerWaalsContact O-CD 3.31Å; S799-P803 WeakPolarHBondContact O-CD 3.26Å; P803-L806 PolarHBondContact O-N 3.47Å; P803-Q807 WeakPolarHBondContact O-CB 3.49Å; P803-Q807 PolarHBondContact O-N 3.41Å; P803-I830 HydrophobicContact CB-CG2 4.29Å
804S89.4Confident91.3Very high68 Ų6841.7 Ų41.748%0.47622%0.223SC..Hα-helixtrans-65.3-41-178.851.10000113H802 R808H802-S804 PolarHBondContact CE1-OG 2.93Å; H802-S804 PolarHBondContact ND1-OG 2.96Å; H802-S804 PolarHBondContact O-N 3.34Å; S804-R808 PolarHBondContact O-N 2.89Å; S804-R808 VanDerWaalsContact O-N 3.14Å
805L90.8Very high91.1Very high12 Ų1247.6 Ų47.66%0.06326%0.255CS..Hα-helixtrans-66-49.1176178.561.9000110.6L769 Q770 F773 H802 Q807 R808 E809L769-L805 HydrophobicContact CB-CD2 3.92Å; Q770-L805 HydrophobicContact CB-CD1 4.25Å; Q770-L805 HydrophobicContact CB-CD2 4.14Å; Q770-L805 HydrophobicContact CG-CD1 4.28Å; F773-L805 HydrophobicContact CD2-CD2 4.24Å; F773-L805 HydrophobicContact CD2-CG 4.16Å; F773-L805 HydrophobicContact CE2-CD2 4.24Å; F773-L805 HydrophobicContact CE2-CG 4.36Å; H802-L805 HydrophobicContact CB-CB 4.27Å; H802-L805 WeakPolarHBondContact ND1-CB 3.23Å; H802-L805 PolarHBondContact ND1-N 3.26Å; H802-L805 PolarHBondContact O-N 3.31Å; L805-Q807 VanDerWaalsContact C-N 3.32Å; L805-Q807 PolarHBondContact O-N 3.47Å; L805-R808 VanDerWaalsContact CD1-NH2 3.34Å; L805-R808 PolarHBondContact O-N 3.4Å; L805-E809 HydrophobicContact CD1-CG 4.24Å; L805-E809 WeakPolarHBondContact O-CG 3.43Å; L805-E809 PolarHBondContact O-N 3.03Å
806L93.1Very high90.9Very high0 Ų055.4 Ų55.40%029%0.289CS..Hα-helixtrans-62.2-39.9179.3179.457.9000112.1F773 L777 L795 H802 P803 E809 A810 L826 I830F773-L806 HydrophobicContact CB-CD1 3.83Å; F773-L806 HydrophobicContact CD1-CD1 3.82Å; F773-L806 HydrophobicContact CD2-CB 3.87Å; F773-L806 HydrophobicContact CD2-CD1 4.07Å; F773-L806 HydrophobicContact CE1-CD1 4.4Å; F773-L806 HydrophobicContact CE1-CD2 4.41Å; F773-L806 HydrophobicContact CE2-CB 3.79Å; F773-L806 HydrophobicContact CG-CB 4.31Å; F773-L806 HydrophobicContact CG-CD1 3.65Å; F773-L806 HydrophobicContact CG-CG 4.48Å; F773-L806 HydrophobicContact CZ-CB 4.17Å; L777-L806 HydrophobicContact CD1-CD1 4.4Å; L795-L806 HydrophobicContact CD2-CD1 3.83Å; L795-L806 WeakPolarHBondContact O-CD2 3.25Å; H802-L806 PolarHBondContact O-N 3.26Å; H802-L806 VanDerWaalsContact O-N 3.15Å; P803-L806 PolarHBondContact O-N 3.47Å; L806-E809 PolarHBondContact O-N 3.39Å; L806-A810 VanDerWaalsContact O-CB 3.25Å; L806-A810 WeakPolarHBondContact O-CB 3.44Å; L806-A810 PolarHBondContact O-N 2.92Å; L806-L826 HydrophobicContact CD1-CD2 4.33Å; L806-L826 HydrophobicContact CD2-CD1 4.37Å; L806-I830 HydrophobicContact CB-CD1 4.45Å; L806-I830 HydrophobicContact CD2-CD1 4.06Å; L806-I830 HydrophobicContact CG-CD1 3.91Å
