A0A087XM79_POEFO Loading...

Limb development membrane protein 1-like

AlphaFold DB , UniProt , Accession A0A087XM79, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 497 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
1M58.4Low71.7Confident168 Ų168116.9 Ų116.983%0.82858%0.58SS**  0-68.30-143.3169.2168.600111T3 D4 E5M1-T3 PolarHBondContact O-N 2.81Å; M1-D4 WeakPolarHBondContact CA-OD2 3.39Å; M1-D4 PolarHBondContact N-OD2 3.28Å; M1-D4 PolarHBondContact O-N 2.69Å; M1-E5 WeakPolarHBondContact O-CG 3.41Å; M1-E5 PolarHBondContact O-N 3.31Å; M1-E5 VanDerWaalsContact O-N 3.08Å
2E59.5Low72.6Confident164 Ų164115.7 Ų115.777%0.76658%0.576SS**Hα-helixtrans-62.2-38.1175.4-70.4-176.9161.700113.7D4 E5 V6E2-D4 VanDerWaalsContact C-N 3.33Å; E2-D4 PolarHBondContact O-N 2.78Å; E2-E5 PolarHBondContact O-N 2.97Å; E2-V6 WeakPolarHBondContact O-CG2 3.46Å; E2-V6 PolarHBondContact O-N 2.94Å; E2-V6 VanDerWaalsContact O-N 3.12Å
3T61.5Low73.6Confident109 Ų109117 Ų11767%0.66958%0.576SS**Hα-helixtrans-66.2-33.7176.248.90000113.2M1 S7M1-T3 PolarHBondContact O-N 2.81Å; T3-S7 PolarHBondContact O-N 3.02Å
4D65.6Low74.2Confident93 Ų93117.1 Ų117.150%0.49758%0.575SS.*Hα-helixtrans-73.8-39.7178.7-53.5-52000110.1M1 E2 V6 S7 I8M1-D4 WeakPolarHBondContact CA-OD2 3.39Å; M1-D4 PolarHBondContact N-OD2 3.28Å; M1-D4 PolarHBondContact O-N 2.69Å; E2-D4 VanDerWaalsContact C-N 3.33Å; E2-D4 PolarHBondContact O-N 2.78Å; D4-V6 PolarHBondContact O-N 3.19Å; D4-S7 PolarHBondContact O-N 3.4Å; D4-S7 PolarHBondContact O-OG 3.08Å; D4-I8 WeakPolarHBondContact O-CD1 3.44Å; D4-I8 VanDerWaalsContact O-CG1 3.26Å; D4-I8 WeakPolarHBondContact O-CG1 3.49Å; D4-I8 PolarHBondContact O-N 3.11Å
5E69.4Low74.7Confident111 Ų111112.9 Ų112.952%0.51956%0.555SS.*Hα-helixtrans-63.7-39.4175.4-72.2-178.6-171.500113.3M1 E2 I8 R9M1-E5 WeakPolarHBondContact O-CG 3.41Å; M1-E5 PolarHBondContact O-N 3.31Å; M1-E5 VanDerWaalsContact O-N 3.08Å; E2-E5 PolarHBondContact O-N 2.97Å; E5-I8 PolarHBondContact O-N 3.49Å; E5-R9 WeakPolarHBondContact O-CB 3.31Å; E5-R9 PolarHBondContact O-N 2.71Å
6V69Low75.2Confident79 Ų79115.9 Ų115.948%0.47956%0.558SS.*Hα-helixtrans-64.6-43.8174.7176.60000110.3E2 D4 I8 R9 E10E2-V6 WeakPolarHBondContact O-CG2 3.46Å; E2-V6 PolarHBondContact O-N 2.94Å; E2-V6 VanDerWaalsContact O-N 3.12Å; D4-V6 PolarHBondContact O-N 3.19Å; V6-I8 PolarHBondContact O-N 3.24Å; V6-R9 PolarHBondContact O-N 3.21Å; V6-E10 WeakPolarHBondContact O-CG 3.45Å; V6-E10 PolarHBondContact O-N 3.2Å
7S78.6Confident75.9Confident50 Ų50112.4 Ų112.435%0.3555%0.546SS..Hα-helixtrans-64.1-37.7178.275.40000113.5T3 D4 E10 Q11T3-S7 PolarHBondContact O-N 3.02Å; D4-S7 PolarHBondContact O-N 3.4Å; D4-S7 PolarHBondContact O-OG 3.08Å; S7-E10 PolarHBondContact O-N 3.31Å; S7-Q11 WeakPolarHBondContact O-CG 3.34Å; S7-Q11 PolarHBondContact O-N 2.89Å
8I82.1Confident76.3Confident92 Ų92108.2 Ų108.247%0.47252%0.523SS..Hα-helixtrans-66.6-42.1175.8-68.2163.5000110.3D4 E5 V6 Q11 L12D4-I8 WeakPolarHBondContact O-CD1 3.44Å; D4-I8 VanDerWaalsContact O-CG1 3.26Å; D4-I8 WeakPolarHBondContact O-CG1 3.49Å; D4-I8 PolarHBondContact O-N 3.11Å; E5-I8 PolarHBondContact O-N 3.49Å; V6-I8 PolarHBondContact O-N 3.24Å; I8-Q11 PolarHBondContact O-N 2.93Å; I8-L12 HydrophobicContact CG2-CD1 4.08Å; I8-L12 WeakPolarHBondContact O-CG 3.42Å; I8-L12 PolarHBondContact O-N 2.97Å
9R82.8Confident76.8Confident185 Ų185103.4 Ų103.470%0.69850%0.5SS*.Hα-helixtrans-62.6-43.4177.6-174.8-176.6-62.7-1551111.8E5 V6 L12 F13E5-R9 WeakPolarHBondContact O-CB 3.31Å; E5-R9 PolarHBondContact O-N 2.71Å; V6-R9 PolarHBondContact O-N 3.21Å; R9-L12 PolarHBondContact O-N 2.76Å; R9-F13 WeakPolarHBondContact O-CB 3.23Å; R9-F13 PolarHBondContact O-N 3.08Å
10E82.4Confident77.3Confident111 Ų111102.6 Ų102.652%0.51950%0.501SS..Hα-helixtrans-62.8-44.1176.3-73.3176.5178.600111.5V6 S7 L12 F13 H14V6-E10 WeakPolarHBondContact O-CG 3.45Å; V6-E10 PolarHBondContact O-N 3.2Å; S7-E10 PolarHBondContact O-N 3.31Å; E10-L12 PolarHBondContact O-N 2.84Å; E10-F13 PolarHBondContact O-N 3.26Å; E10-H14 PolarHBondContact O-CD2 3.49Å; E10-H14 PolarHBondContact O-N 2.69Å
11Q79.8Confident77.8Confident124 Ų124102.4 Ų102.458%0.57950%0.502SS*.Hα-helixtrans-61.1-43.8175.1-76.8-179.5-5.400112.4S7 I8 H14 N15S7-Q11 WeakPolarHBondContact O-CG 3.34Å; S7-Q11 PolarHBondContact O-N 2.89Å; I8-Q11 PolarHBondContact O-N 2.93Å; Q11-H14 PolarHBondContact O-N 3.04Å; Q11-N15 WeakPolarHBondContact O-CB 3.47Å; Q11-N15 PolarHBondContact O-N 3.01Å; Q11-N15 PolarHBondContact O-ND2 2.93Å; Q11-N15 VanDerWaalsContact O-ND2 3.15Å