807Q92.8Very high90.9Very high65 Ų6554.8 Ų54.830%0.30429%0.286SS..Hα-helixtrans-58-49.6175-177.7176-8.600111.3P803 L805 E809 A810 E811 L827 I830P803-Q807 WeakPolarHBondContact O-CB 3.49Å; P803-Q807 PolarHBondContact O-N 3.41Å; L805-Q807 VanDerWaalsContact C-N 3.32Å; L805-Q807 PolarHBondContact O-N 3.47Å; Q807-E809 PolarHBondContact O-N 3.32Å; Q807-A810 PolarHBondContact O-N 3.45Å; Q807-E811 HydrophobicContact CG-CG 4.47Å; Q807-E811 WeakPolarHBondContact CG-OE1 3.25Å; Q807-E811 PolarHBondContact NE2-OE1 2.73Å; Q807-E811 WeakPolarHBondContact O-CB 3.24Å; Q807-E811 WeakPolarHBondContact O-CG 3.34Å; Q807-E811 PolarHBondContact O-N 2.76Å; Q807-L827 HydrophobicContact CG-CD2 3.92Å; Q807-I830 HydrophobicContact CB-CD1 4.42Å; Q807-I830 HydrophobicContact CB-CG2 4.2Å
808R93.6Very high90.9Very high134 Ų13458 Ų5851%0.50629%0.291SS..Hα-helixtrans-59.3-45.9179-172.9-171.974.9-172.71.2112S804 L805 A812S804-R808 PolarHBondContact O-N 2.89Å; S804-R808 VanDerWaalsContact O-N 3.14Å; L805-R808 VanDerWaalsContact CD1-NH2 3.34Å; L805-R808 PolarHBondContact O-N 3.4Å; R808-A812 WeakPolarHBondContact O-CB 3.39Å; R808-A812 PolarHBondContact O-N 3.19Å; R808-A812 VanDerWaalsContact O-N 3.12Å
809E94.4Very high91Very high15 Ų1560.5 Ų60.57%0.0731%0.309CS..Hα-helixtrans-68.3-38.1-179.9-61-57139.100111.6Q770 Q774 L777 L805 L806 Q807 A812 V813Q770-E809 HydrophobicContact CG-CG 4.33Å; Q770-E809 PolarHBondContact NE2-OE1 2.86Å; Q774-E809 HydrophobicContact CG-CG 4.44Å; Q774-E809 VanDerWaalsContact CG-OE2 3.3Å; Q774-E809 WeakPolarHBondContact CG-OE2 3.29Å; Q774-E809 PolarHBondContact NE2-OE2 3.35Å; L777-E809 HydrophobicContact CD1-CB 3.79Å; L805-E809 HydrophobicContact CD1-CG 4.24Å; L805-E809 WeakPolarHBondContact O-CG 3.43Å; L805-E809 PolarHBondContact O-N 3.03Å; L806-E809 PolarHBondContact O-N 3.39Å; Q807-E809 PolarHBondContact O-N 3.32Å; E809-A812 PolarHBondContact O-N 3.18Å; E809-V813 WeakPolarHBondContact O-CG2 3.43Å; E809-V813 PolarHBondContact O-N 3.12Å
810A92.4Very high91Very high0 Ų063 Ų630%033%0.325CS..Hα-helixtrans-66.6-42.6176.900000112.4L777 L806 Q807 A812 V813 R814 L826 L827L777-A810 HydrophobicContact CD1-CB 4.31Å; L777-A810 HydrophobicContact CD2-CB 4.06Å; L806-A810 VanDerWaalsContact O-CB 3.25Å; L806-A810 WeakPolarHBondContact O-CB 3.44Å; L806-A810 PolarHBondContact O-N 2.92Å; Q807-A810 PolarHBondContact O-N 3.45Å; A810-A812 VanDerWaalsContact C-N 3.29Å; A810-A812 PolarHBondContact O-N 3.43Å; A810-V813 WeakPolarHBondContact O-CG2 3.42Å; A810-V813 PolarHBondContact O-N 3.15Å; A810-R814 PolarHBondContact O-N 3.47Å; A810-L826 HydrophobicContact CB-CD2 4.26Å; A810-L827 HydrophobicContact CB-CD2 3.95Å; A810-L827 HydrophobicContact CB-CG 4.37Å