12L82.8Confident79.2Confident102 Ų10297.3 Ų97.353%0.53448%0.477SS..Hα-helixtrans-62.5-43.2175.7-74.3171.3000111.6I8 R9 E10 N15 R16I8-L12 HydrophobicContact CG2-CD1 4.08Å; I8-L12 WeakPolarHBondContact O-CG 3.42Å; I8-L12 PolarHBondContact O-N 2.97Å; R9-L12 PolarHBondContact O-N 2.76Å; E10-L12 PolarHBondContact O-N 2.84Å; L12-N15 PolarHBondContact O-N 3.35Å; L12-R16 VanDerWaalsContact O-CG 3.3Å; L12-R16 WeakPolarHBondContact O-CG 3.5Å; L12-R16 PolarHBondContact O-N 3.39Å
13F85Confident80.5Confident133 Ų13390.1 Ų90.158%0.58345%0.445SS*.Hα-helixtrans-59.8-50.4176.3176.2-100.1000111.5R9 E10 N15 R16 V17R9-F13 WeakPolarHBondContact O-CB 3.23Å; R9-F13 PolarHBondContact O-N 3.08Å; E10-F13 PolarHBondContact O-N 3.26Å; F13-N15 VanDerWaalsContact C-N 3.31Å; F13-N15 PolarHBondContact O-N 3.3Å; F13-R16 PolarHBondContact O-N 3.25Å; F13-V17 HydrophobicContact CD1-CG2 4.27Å; F13-V17 HydrophobicContact CD2-CG2 4.35Å; F13-V17 HydrophobicContact CE1-CG2 3.86Å; F13-V17 HydrophobicContact CE2-CG2 3.94Å; F13-V17 HydrophobicContact CZ-CG2 3.68Å; F13-V17 WeakPolarHBondContact O-CG2 3.36Å; F13-V17 PolarHBondContact O-N 3.32Å
14H82.6Confident81.9Confident119 Ų11989 Ų8955%0.55144%0.437SS*.Hα-helixtrans-61.6-38.8177.7-72.6-56.6000112.6E10 Q11 R18E10-H14 PolarHBondContact O-CD2 3.49Å; E10-H14 PolarHBondContact O-N 2.69Å; Q11-H14 PolarHBondContact O-N 3.04Å; H14-R18 VanDerWaalsContact O-CB 3.3Å; H14-R18 WeakPolarHBondContact O-CB 3.46Å; H14-R18 PolarHBondContact O-N 3.18Å
15N80.6Confident83.1Confident53 Ų5390.1 Ų90.128%0.28344%0.443SS..Hα-helixtrans-62.5-44.8174.6-75.3-30.5000111.7Q11 L12 F13 R18 E19Q11-N15 WeakPolarHBondContact O-CB 3.47Å; Q11-N15 PolarHBondContact O-N 3.01Å; Q11-N15 PolarHBondContact O-ND2 2.93Å; Q11-N15 VanDerWaalsContact O-ND2 3.15Å; L12-N15 PolarHBondContact O-N 3.35Å; F13-N15 VanDerWaalsContact C-N 3.31Å; F13-N15 PolarHBondContact O-N 3.3Å; N15-R18 PolarHBondContact O-N 3.3Å; N15-R18 PolarHBondContact OD1-NH1 3.14Å; N15-R18 PolarHBondContact OD1-NH2 3.29Å; N15-E19 WeakPolarHBondContact O-CB 3.35Å; N15-E19 VanDerWaalsContact O-CG 3.24Å; N15-E19 WeakPolarHBondContact O-CG 3.45Å; N15-E19 PolarHBondContact O-N 2.88Å
16R83.3Confident84.1Confident161 Ų16187.1 Ų87.161%0.60843%0.43SS*.Hα-helixtrans-65.8-42.7177.9-71.3-60.9-168.8174.65.1112.9L12 F13 E19 T20L12-R16 VanDerWaalsContact O-CG 3.3Å; L12-R16 WeakPolarHBondContact O-CG 3.5Å; L12-R16 PolarHBondContact O-N 3.39Å; F13-R16 PolarHBondContact O-N 3.25Å; R16-E19 IonicContact NH1-OE2 3.27Å; R16-E19 PolarHBondContact O-N 2.71Å; R16-T20 WeakPolarHBondContact O-CB 3.44Å; R16-T20 PolarHBondContact O-N 2.99Å; R16-T20 PolarHBondContact O-OG1 2.97Å
17V86.6Confident85.2Confident57 Ų5785 Ų8535%0.34542%0.416SS..Hα-helixtrans-61.5-46.9176.1171.50000110F13 T20 I21F13-V17 HydrophobicContact CD1-CG2 4.27Å; F13-V17 HydrophobicContact CD2-CG2 4.35Å; F13-V17 HydrophobicContact CE1-CG2 3.86Å; F13-V17 HydrophobicContact CE2-CG2 3.94Å; F13-V17 HydrophobicContact CZ-CG2 3.68Å; F13-V17 WeakPolarHBondContact O-CG2 3.36Å; F13-V17 PolarHBondContact O-N 3.32Å; V17-T20 PolarHBondContact O-N 3.4Å; V17-I21 HydrophobicContact CG1-CD1 3.68Å; V17-I21 HydrophobicContact CG1-CG1 4.4Å; V17-I21 VanDerWaalsContact O-CG1 3.24Å; V17-I21 WeakPolarHBondContact O-CG1 3.3Å; V17-I21 PolarHBondContact O-N 2.96Å
18R84.6Confident85.9Confident37 Ų3786.1 Ų86.114%0.1442%0.421CS..Hα-helixtrans-57.3-51.5175.6179.2-168.866.1-140-9.3111.7H14 N15 T20 I21 I22 W101H14-R18 VanDerWaalsContact O-CB 3.3Å; H14-R18 WeakPolarHBondContact O-CB 3.46Å; H14-R18 PolarHBondContact O-N 3.18Å; N15-R18 PolarHBondContact O-N 3.3Å; N15-R18 PolarHBondContact OD1-NH1 3.14Å; N15-R18 PolarHBondContact OD1-NH2 3.29Å; R18-T20 VanDerWaalsContact C-N 3.27Å; R18-T20 PolarHBondContact O-N 3.17Å; R18-I21 PolarHBondContact O-N 2.86Å; R18-I22 HydrophobicContact CG-CD1 3.93Å; R18-I22 WeakPolarHBondContact O-CG1 3.28Å; R18-I22 PolarHBondContact O-N 2.86Å; R18-W101 HydrophobicContact CG-CE3 3.97Å; R18-W101 HydrophobicContact CG-CZ3 4.14Å
19E84.6Confident86.5Confident17 Ų1785.3 Ų85.38%0.07942%0.423CS..Hα-helixtrans-56.3-44.7179.6-74.8169.9-174.500111.4N15 R16 I22 C23 S105 L106N15-E19 WeakPolarHBondContact O-CB 3.35Å; N15-E19 VanDerWaalsContact O-CG 3.24Å; N15-E19 WeakPolarHBondContact O-CG 3.45Å; N15-E19 PolarHBondContact O-N 2.88Å; R16-E19 IonicContact NH1-OE2 3.27Å; R16-E19 PolarHBondContact O-N 2.71Å; E19-I22 PolarHBondContact O-N 3.49Å; E19-C23 WeakPolarHBondContact O-CB 3.29Å; E19-C23 PolarHBondContact O-N 2.73Å; E19-C23 PolarHBondContact O-SG 2.81Å; E19-S105 WeakPolarHBondContact OE1-CB 3.41Å; E19-S105 PolarHBondContact OE1-OG 3.18Å; E19-L106 HydrophobicContact CB-CD1 3.91Å; E19-L106 HydrophobicContact CG-CB 4.16Å; E19-L106 HydrophobicContact CG-CD1 3.74Å
20T86.2Confident87.1Confident86 Ų8677.7 Ų77.753%0.52840%0.396SS..Hα-helixtrans-64.2-45179-53.40000111.5R16 V17 R18 I22 C23 V24R16-T20 WeakPolarHBondContact O-CB 3.44Å; R16-T20 PolarHBondContact O-N 2.99Å; R16-T20 PolarHBondContact O-OG1 2.97Å; V17-T20 PolarHBondContact O-N 3.4Å; R18-T20 VanDerWaalsContact C-N 3.27Å; R18-T20 PolarHBondContact O-N 3.17Å; T20-I22 PolarHBondContact O-N 3.47Å; T20-C23 PolarHBondContact O-N 3.49Å; T20-V24 HydrophobicContact CG2-CG2 4.29Å; T20-V24 WeakPolarHBondContact O-CB 3.27Å; T20-V24 VanDerWaalsContact O-CG2 3.28Å; T20-V24 WeakPolarHBondContact O-CG2 3.35Å; T20-V24 PolarHBondContact O-N 3.22Å
21I89.2Confident87.7Confident100 Ų10075.4 Ų75.451%0.51338%0.383SS..Hα-helixtrans-59.1-48178.4-70165.7000110.5V17 R18 C23 V24 L25V17-I21 HydrophobicContact CG1-CD1 3.68Å; V17-I21 HydrophobicContact CG1-CG1 4.4Å; V17-I21 VanDerWaalsContact O-CG1 3.24Å; V17-I21 WeakPolarHBondContact O-CG1 3.3Å; V17-I21 PolarHBondContact O-N 2.96Å; R18-I21 PolarHBondContact O-N 2.86Å; I21-C23 PolarHBondContact O-N 3.24Å; I21-V24 PolarHBondContact O-N 3.48Å; I21-L25 WeakPolarHBondContact O-CB 3.3Å; I21-L25 PolarHBondContact O-N 3.33Å
22I88.1Confident88.5Confident60 Ų6074.8 Ų74.831%0.30838%0.381SS..Hα-helixtrans-62.2-45.5-179.9-65.5169.3000110.6R18 E19 T20 V24 L25 L26 L106R18-I22 HydrophobicContact CG-CD1 3.93Å; R18-I22 WeakPolarHBondContact O-CG1 3.28Å; R18-I22 PolarHBondContact O-N 2.86Å; E19-I22 PolarHBondContact O-N 3.49Å; T20-I22 PolarHBondContact O-N 3.47Å; I22-V24 PolarHBondContact O-N 3.08Å; I22-L25 PolarHBondContact O-N 3.13Å; I22-L26 WeakPolarHBondContact O-CB 3.09Å; I22-L26 PolarHBondContact O-N 3.2Å; I22-L106 HydrophobicContact CB-CD1 4.3Å; I22-L106 HydrophobicContact CD1-CD1 4.36Å; I22-L106 HydrophobicContact CD1-CD2 4.14Å; I22-L106 HydrophobicContact CG2-CD1 4.34Å; I22-L106 HydrophobicContact CG2-CD2 4.4Å
23C86.4Confident89.1Confident13 Ų1373.7 Ų73.79%0.08838%0.378CS..Hα-helixtrans-62.9-43.4179.4-67.40000112.1E19 T20 I21 L26 L27 L113E19-C23 WeakPolarHBondContact O-CB 3.29Å; E19-C23 PolarHBondContact O-N 2.73Å; E19-C23 PolarHBondContact O-SG 2.81Å; T20-C23 PolarHBondContact O-N 3.49Å; I21-C23 PolarHBondContact O-N 3.24Å; C23-L26 PolarHBondContact O-N 2.99Å; C23-L27 VanDerWaalsContact O-CB 3.31Å; C23-L27 WeakPolarHBondContact O-CB 3.4Å; C23-L27 PolarHBondContact O-N 3.36Å; C23-L113 HydrophobicContact CB-CD1 4.29Å
24V90.1Very high89.6Confident85 Ų8567.5 Ų67.552%0.51535%0.352SS..Hα-helixtrans-65-42.2177.7170.70000111T20 I21 I22 L27 T28T20-V24 HydrophobicContact CG2-CG2 4.29Å; T20-V24 WeakPolarHBondContact O-CB 3.27Å; T20-V24 VanDerWaalsContact O-CG2 3.28Å; T20-V24 WeakPolarHBondContact O-CG2 3.35Å; T20-V24 PolarHBondContact O-N 3.22Å; I21-V24 PolarHBondContact O-N 3.48Å; I22-V24 PolarHBondContact O-N 3.08Å; V24-L27 PolarHBondContact O-N 3.36Å; V24-T28 HydrophobicContact CG1-CG2 4.19Å; V24-T28 WeakPolarHBondContact O-CB 3.38Å; V24-T28 WeakPolarHBondContact O-CG2 3.27Å; V24-T28 PolarHBondContact O-N 3.01Å; V24-T28 PolarHBondContact O-OG1 3.06Å
25L92Very high90.1Very high117 Ų11765.8 Ų65.861%0.61334%0.341SS*.Hα-helixtrans-65.6-41179-147.9160.8000111.3I21 I22 T28 C29I21-L25 WeakPolarHBondContact O-CB 3.3Å; I21-L25 PolarHBondContact O-N 3.33Å; I22-L25 PolarHBondContact O-N 3.13Å; L25-T28 WeakPolarHBondContact CA-OG1 3.43Å; L25-T28 PolarHBondContact O-OG1 3.19Å; L25-C29 WeakPolarHBondContact O-CB 3.38Å; L25-C29 PolarHBondContact O-N 3.14Å; L25-C29 VanDerWaalsContact O-N 3.09Å
26L90.7Very high90.7Very high49 Ų4968.5 Ų68.526%0.25736%0.355SS..Hα-helixtrans-63.6-48.2174.3-178.3143.9000111.6I22 C23 T28 C29 L30I22-L26 WeakPolarHBondContact O-CB 3.09Å; I22-L26 PolarHBondContact O-N 3.2Å; C23-L26 PolarHBondContact O-N 2.99Å; L26-T28 PolarHBondContact O-N 3.21Å; L26-C29 PolarHBondContact O-N 3.36Å; L26-L30 HydrophobicContact CD2-CD1 3.62Å; L26-L30 HydrophobicContact CD2-CG 4.48Å; L26-L30 HydrophobicContact CG-CD1 4.34Å; L26-L30 WeakPolarHBondContact O-CG 3.26Å; L26-L30 PolarHBondContact O-N 3.15Å