811E93.2Very high91.3Very high99 Ų9963.2 Ų63.246%0.46332%0.318SS..Hα-helixtrans-60.8-38.5173.5-73.6169.9-177.200111.6Q807 V813 L827Q807-E811 HydrophobicContact CG-CG 4.47Å; Q807-E811 WeakPolarHBondContact CG-OE1 3.25Å; Q807-E811 PolarHBondContact NE2-OE1 2.73Å; Q807-E811 WeakPolarHBondContact O-CB 3.24Å; Q807-E811 WeakPolarHBondContact O-CG 3.34Å; Q807-E811 PolarHBondContact O-N 2.76Å; E811-V813 VanDerWaalsContact C-N 3.26Å; E811-V813 PolarHBondContact O-N 3.4Å; E811-L827 HydrophobicContact CG-CD1 4.17Å; E811-L827 HydrophobicContact CG-CD2 3.92Å
812A92.4Very high91.5Very high51 Ų5162.9 Ų62.942%0.42132%0.315SS..Hα-helixtrans-68.7-18.5-177.900000114.9R808 E809 A810 K816R808-A812 WeakPolarHBondContact O-CB 3.39Å; R808-A812 PolarHBondContact O-N 3.19Å; R808-A812 VanDerWaalsContact O-N 3.12Å; E809-A812 PolarHBondContact O-N 3.18Å; A810-A812 VanDerWaalsContact C-N 3.29Å; A810-A812 PolarHBondContact O-N 3.43Å; A812-K816 WeakPolarHBondContact O-CE 3.27Å; A812-K816 PolarHBondContact O-NZ 3.5Å
813V93.1Very high91.6Very high31 Ų3162.1 Ų62.119%0.18831%0.311CS..Hα-helixtrans-115-14-178.8-57.80000113.8L777 E809 A810 E811 D815 K816 H817L777-V813 HydrophobicContact CB-CG2 4.09Å; L777-V813 HydrophobicContact CD1-CG2 4.11Å; L777-V813 HydrophobicContact CD2-CG2 4.28Å; L777-V813 HydrophobicContact CG-CG2 4.39Å; E809-V813 WeakPolarHBondContact O-CG2 3.43Å; E809-V813 PolarHBondContact O-N 3.12Å; A810-V813 WeakPolarHBondContact O-CG2 3.42Å; A810-V813 PolarHBondContact O-N 3.15Å; E811-V813 VanDerWaalsContact C-N 3.26Å; E811-V813 PolarHBondContact O-N 3.4Å; V813-D815 VanDerWaalsContact C-N 3.34Å; V813-D815 PolarHBondContact O-N 2.91Å; V813-K816 WeakPolarHBondContact O-CA 3.39Å; V813-K816 WeakPolarHBondContact O-CB 3.3Å; V813-K816 PolarHBondContact O-N 3.13Å; V813-H817 WeakPolarHBondContact CG2-NE2 3.37Å; V813-H817 PolarHBondContact O-CD2 2.82Å; V813-H817 PolarHBondContact O-N 3.42Å
814R91.6Very high91.8Very high77 Ų7762.2 Ų62.229%0.29131%0.31SS..Hα-helixtrans-44.6-52.9-177.9-177.9-172.9-179.5-82.8-6.4113.9A810 K816 P820 C823 D824A810-R814 PolarHBondContact O-N 3.47Å; R814-K816 PolarHBondContact O-N 3.4Å; R814-P820 HydrophobicContact CG-CB 4.28Å; R814-C823 HydrophobicContact CB-CB 4.35Å; R814-C823 HydrophobicContact CG-CB 4.15Å; R814-D824 IonicContact CZ-OD1 2.89Å; R814-D824 VanDerWaalsContact CZ-OD1 3.23Å; R814-D824 IonicContact CZ-OD2 3.56Å; R814-D824 IonicContact NE-OD1 3.62Å; R814-D824 PolarHBondContact NE-OD1 3.4Å; R814-D824 IonicContact NH2-OD1 2.7Å; R814-D824 PolarHBondContact NH2-OD1 3.07Å; R814-D824 IonicContact NH2-OD2 3.26Å; R814-D824 PolarHBondContact NH2-OD2 3.46Å