27L91.4Very high91.2Very high35 Ų3564 Ų6418%0.18335%0.345CS..Hα-helixtrans-65.8-39.4-178.5-173.967.2000112.2C23 V24 L30 Y31 F68 F117C23-L27 VanDerWaalsContact O-CB 3.31Å; C23-L27 WeakPolarHBondContact O-CB 3.4Å; C23-L27 PolarHBondContact O-N 3.36Å; V24-L27 PolarHBondContact O-N 3.36Å; L27-L30 PolarHBondContact O-N 3.03Å; L27-Y31 VanDerWaalsContact O-CB 3.24Å; L27-Y31 WeakPolarHBondContact O-CB 3.46Å; L27-Y31 PolarHBondContact O-N 2.88Å; L27-F68 HydrophobicContact CD2-CE2 4.35Å; L27-F117 HydrophobicContact CD2-CE2 4.15Å
28T93.9Very high91.4Very high73 Ų7361.9 Ų61.945%0.44833%0.332SS..Hα-helixtrans-66.2-42.317748.80000111.8V24 L25 L26 Y31 M32V24-T28 HydrophobicContact CG1-CG2 4.19Å; V24-T28 WeakPolarHBondContact O-CB 3.38Å; V24-T28 WeakPolarHBondContact O-CG2 3.27Å; V24-T28 PolarHBondContact O-N 3.01Å; V24-T28 PolarHBondContact O-OG1 3.06Å; L25-T28 WeakPolarHBondContact CA-OG1 3.43Å; L25-T28 PolarHBondContact O-OG1 3.19Å; L26-T28 PolarHBondContact O-N 3.21Å; T28-Y31 PolarHBondContact O-N 3.39Å; T28-M32 WeakPolarHBondContact O-CG 3.39Å; T28-M32 PolarHBondContact O-N 3.21Å
29C94.8Very high91.6Very high75 Ų7562.8 Ų62.851%0.50734%0.342SS..Hα-helixtrans-59.4-49.8174.1-176.90000111.3L25 L26 Y31 M32 V33L25-C29 WeakPolarHBondContact O-CB 3.38Å; L25-C29 PolarHBondContact O-N 3.14Å; L25-C29 VanDerWaalsContact O-N 3.09Å; L26-C29 PolarHBondContact O-N 3.36Å; C29-Y31 VanDerWaalsContact C-N 3.31Å; C29-Y31 PolarHBondContact O-N 3.19Å; C29-M32 PolarHBondContact O-N 3Å; C29-V33 WeakPolarHBondContact O-CG2 3.41Å; C29-V33 PolarHBondContact O-N 3.47Å; C29-V33 VanDerWaalsContact O-N 3.09Å
30L94.3Very high91.8Very high24 Ų2466.7 Ų66.713%0.12636%0.36CS..Hα-helixtrans-62-38.6177.2-71.5177.6000112.3L26 L27 V33 C34 S71 V74 C75 L78L26-L30 HydrophobicContact CD2-CD1 3.62Å; L26-L30 HydrophobicContact CD2-CG 4.48Å; L26-L30 HydrophobicContact CG-CD1 4.34Å; L26-L30 WeakPolarHBondContact O-CG 3.26Å; L26-L30 PolarHBondContact O-N 3.15Å; L27-L30 PolarHBondContact O-N 3.03Å; L30-V33 PolarHBondContact O-N 3.38Å; L30-C34 WeakPolarHBondContact O-CB 3.44Å; L30-C34 PolarHBondContact O-N 3.28Å; L30-C34 PolarHBondContact O-SG 3.45Å; L30-S71 VanDerWaalsContact CB-OG 3.25Å; L30-S71 WeakPolarHBondContact CB-OG 3.28Å; L30-V74 HydrophobicContact CD2-CG1 3.87Å; L30-C75 HydrophobicContact CD1-CB 3.79Å; L30-L78 HydrophobicContact CD2-CD1 4.19Å
31Y95.6Very high91.7Very high63 Ų6365.5 Ų65.525%0.24735%0.347CS..Hα-helixtrans-61.2-45.1176.5-176-88.5000111.6L27 T28 C29 V33 C34 Y35 T67 F68 S71L27-Y31 VanDerWaalsContact O-CB 3.24Å; L27-Y31 WeakPolarHBondContact O-CB 3.46Å; L27-Y31 PolarHBondContact O-N 2.88Å; T28-Y31 PolarHBondContact O-N 3.39Å; C29-Y31 VanDerWaalsContact C-N 3.31Å; C29-Y31 PolarHBondContact O-N 3.19Å; Y31-V33 PolarHBondContact O-N 3.01Å; Y31-C34 PolarHBondContact O-N 3.49Å; Y31-Y35 VanDerWaalsContact O-CB 3.31Å; Y31-Y35 WeakPolarHBondContact O-CB 3.37Å; Y31-Y35 PolarHBondContact O-N 3.27Å; Y31-T67 VanDerWaalsContact CE2-OG1 3.27Å; Y31-T67 WeakPolarHBondContact CE2-OG1 3.34Å; Y31-T67 VanDerWaalsContact CZ-OG1 3.28Å; Y31-T67 PolarHBondContact OH-OG1 3.14Å; Y31-F68 HydrophobicContact CD2-CB 4.47Å; Y31-F68 HydrophobicContact CE2-CB 4.12Å; Y31-S71 PolarHBondContact N-OG 3.41Å
32M95.4Very high91.5Very high111 Ų11162.2 Ų62.255%0.54733%0.329SS..Hα-helixtrans-62.2-44.3176.9-69.6-57.8-65.600111.8T28 C29 Y35 L36T28-M32 WeakPolarHBondContact O-CG 3.39Å; T28-M32 PolarHBondContact O-N 3.21Å; C29-M32 PolarHBondContact O-N 3Å; M32-Y35 PolarHBondContact O-N 2.91Å; M32-L36 WeakPolarHBondContact O-CG 3.35Å; M32-L36 PolarHBondContact O-N 2.89Å
33V95.3Very high91.1Very high79 Ų7962.1 Ų62.148%0.47933%0.327SS..Hα-helixtrans-62.2-46.4176.4175.50000110.8C29 L30 Y31 Y35 L36 V37C29-V33 WeakPolarHBondContact O-CG2 3.41Å; C29-V33 PolarHBondContact O-N 3.47Å; C29-V33 VanDerWaalsContact O-N 3.09Å; L30-V33 PolarHBondContact O-N 3.38Å; Y31-V33 PolarHBondContact O-N 3.01Å; V33-Y35 VanDerWaalsContact C-N 3.33Å; V33-Y35 PolarHBondContact O-N 2.94Å; V33-L36 PolarHBondContact O-N 3.28Å; V33-V37 WeakPolarHBondContact O-CG2 3.37Å; V33-V37 PolarHBondContact O-N 2.98Å
34C95.3Very high90.2Very high4 Ų465.7 Ų65.73%0.02735%0.348CS..Hα-helixtrans-64.6-36.9179.1-68.30000112.3L30 Y31 V37 L38 L70 S71L30-C34 WeakPolarHBondContact O-CB 3.44Å; L30-C34 PolarHBondContact O-N 3.28Å; L30-C34 PolarHBondContact O-SG 3.45Å; Y31-C34 PolarHBondContact O-N 3.49Å; C34-V37 PolarHBondContact O-N 2.89Å; C34-L38 WeakPolarHBondContact O-CB 3.36Å; C34-L38 PolarHBondContact O-N 3.45Å; C34-L70 HydrophobicContact CB-CB 4.31Å; C34-L70 HydrophobicContact CB-CD2 4.04Å; C34-L70 HydrophobicContact CB-CG 4.18Å; C34-S71 VanDerWaalsContact SG-CA 3.59Å
35Y94.6Very high88.5Confident82 Ų8263.9 Ų63.932%0.32234%0.342SS..Hα-helixtrans-60.9-44.8173.2-177.9-95.2000111.8Y31 M32 V33 L38 T39 L63 T67Y31-Y35 VanDerWaalsContact O-CB 3.31Å; Y31-Y35 WeakPolarHBondContact O-CB 3.37Å; Y31-Y35 PolarHBondContact O-N 3.27Å; M32-Y35 PolarHBondContact O-N 2.91Å; V33-Y35 VanDerWaalsContact C-N 3.33Å; V33-Y35 PolarHBondContact O-N 2.94Å; Y35-L38 PolarHBondContact O-N 3.04Å; Y35-T39 HydrophobicContact CD1-CG2 4.2Å; Y35-T39 HydrophobicContact CD2-CG2 4.49Å; Y35-T39 HydrophobicContact CE1-CG2 3.78Å; Y35-T39 HydrophobicContact CE2-CG2 4.07Å; Y35-T39 WeakPolarHBondContact O-CB 3.28Å; Y35-T39 VanDerWaalsContact O-CG2 3.32Å; Y35-T39 WeakPolarHBondContact O-CG2 3.36Å; Y35-T39 PolarHBondContact O-N 3.48Å; Y35-T39 PolarHBondContact O-OG1 3.43Å; Y35-L63 HydrophobicContact CE2-CD2 4.35Å; Y35-T67 HydrophobicContact CD2-CG2 3.9Å
36L93.4Very high86.8Confident110 Ų11060.8 Ų60.858%0.57632%0.324SS*.Hα-helixtrans-63.8-41.7175.9-67.4175.3000112M32 V33 T39 H40M32-L36 WeakPolarHBondContact O-CG 3.35Å; M32-L36 PolarHBondContact O-N 2.89Å; V33-L36 PolarHBondContact O-N 3.28Å; L36-T39 WeakPolarHBondContact CA-OG1 3.29Å; L36-T39 PolarHBondContact O-OG1 2.95Å; L36-H40 WeakPolarHBondContact O-CB 3.47Å; L36-H40 PolarHBondContact O-N 3.03Å
37V92Very high85Confident67 Ų6761.7 Ų61.741%0.40633%0.326SS..Hα-helixtrans-61.2-49.6176172.10000110.7V33 C34 T39 H40 F41V33-V37 WeakPolarHBondContact O-CG2 3.37Å; V33-V37 PolarHBondContact O-N 2.98Å; C34-V37 PolarHBondContact O-N 2.89Å; V37-T39 PolarHBondContact O-N 3.28Å; V37-H40 WeakPolarHBondContact O-CB 3.43Å; V37-H40 PolarHBondContact O-N 3.42Å; V37-F41 HydrophobicContact CG1-CD2 4.04Å; V37-F41 HydrophobicContact CG1-CE2 4.04Å; V37-F41 VanDerWaalsContact O-CD2 3.23Å; V37-F41 WeakPolarHBondContact O-CD2 3.36Å; V37-F41 PolarHBondContact O-N 2.95Å
38L91.4Very high83.1Confident13 Ų1366.1 Ų66.17%0.06835%0.349CS..Hα-helixtrans-65.9-41.3-177.6-82.8160.1000112.7C34 Y35 H40 F41 K42 L63 T67 L70 I394C34-L38 WeakPolarHBondContact O-CB 3.36Å; C34-L38 PolarHBondContact O-N 3.45Å; Y35-L38 PolarHBondContact O-N 3.04Å; L38-H40 VanDerWaalsContact C-N 3.26Å; L38-H40 PolarHBondContact O-N 3.36Å; L38-F41 PolarHBondContact O-N 3.05Å; L38-K42 VanDerWaalsContact O-CB 3.24Å; L38-K42 WeakPolarHBondContact O-CB 3.49Å; L38-K42 PolarHBondContact O-N 3.22Å; L38-L63 HydrophobicContact CB-CD1 4.29Å; L38-T67 HydrophobicContact CB-CG2 4.11Å; L38-T67 HydrophobicContact CD1-CG2 3.31Å; L38-T67 HydrophobicContact CG-CG2 4.32Å; L38-L70 HydrophobicContact CD1-CB 4.16Å; L38-L70 HydrophobicContact CD1-CD2 3.6Å; L38-L70 HydrophobicContact CD2-CD2 4.46Å; L38-L70 HydrophobicContact CG-CD2 3.8Å; L38-I394 HydrophobicContact CD2-CG1 4.45Å; L38-I394 HydrophobicContact CD2-CG2 3.41Å; L38-I394 VanDerWaalsContact CD2-CG2 3.41Å
39T88Confident81.1Confident55 Ų5567.7 Ų67.734%0.33736%0.359SS..Hα-helixtrans-65.5-28.9175.550.60000112.9Y35 L36 V37 L63Y35-T39 HydrophobicContact CD1-CG2 4.2Å; Y35-T39 HydrophobicContact CD2-CG2 4.49Å; Y35-T39 HydrophobicContact CE1-CG2 3.78Å; Y35-T39 HydrophobicContact CE2-CG2 4.07Å; Y35-T39 WeakPolarHBondContact O-CB 3.28Å; Y35-T39 VanDerWaalsContact O-CG2 3.32Å; Y35-T39 WeakPolarHBondContact O-CG2 3.36Å; Y35-T39 PolarHBondContact O-N 3.48Å; Y35-T39 PolarHBondContact O-OG1 3.43Å; L36-T39 WeakPolarHBondContact CA-OG1 3.29Å; L36-T39 PolarHBondContact O-OG1 2.95Å; V37-T39 PolarHBondContact O-N 3.28Å; T39-L63 HydrophobicContact CG2-CD2 4.43Å
40H88.8Confident79.2Confident99 Ų9965.2 Ų65.246%0.45834%0.343SS..Hα-helixtrans-69.9-38.4174.3179.9-91.5000113.2L36 V37 L38L36-H40 WeakPolarHBondContact O-CB 3.47Å; L36-H40 PolarHBondContact O-N 3.03Å; V37-H40 WeakPolarHBondContact O-CB 3.43Å; V37-H40 PolarHBondContact O-N 3.42Å; L38-H40 VanDerWaalsContact C-N 3.26Å; L38-H40 PolarHBondContact O-N 3.36Å