815D90.9Very high92Very high131 Ų13162.3 Ų62.370%0.70130%0.304SS*.THydrogen-bonded Turntrans-83.5-1.9-176-57.2-32000112.9V813V813-D815 VanDerWaalsContact C-N 3.34Å; V813-D815 PolarHBondContact O-N 2.91Å
816K91Very high92.2Very high165 Ų16561.7 Ų61.772%0.71730%0.301SS*.THydrogen-bonded Turntrans-96.8-18.2177.1-58177.3-175.8151.50112.8A812 V813 R814A812-K816 WeakPolarHBondContact O-CE 3.27Å; A812-K816 PolarHBondContact O-NZ 3.5Å; V813-K816 WeakPolarHBondContact O-CA 3.39Å; V813-K816 WeakPolarHBondContact O-CB 3.3Å; V813-K816 PolarHBondContact O-N 3.13Å; R814-K816 PolarHBondContact O-N 3.4Å
817H92.3Very high92.1Very high29 Ų2963.1 Ų63.113%0.13431%0.309CS..SBendtrans-74.5155.6178-71.4-162.7000111.3L777 D781 V813 S819 C823L777-H817 PolarHBondContact O-CE1 3.44Å; L777-H817 PolarHBondContact O-NE2 3.33Å; D781-H817 HydrophobicContact CB-CB 4.1Å; D781-H817 VanDerWaalsContact OD2-CA 3.25Å; D781-H817 WeakPolarHBondContact OD2-CA 3.47Å; V813-H817 WeakPolarHBondContact CG2-NE2 3.37Å; V813-H817 PolarHBondContact O-CD2 2.82Å; V813-H817 PolarHBondContact O-N 3.42Å; H817-S819 PolarHBondContact O-N 2.94Å; H817-C823 PolarHBondContact CE1-SG 3.39Å; H817-C823 PolarHBondContact ND1-SG 3.36Å
818R89.4Confident92.1Very high157 Ų15765.8 Ų65.859%0.59232%0.321SS*.SBendtrans-60.9-30.3176.1-62.8171.3-61159.917.6112.5D781 D782D781-R818 VanDerWaalsContact O-CZ 3.22Å; D781-R818 PolarHBondContact O-NE 3.09Å; D781-R818 PolarHBondContact O-NH2 3.22Å; D781-R818 WeakPolarHBondContact OD1-CB 3.4Å; D781-R818 IonicContact OD1-CZ 3.95Å; D781-R818 PolarHBondContact OD1-N 3.1Å; D781-R818 IonicContact OD1-NE 3.32Å; D781-R818 PolarHBondContact OD1-NE 3.23Å; D781-R818 IonicContact OD1-NH2 3.23Å; D781-R818 PolarHBondContact OD1-NH2 3.02Å; D781-R818 WeakPolarHBondContact OD2-CG 3.33Å; D781-R818 PolarHBondContact OD2-N 3.13Å; D781-R818 IonicContact OD2-NE 2.74Å; D782-R818 PolarHBondContact O-NH2 3.4Å
819S88.9Confident92Very high53 Ų5362.1 Ų62.137%0.37131%0.31SS..  trans-140.9133.9173.1177.90000110.6H817 L821H817-S819 PolarHBondContact O-N 2.94Å; S819-L821 PolarHBondContact O-N 3.31Å; S819-L821 PolarHBondContact OG-N 3Å
820P90Very high91.8Very high54 Ų5461.4 Ų61.435%0.35131%0.307SS..SBendtrans-76.6-8.6177.831.7-35.4000113.5R814 H822 C823 D824R814-P820 HydrophobicContact CG-CB 4.28Å; P820-H822 PolarHBondContact O-N 3.24Å; P820-C823 PolarHBondContact O-N 3.32Å; P820-D824 PolarHBondContact O-N 2.9Å