41F85.9Confident77.3Confident61 Ų6171.3 Ų71.327%0.26838%0.376SS..Hα-helixtrans-85.4-29-179.9-73.3-75.3000113.6V37 L38 P384 V386 K387 D388 T389V37-F41 HydrophobicContact CG1-CD2 4.04Å; V37-F41 HydrophobicContact CG1-CE2 4.04Å; V37-F41 VanDerWaalsContact O-CD2 3.23Å; V37-F41 WeakPolarHBondContact O-CD2 3.36Å; V37-F41 PolarHBondContact O-N 2.95Å; L38-F41 PolarHBondContact O-N 3.05Å; F41-P384 HydrophobicContact CD1-CB 3.97Å; F41-P384 HydrophobicContact CE1-CB 4.41Å; F41-P384 HydrophobicContact CG-CB 4.29Å; F41-V386 HydrophobicContact CD1-CG2 4.13Å; F41-V386 HydrophobicContact CE1-CG2 3.79Å; F41-K387 WeakPolarHBondContact O-CA 3.31Å; F41-K387 PolarHBondContact O-N 2.95Å; F41-D388 PolarHBondContact O-N 2.89Å; F41-T389 VanDerWaalsContact C-OG1 3.3Å; F41-T389 PolarHBondContact O-OG1 3.49Å
42K84.6Confident76.1Confident32 Ų3273.2 Ų73.214%0.13939%0.391CS..BIsolated β-bridgetrans-55.5136.8-176.9177.8176.7175.3177.60113.4L38 T44 L63 I394L38-K42 VanDerWaalsContact O-CB 3.24Å; L38-K42 WeakPolarHBondContact O-CB 3.49Å; L38-K42 PolarHBondContact O-N 3.22Å; K42-T44 PolarHBondContact O-N 3.37Å; K42-L63 HydrophobicContact CD-CD1 4.31Å; K42-L63 HydrophobicContact CD-CD2 4.19Å; K42-I394 HydrophobicContact CB-CD1 4.21Å; K42-I394 HydrophobicContact CG-CD1 4.4Å
43K79.3Confident75.3Confident58 Ų5874.7 Ų74.725%0.25240%0.399SS..  trans-66.1125.4172.2-167.4173.3-171.5167.60112.2A45 K387 D388 T389K43-A45 HydrophobicContact CG-CB 4.34Å; K43-K387 WeakPolarHBondContact CA-O 3.49Å; K43-D388 WeakPolarHBondContact CE-OD1 3.43Å; K43-D388 IonicContact NZ-OD1 3.4Å; K43-D388 PolarHBondContact NZ-OD1 2.9Å; K43-T389 WeakPolarHBondContact CB-O 3.3Å; K43-T389 PolarHBondContact N-O 3.17Å
44T66.9Low74.6Confident87 Ų8774 Ų7453%0.53439%0.391SS..SBendtrans-74.3-26.8-178.1-46.10000112.8K42 F47 I48K42-T44 PolarHBondContact O-N 3.37Å; T44-F47 PolarHBondContact O-N 3.3Å; T44-I48 HydrophobicContact CG2-CD1 4.29Å
45A55.1Low74Confident47 Ų4776.1 Ų76.139%0.38840%0.402SS..G310 helixtrans-71.5-31.3-173.300000114.9K43 F47 I48 T49K43-A45 HydrophobicContact CG-CB 4.34Å; A45-F47 PolarHBondContact O-N 3.22Å; A45-I48 PolarHBondContact O-N 2.81Å; A45-I48 VanDerWaalsContact O-N 3.14Å; A45-T49 PolarHBondContact O-N 2.85Å; A45-T49 PolarHBondContact O-OG1 2.89Å
46E56Low73.5Confident52 Ų5272.8 Ų72.824%0.24339%0.391CS..G310 helixtrans-63.9-20.8178.9-77178175.800112.8A50E46-A50 WeakPolarHBondContact O-CB 3.37Å
47F52.1Low73.2Confident68 Ų6869.8 Ų69.830%0.29838%0.378SS..G310 helixtrans-90.9-18177.7-133.7-92.5000113.7T44 A45 A56 N59 K60T44-F47 PolarHBondContact O-N 3.3Å; A45-F47 PolarHBondContact O-N 3.22Å; F47-A56 HydrophobicContact CE1-CB 3.92Å; F47-A56 HydrophobicContact CE2-CB 4.34Å; F47-A56 WeakPolarHBondContact CE2-O 3.4Å; F47-A56 HydrophobicContact CZ-CB 3.7Å; F47-A56 VanDerWaalsContact CZ-O 3.23Å; F47-A56 WeakPolarHBondContact CZ-O 3.19Å; F47-N59 HydrophobicContact CE2-CB 4.23Å; F47-K60 HydrophobicContact CE2-CD 4.49Å; F47-K60 HydrophobicContact CE2-CG 3.91Å; F47-K60 HydrophobicContact CZ-CD 3.71Å; F47-K60 HydrophobicContact CZ-CG 3.61Å
48I52Low73Confident128 Ų12866.7 Ų66.766%0.65636%0.359SS*.THydrogen-bonded Turntrans-93.3-28.1178.8-59.1170.6000110.2T44 A45T44-I48 HydrophobicContact CG2-CD1 4.29Å; A45-I48 PolarHBondContact O-N 2.81Å; A45-I48 VanDerWaalsContact O-N 3.14Å
49T51.9Low72.9Confident107 Ų10767.5 Ų67.566%0.65636%0.363SS*.SBendtrans-89.7-11.5177.747.60000113.7A45 D51A45-T49 PolarHBondContact O-N 2.85Å; A45-T49 PolarHBondContact O-OG1 2.89Å; T49-D51 PolarHBondContact O-N 3.45Å
50A55.5Low72.9Confident22 Ų2269.5 Ų69.518%0.18237%0.367CS..  trans-76.377.9167.300000109E46 D52 D55E46-A50 WeakPolarHBondContact O-CB 3.37Å; A50-D52 PolarHBondContact O-N 2.94Å; A50-D55 HydrophobicContact CB-CB 4.16Å
51D54.8Low73.1Confident153 Ų15367.4 Ų67.482%0.81836%0.359SS*.  trans-62.3-18.2172-85.9-29.5000111.5T49T49-D51 PolarHBondContact O-N 3.45Å
52D69.2Low73.4Confident102 Ų10264.5 Ų64.555%0.54535%0.346SS..SBendtrans-87.8117.4173.8-74.3-21.9000112A50 E54 D55 A56A50-D52 PolarHBondContact O-N 2.94Å; D52-E54 PolarHBondContact O-N 3.4Å; D52-E54 VanDerWaalsContact O-N 3.09Å; D52-D55 HydrophobicContact CB-CB 4.47Å; D52-D55 PolarHBondContact O-N 3.37Å; D52-D55 VanDerWaalsContact O-N 3.11Å; D52-A56 PolarHBondContact O-N 3.18Å
53I79.8Confident73.7Confident143 Ų14363.4 Ų63.473%0.73334%0.342SS*.Hα-helixtrans-52.9-33175.7-63.2167.8000111.3T57I53-T57 HydrophobicContact CG2-CG2 4.46Å; I53-T57 WeakPolarHBondContact O-CG2 3.15Å; I53-T57 PolarHBondContact O-N 3.49Å; I53-T57 VanDerWaalsContact O-N 3.1Å
54E80.8Confident74.4Confident65 Ų6566.8 Ų66.830%0.30435%0.353SS..Hα-helixtrans-64.2-50.5178.1-63-172.9179.600111.7D52 A56 T57 V58 G144D52-E54 PolarHBondContact O-N 3.4Å; D52-E54 VanDerWaalsContact O-N 3.09Å; E54-A56 VanDerWaalsContact C-N 3.3Å; E54-A56 PolarHBondContact O-N 2.92Å; E54-T57 PolarHBondContact O-N 3.39Å; E54-T57 PolarHBondContact O-OG1 3.21Å; E54-V58 WeakPolarHBondContact O-CG2 3.41Å; E54-V58 PolarHBondContact O-N 2.89Å; E54-G144 PolarHBondContact OE2-N 2.84Å
55D82.8Confident75.8Confident48 Ų4864.4 Ų64.426%0.25734%0.337SS..Hα-helixtrans-62.7-38179.1-70.1-25.2000111.8A50 D52 T57 V58 N59 R148A50-D55 HydrophobicContact CB-CB 4.16Å; D52-D55 HydrophobicContact CB-CB 4.47Å; D52-D55 PolarHBondContact O-N 3.37Å; D52-D55 VanDerWaalsContact O-N 3.11Å; D55-T57 VanDerWaalsContact C-N 3.3Å; D55-T57 PolarHBondContact O-N 2.89Å; D55-V58 PolarHBondContact O-N 3.45Å; D55-N59 WeakPolarHBondContact O-CB 3.38Å; D55-N59 VanDerWaalsContact O-CG 3.26Å; D55-N59 PolarHBondContact O-N 3.24Å; D55-N59 PolarHBondContact O-ND2 2.92Å; D55-R148 IonicContact OD1-CZ 3.48Å; D55-R148 IonicContact OD1-NH1 3.58Å; D55-R148 PolarHBondContact OD1-NH1 3.49Å; D55-R148 IonicContact OD1-NH2 3.75Å; D55-R148 PolarHBondContact OD1-NH2 3.03Å
56A83.5Confident77.7Confident12 Ų1262.2 Ų62.210%0.09932%0.318CS..Hα-helixtrans-62-38.4173.900000112.1F47 D52 E54 K60F47-A56 HydrophobicContact CE1-CB 3.92Å; F47-A56 HydrophobicContact CE2-CB 4.34Å; F47-A56 WeakPolarHBondContact CE2-O 3.4Å; F47-A56 HydrophobicContact CZ-CB 3.7Å; F47-A56 VanDerWaalsContact CZ-O 3.23Å; F47-A56 WeakPolarHBondContact CZ-O 3.19Å; D52-A56 PolarHBondContact O-N 3.18Å; E54-A56 VanDerWaalsContact C-N 3.3Å; E54-A56 PolarHBondContact O-N 2.92Å; A56-K60 WeakPolarHBondContact O-CG 3.35Å; A56-K60 PolarHBondContact O-N 2.99Å
57T86.6Confident79.5Confident47 Ų4759.7 Ų59.729%0.28831%0.307SS..Hα-helixtrans-71.8-41.4177.465.10000112.3I53 E54 D55 N59 K60 I61 V145I53-T57 HydrophobicContact CG2-CG2 4.46Å; I53-T57 WeakPolarHBondContact O-CG2 3.15Å; I53-T57 PolarHBondContact O-N 3.49Å; I53-T57 VanDerWaalsContact O-N 3.1Å; E54-T57 PolarHBondContact O-N 3.39Å; E54-T57 PolarHBondContact O-OG1 3.21Å; D55-T57 VanDerWaalsContact C-N 3.3Å; D55-T57 PolarHBondContact O-N 2.89Å; T57-N59 PolarHBondContact O-N 3.37Å; T57-K60 WeakPolarHBondContact O-CB 3.5Å; T57-K60 PolarHBondContact O-N 3.36Å; T57-I61 WeakPolarHBondContact O-CG1 3.21Å; T57-I61 PolarHBondContact O-N 3.34Å; T57-V145 WeakPolarHBondContact OG1-CG2 3.44Å
58V88.5Confident81.6Confident1 Ų158.5 Ų58.51%0.00630%0.302CS..Hα-helixtrans-58.4-49.6175170.20000110.2E54 D55 K60 I61 A62 F132 V145E54-V58 WeakPolarHBondContact O-CG2 3.41Å; E54-V58 PolarHBondContact O-N 2.89Å; D55-V58 PolarHBondContact O-N 3.45Å; V58-K60 VanDerWaalsContact C-N 3.28Å; V58-K60 PolarHBondContact O-N 2.85Å; V58-I61 PolarHBondContact O-N 2.71Å; V58-A62 WeakPolarHBondContact O-CB 3.22Å; V58-A62 PolarHBondContact O-N 3.25Å; V58-F132 HydrophobicContact CB-CE1 4.06Å; V58-F132 HydrophobicContact CB-CZ 4.12Å; V58-F132 HydrophobicContact CG1-CD1 3.87Å; V58-F132 HydrophobicContact CG1-CE1 3.61Å; V58-F132 HydrophobicContact CG1-CG 4.44Å; V58-F132 HydrophobicContact CG1-CZ 3.97Å; V58-F132 HydrophobicContact CG2-CE1 4.19Å; V58-F132 HydrophobicContact CG2-CE2 4.22Å; V58-F132 HydrophobicContact CG2-CZ 3.74Å; V58-V145 HydrophobicContact CG2-CG1 4.43Å
59N88.1Confident83.7Confident30 Ų3052.4 Ų52.416%0.1627%0.27CS..Hα-helixtrans-64.6-29.2179.5-72.8-21.5000113.3F47 D55 T57 L63 L391F47-N59 HydrophobicContact CE2-CB 4.23Å; D55-N59 WeakPolarHBondContact O-CB 3.38Å; D55-N59 VanDerWaalsContact O-CG 3.26Å; D55-N59 PolarHBondContact O-N 3.24Å; D55-N59 PolarHBondContact O-ND2 2.92Å; T57-N59 PolarHBondContact O-N 3.37Å; N59-L63 WeakPolarHBondContact O-CB 3.37Å; N59-L63 PolarHBondContact O-N 3.39Å; N59-L63 VanDerWaalsContact O-N 3.12Å; N59-L391 HydrophobicContact CB-CD2 4.36Å; N59-L391 WeakPolarHBondContact OD1-CD2 3.41Å
60K89.6Confident85.8Confident97 Ų9748.1 Ų48.142%0.42224%0.243SC..Hα-helixtrans-69.9-46.8172.4-83.1166.1172161.60111.7F47 A56 T57 V58 L63 W64F47-K60 HydrophobicContact CE2-CD 4.49Å; F47-K60 HydrophobicContact CE2-CG 3.91Å; F47-K60 HydrophobicContact CZ-CD 3.71Å; F47-K60 HydrophobicContact CZ-CG 3.61Å; A56-K60 WeakPolarHBondContact O-CG 3.35Å; A56-K60 PolarHBondContact O-N 2.99Å; T57-K60 WeakPolarHBondContact O-CB 3.5Å; T57-K60 PolarHBondContact O-N 3.36Å; V58-K60 VanDerWaalsContact C-N 3.28Å; V58-K60 PolarHBondContact O-N 2.85Å; K60-L63 WeakPolarHBondContact O-CB 3.43Å; K60-L63 PolarHBondContact O-N 3.13Å; K60-W64 PolarHBondContact O-N 3Å