821L92.1Very high91.5Very high100 Ų10064.5 Ų64.552%0.52433%0.328SS..Hα-helixtrans-52.9-53.9-169.4-179.167.4000113.8S819 C823 D824 L825S819-L821 PolarHBondContact O-N 3.31Å; S819-L821 PolarHBondContact OG-N 3Å; L821-C823 PolarHBondContact O-N 3.36Å; L821-D824 PolarHBondContact O-N 2.81Å; L821-L825 HydrophobicContact CG-CD1 4.38Å; L821-L825 WeakPolarHBondContact O-CG 3.35Å; L821-L825 PolarHBondContact O-N 3.33Å
822H92.7Very high91.1Very high21 Ų2162 Ų6210%0.09732%0.322CS..Hα-helixtrans-69.6-32.3-178-70.579.5000112.7L780 D789 P820 L825 L826L780-H822 HydrophobicContact CD1-CB 3.83Å; L780-H822 HydrophobicContact CD2-CB 4.1Å; L780-H822 HydrophobicContact CG-CB 3.79Å; D789-H822 IonicContact OD1-CD2 3.26Å; D789-H822 IonicContact OD1-NE2 3.96Å; D789-H822 PolarHBondContact OD1-NE2 3.26Å; P820-H822 PolarHBondContact O-N 3.24Å; H822-L825 PolarHBondContact O-N 3.22Å; H822-L826 WeakPolarHBondContact O-CB 3.25Å; H822-L826 PolarHBondContact O-N 3.33Å
823C91.9Very high90.5Very high0 Ų062.1 Ų62.10%032%0.315CS..Hα-helixtrans-66.6-41.8172-710000111.5R814 H817 P820 L821 L826 L827R814-C823 HydrophobicContact CB-CB 4.35Å; R814-C823 HydrophobicContact CG-CB 4.15Å; H817-C823 PolarHBondContact CE1-SG 3.39Å; H817-C823 PolarHBondContact ND1-SG 3.36Å; P820-C823 PolarHBondContact O-N 3.32Å; L821-C823 PolarHBondContact O-N 3.36Å; C823-L826 PolarHBondContact O-N 3.03Å; C823-L827 WeakPolarHBondContact O-CG 3.48Å; C823-L827 PolarHBondContact O-N 2.98Å
824D92.8Very high89.1Confident45 Ų4564.7 Ų64.724%0.24133%0.325CS..Hα-helixtrans-62.7-43176-73.9-24.6000111.2R814 P820 L821 L826 L827 Q828R814-D824 IonicContact CZ-OD1 2.89Å; R814-D824 VanDerWaalsContact CZ-OD1 3.23Å; R814-D824 IonicContact CZ-OD2 3.56Å; R814-D824 IonicContact NE-OD1 3.62Å; R814-D824 PolarHBondContact NE-OD1 3.4Å; R814-D824 IonicContact NH2-OD1 2.7Å; R814-D824 PolarHBondContact NH2-OD1 3.07Å; R814-D824 IonicContact NH2-OD2 3.26Å; R814-D824 PolarHBondContact NH2-OD2 3.46Å; P820-D824 PolarHBondContact O-N 2.9Å; L821-D824 PolarHBondContact O-N 2.81Å; D824-L826 VanDerWaalsContact C-N 3.32Å; D824-L826 PolarHBondContact O-N 2.9Å; D824-L827 PolarHBondContact O-N 3.5Å; D824-Q828 WeakPolarHBondContact O-CB 3.4Å; D824-Q828 WeakPolarHBondContact O-CG 3.48Å; D824-Q828 PolarHBondContact O-N 3.5Å
825L93.4Very high87.5Confident69 Ų6965.2 Ų65.236%0.36134%0.337SS..Hα-helixtrans-61.9-38.4174.6-70.4172.8000112.3L792 L821 H822 H829L792-L825 HydrophobicContact CD2-CB 4.13Å; L792-L825 HydrophobicContact CD2-CD1 4.16Å; L821-L825 HydrophobicContact CG-CD1 4.38Å; L821-L825 WeakPolarHBondContact O-CG 3.35Å; L821-L825 PolarHBondContact O-N 3.33Å; H822-L825 PolarHBondContact O-N 3.22Å; L825-H829 PolarHBondContact O-N 3.29Å; L825-H829 VanDerWaalsContact O-N 3.1Å
826L93.4Very high85.7Confident0 Ų068.1 Ų68.10%034%0.338CS..Hα-helixtrans-68-46.7176.1-17860.6000111.9L777 L780 L792 L795 K796 L806 A810 H822 C823 D824 Q828 H829 I830L777-L826 HydrophobicContact CD2-CD2 3.97Å; L780-L826 HydrophobicContact CD2-CD2 4.46Å; L792-L826 HydrophobicContact CD1-CB 3.76Å; L792-L826 HydrophobicContact CD1-CD1 4.3Å; L795-L826 HydrophobicContact CB-CD1 3.83Å; L795-L826 HydrophobicContact CB-CD2 3.88Å; L795-L826 HydrophobicContact CD1-CD2 3.88Å; L795-L826 HydrophobicContact CG-CD2 4.4Å; K796-L826 HydrophobicContact CG-CD1 4.06Å; L806-L826 HydrophobicContact CD1-CD2 4.33Å; L806-L826 HydrophobicContact CD2-CD1 4.37Å; A810-L826 HydrophobicContact CB-CD2 4.26Å; H822-L826 WeakPolarHBondContact O-CB 3.25Å; H822-L826 PolarHBondContact O-N 3.33Å; C823-L826 PolarHBondContact O-N 3.03Å; D824-L826 VanDerWaalsContact C-N 3.32Å; D824-L826 PolarHBondContact O-N 2.9Å; L826-Q828 VanDerWaalsContact C-N 3.34Å; L826-Q828 PolarHBondContact O-N 3.39Å; L826-H829 WeakPolarHBondContact O-CB 3.37Å; L826-H829 PolarHBondContact O-N 2.82Å; L826-H829 VanDerWaalsContact O-N 3.11Å; L826-I830 HydrophobicContact CD1-CD1 4.31Å; L826-I830 HydrophobicContact CG-CD1 4.01Å; L826-I830 WeakPolarHBondContact O-CG1 3.48Å; L826-I830 PolarHBondContact O-N 2.89Å
827L92.1Very high83.6Confident30 Ų3065.4 Ų65.416%0.15734%0.335CS..Hα-helixtrans-64.8-36.9178.2-69.1170.3000112.1Q807 A810 E811 C823 D824 H829 I830 S831Q807-L827 HydrophobicContact CG-CD2 3.92Å; A810-L827 HydrophobicContact CB-CD2 3.95Å; A810-L827 HydrophobicContact CB-CG 4.37Å; E811-L827 HydrophobicContact CG-CD1 4.17Å; E811-L827 HydrophobicContact CG-CD2 3.92Å; C823-L827 WeakPolarHBondContact O-CG 3.48Å; C823-L827 PolarHBondContact O-N 2.98Å; D824-L827 PolarHBondContact O-N 3.5Å; L827-H829 VanDerWaalsContact C-N 3.33Å; L827-I830 PolarHBondContact O-N 2.7Å; L827-S831 WeakPolarHBondContact O-CB 3.36Å; L827-S831 PolarHBondContact O-N 3.41Å; L827-S831 PolarHBondContact O-OG 3.14Å
828Q92.2Very high81.2Confident120 Ų12068 Ų6856%0.56136%0.356SS*.Hα-helixtrans-61.1-41.1170.6-76.1174.71200111.7D824 L826 S831 S832D824-Q828 WeakPolarHBondContact O-CB 3.4Å; D824-Q828 WeakPolarHBondContact O-CG 3.48Å; D824-Q828 PolarHBondContact O-N 3.5Å; L826-Q828 VanDerWaalsContact C-N 3.34Å; L826-Q828 PolarHBondContact O-N 3.39Å; Q828-S831 WeakPolarHBondContact CA-OG 3.48Å; Q828-S831 PolarHBondContact O-OG 2.95Å; Q828-S832 WeakPolarHBondContact O-CB 3.42Å; Q828-S832 PolarHBondContact O-N 3.24Å; Q828-S832 VanDerWaalsContact O-N 3.1Å
829H91.8Very high78.9Confident58 Ų5868.4 Ų68.427%0.26937%0.365SS..Hα-helixtrans-64-47.3175-17675.9000111.9K796 L825 L826 L827 S831 S832 L833K796-H829 HydrophobicContact CG-CB 4.16Å; L825-H829 PolarHBondContact O-N 3.29Å; L825-H829 VanDerWaalsContact O-N 3.1Å; L826-H829 WeakPolarHBondContact O-CB 3.37Å; L826-H829 PolarHBondContact O-N 2.82Å; L826-H829 VanDerWaalsContact O-N 3.11Å; L827-H829 VanDerWaalsContact C-N 3.33Å; H829-S831 PolarHBondContact O-N 3.26Å; H829-S832 WeakPolarHBondContact O-CB 3.39Å; H829-S832 PolarHBondContact O-N 3.32Å; H829-S832 VanDerWaalsContact O-N 3.13Å; H829-S832 PolarHBondContact O-OG 2.93Å; H829-L833 PolarHBondContact O-N 3.31Å
830I90.4Very high76.2Confident0 Ų077.4 Ų77.40%040%0.401CS..Hα-helixtrans-61.8-42.9-179.4-63.1164.4000111.5P803 L806 Q807 L826 L827 S832 L833 H834P803-I830 HydrophobicContact CB-CG2 4.29Å; L806-I830 HydrophobicContact CB-CD1 4.45Å; L806-I830 HydrophobicContact CD2-CD1 4.06Å; L806-I830 HydrophobicContact CG-CD1 3.91Å; Q807-I830 HydrophobicContact CB-CD1 4.42Å; Q807-I830 HydrophobicContact CB-CG2 4.2Å; L826-I830 HydrophobicContact CD1-CD1 4.31Å; L826-I830 HydrophobicContact CG-CD1 4.01Å; L826-I830 WeakPolarHBondContact O-CG1 3.48Å; L826-I830 PolarHBondContact O-N 2.89Å; L827-I830 PolarHBondContact O-N 2.7Å; I830-S832 VanDerWaalsContact C-N 3.31Å; I830-S832 PolarHBondContact O-N 3.12Å; I830-L833 PolarHBondContact O-N 3.44Å; I830-H834 PolarHBondContact O-N 3.45Å; I830-H834 PolarHBondContact O-ND1 2.89Å
831S86.6Confident75.5Confident65 Ų6578.6 Ų78.646%0.45540%0.403SS..Hα-helixtrans-65.7-31.717654.90000113L827 Q828 H829 L833 H834 T835L827-S831 WeakPolarHBondContact O-CB 3.36Å; L827-S831 PolarHBondContact O-N 3.41Å; L827-S831 PolarHBondContact O-OG 3.14Å; Q828-S831 WeakPolarHBondContact CA-OG 3.48Å; Q828-S831 PolarHBondContact O-OG 2.95Å; H829-S831 PolarHBondContact O-N 3.26Å; S831-L833 VanDerWaalsContact C-N 3.3Å; S831-L833 PolarHBondContact O-N 3.22Å; S831-H834 PolarHBondContact O-N 3.4Å; S831-T835 PolarHBondContact O-N 2.83Å; S831-T835 PolarHBondContact O-OG1 3.19Å
832S84.4Confident74.6Confident47 Ų4777.5 Ų77.533%0.32940%0.397SS..Hα-helixtrans-69.4-23.1174.181.10000114.1Q828 H829 I830 T835Q828-S832 WeakPolarHBondContact O-CB 3.42Å; Q828-S832 PolarHBondContact O-N 3.24Å; Q828-S832 VanDerWaalsContact O-N 3.1Å; H829-S832 WeakPolarHBondContact O-CB 3.39Å; H829-S832 PolarHBondContact O-N 3.32Å; H829-S832 VanDerWaalsContact O-N 3.13Å; H829-S832 PolarHBondContact O-OG 2.93Å; I830-S832 VanDerWaalsContact C-N 3.31Å; I830-S832 PolarHBondContact O-N 3.12Å; S832-T835 WeakPolarHBondContact CA-OG1 3.33Å; S832-T835 PolarHBondContact O-OG1 3.43Å
833L79.4Confident73.6Confident53 Ų5380.6 Ų80.628%0.27741%0.413SS..Hα-helixtrans-76-39.1175-69.9168.9000111.8S799 H829 I830 S831 T835 R836 T837S799-L833 WeakPolarHBondContact OG-CD1 3.3Å; H829-L833 PolarHBondContact O-N 3.31Å; I830-L833 PolarHBondContact O-N 3.44Å; S831-L833 VanDerWaalsContact C-N 3.3Å; S831-L833 PolarHBondContact O-N 3.22Å; L833-T835 VanDerWaalsContact C-N 3.28Å; L833-T835 PolarHBondContact O-N 3Å; L833-R836 PolarHBondContact O-N 3.37Å; L833-T837 PolarHBondContact O-N 2.77Å; L833-T837 PolarHBondContact O-OG1 2.96Å
834H64.2Low72.5Confident84 Ų8485.4 Ų85.439%0.38944%0.438SS..Hα-helixtrans-65.9-27.6177-69.787.5000113.4I830 S831 T837 S838I830-H834 PolarHBondContact O-N 3.45Å; I830-H834 PolarHBondContact O-ND1 2.89Å; S831-H834 PolarHBondContact O-N 3.4Å; H834-T837 PolarHBondContact O-OG1 3.2Å; H834-S838 PolarHBondContact O-OG 2.87Å
835T58Low71.3Confident89 Ų8987.9 Ų87.955%0.54645%0.45SS..THydrogen-bonded Turntrans-80.1-16.2175.536.20000113.4S831 S832 L833 S838S831-T835 PolarHBondContact O-N 2.83Å; S831-T835 PolarHBondContact O-OG1 3.19Å; S832-T835 WeakPolarHBondContact CA-OG1 3.33Å; S832-T835 PolarHBondContact O-OG1 3.43Å; L833-T835 VanDerWaalsContact C-N 3.28Å; L833-T835 PolarHBondContact O-N 3Å; T835-S838 PolarHBondContact O-OG 3.03Å
836R52.8Low69.8Low191 Ų19189.1 Ų89.172%0.72146%0.456SS*.THydrogen-bonded Turntrans-90.9-30.8175.5-77.2-179.8174178.7-0.5113.6L833 S838L833-R836 PolarHBondContact O-N 3.37Å; R836-S838 VanDerWaalsContact C-N 3.28Å; R836-S838 PolarHBondContact O-N 3.27Å
837T47.4Very low68.1Low108 Ų10895.5 Ų95.566%0.66349%0.489SS*.G310 helixtrans-75.5-13.9176.142.10000113.8L833 H834 H839L833-T837 PolarHBondContact O-N 2.77Å; L833-T837 PolarHBondContact O-OG1 2.96Å; H834-T837 PolarHBondContact O-OG1 3.2Å; T837-H839 VanDerWaalsContact C-N 3.31Å; T837-H839 PolarHBondContact O-N 2.87Å
838S42Very low66.2Low83 Ų83100.5 Ų100.558%0.5851%0.514SS*.G310 helixtrans-83.81.3177.133.80000114.5H834 T835 R836H834-S838 PolarHBondContact O-OG 2.87Å; T835-S838 PolarHBondContact O-OG 3.03Å; R836-S838 VanDerWaalsContact C-N 3.28Å; R836-S838 PolarHBondContact O-N 3.27Å
839H40.3Very low64.1Low166 Ų16698.9 Ų98.977%0.76951%0.51SS*.G310 helixtrans-119.117178.7-85.2-58.1000115T837T837-H839 VanDerWaalsContact C-N 3.31Å; T837-H839 PolarHBondContact O-N 2.87Å
840H31.6Very low61.6Low243 Ų243102.6 Ų102.6100%1.12553%0.532SS*.  trans-122.60168.7-93-54.8000112.6

Retrieved 840 of 840 residues in 1958.7 ms (Link to these results)

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