61I91.5Very high87.7Confident56 Ų5647.1 Ų47.129%0.28724%0.235SC..Hα-helixtrans-63.9-46178.9-66164.8000110.2T57 V58 L63 W64 L65 F132 V145T57-I61 WeakPolarHBondContact O-CG1 3.21Å; T57-I61 PolarHBondContact O-N 3.34Å; V58-I61 PolarHBondContact O-N 2.71Å; I61-L63 VanDerWaalsContact C-N 3.27Å; I61-L63 PolarHBondContact O-N 3.23Å; I61-W64 HydrophobicContact CG1-CE3 4.29Å; I61-W64 HydrophobicContact CG1-CZ3 4.25Å; I61-W64 PolarHBondContact O-N 2.82Å; I61-W64 VanDerWaalsContact O-N 3.13Å; I61-L65 HydrophobicContact CG2-CD1 4.25Å; I61-L65 WeakPolarHBondContact O-CG 3.48Å; I61-L65 PolarHBondContact O-N 3.32Å; I61-F132 HydrophobicContact CB-CE1 4.05Å; I61-F132 HydrophobicContact CD1-CE1 4.49Å; I61-F132 HydrophobicContact CD1-CZ 4.35Å; I61-F132 HydrophobicContact CG2-CE1 3.96Å; I61-V145 HydrophobicContact CD1-CG1 4.5Å
62A92.1Very high89.6Confident0 Ų039.9 Ų39.90%020%0.196CC..Hα-helixtrans-56.6-42.2174.800000111.7V58 L65 C66 V129 T133 L391V58-A62 WeakPolarHBondContact O-CB 3.22Å; V58-A62 PolarHBondContact O-N 3.25Å; A62-L65 PolarHBondContact O-N 3.19Å; A62-C66 WeakPolarHBondContact O-CB 3.35Å; A62-C66 PolarHBondContact O-N 3.31Å; A62-C66 PolarHBondContact O-SG 2.75Å; A62-V129 HydrophobicContact CB-CG1 3.8Å; A62-T133 HydrophobicContact CB-CG2 3.66Å; A62-L391 HydrophobicContact CB-CD1 4.44Å; A62-L391 HydrophobicContact CB-CD2 3.94Å
63L92.5Very high90.8Very high8 Ų835.2 Ų35.24%0.04217%0.171CC..Hα-helixtrans-63.2-44.2175.6-171.170.8000111.9Y35 L38 T39 K42 N59 K60 I61 L65 C66 T67Y35-L63 HydrophobicContact CE2-CD2 4.35Å; L38-L63 HydrophobicContact CB-CD1 4.29Å; T39-L63 HydrophobicContact CG2-CD2 4.43Å; K42-L63 HydrophobicContact CD-CD1 4.31Å; K42-L63 HydrophobicContact CD-CD2 4.19Å; N59-L63 WeakPolarHBondContact O-CB 3.37Å; N59-L63 PolarHBondContact O-N 3.39Å; N59-L63 VanDerWaalsContact O-N 3.12Å; K60-L63 WeakPolarHBondContact O-CB 3.43Å; K60-L63 PolarHBondContact O-N 3.13Å; I61-L63 VanDerWaalsContact C-N 3.27Å; I61-L63 PolarHBondContact O-N 3.23Å; L63-L65 VanDerWaalsContact C-N 3.3Å; L63-L65 PolarHBondContact O-N 3.16Å; L63-C66 CarbonylContact O-C 3.57Å; L63-C66 PolarHBondContact O-N 3.42Å; L63-T67 HydrophobicContact CG-CG2 4.38Å; L63-T67 WeakPolarHBondContact O-CG2 3.45Å; L63-T67 PolarHBondContact O-N 2.75Å; L63-T67 PolarHBondContact O-OG1 3.19Å
64W93.8Very high91.5Very high129 Ų12930.8 Ų30.849%0.48915%0.151SC..Hα-helixtrans-61.1-38.1177.5-66.4-28.4000112.9K60 I61 T67 F68K60-W64 PolarHBondContact O-N 3Å; I61-W64 HydrophobicContact CG1-CE3 4.29Å; I61-W64 HydrophobicContact CG1-CZ3 4.25Å; I61-W64 PolarHBondContact O-N 2.82Å; I61-W64 VanDerWaalsContact O-N 3.13Å; W64-T67 VanDerWaalsContact C-OG1 3.29Å; W64-T67 VanDerWaalsContact CA-OG1 3.24Å; W64-T67 WeakPolarHBondContact CA-OG1 3.18Å; W64-T67 PolarHBondContact O-N 3.37Å; W64-T67 PolarHBondContact O-OG1 3.29Å; W64-F68 PolarHBondContact O-N 2.69Å
65L94.8Very high92.1Very high38 Ų3828 Ų2820%0.19914%0.139CC..Hα-helixtrans-69.1-41.5174.4-65.9175.3000111.3I61 A62 L63 T67 F68 T69 L125 F128 V129I61-L65 HydrophobicContact CG2-CD1 4.25Å; I61-L65 WeakPolarHBondContact O-CG 3.48Å; I61-L65 PolarHBondContact O-N 3.32Å; A62-L65 PolarHBondContact O-N 3.19Å; L63-L65 VanDerWaalsContact C-N 3.3Å; L63-L65 PolarHBondContact O-N 3.16Å; L65-T67 VanDerWaalsContact C-N 3.3Å; L65-T67 PolarHBondContact O-N 3.14Å; L65-F68 PolarHBondContact O-N 2.98Å; L65-T69 WeakPolarHBondContact O-CG2 3.49Å; L65-T69 PolarHBondContact O-N 2.97Å; L65-T69 PolarHBondContact O-OG1 3.44Å; L65-T69 VanDerWaalsContact O-OG1 3.04Å; L65-L125 HydrophobicContact CD2-CD2 4.29Å; L65-F128 HydrophobicContact CD1-CD1 4.01Å; L65-F128 HydrophobicContact CD1-CE1 3.93Å; L65-V129 HydrophobicContact CB-CG2 3.4Å; L65-V129 VanDerWaalsContact CB-CG2 3.4Å; L65-V129 HydrophobicContact CD1-CG2 3.46Å; L65-V129 VanDerWaalsContact CD1-CG2 3.46Å; L65-V129 HydrophobicContact CG-CG2 4.06Å
66C94.8Very high92.4Very high0 Ų026 Ų260%013%0.129CC..Hα-helixtrans-62.3-35.2172.4-67.20000112.6A62 L63 T69 L70 I394A62-C66 WeakPolarHBondContact O-CB 3.35Å; A62-C66 PolarHBondContact O-N 3.31Å; A62-C66 PolarHBondContact O-SG 2.75Å; L63-C66 CarbonylContact O-C 3.57Å; L63-C66 PolarHBondContact O-N 3.42Å; C66-T69 WeakPolarHBondContact CA-OG1 3.45Å; C66-T69 PolarHBondContact O-OG1 3.41Å; C66-L70 WeakPolarHBondContact O-CB 3.39Å; C66-L70 PolarHBondContact O-N 3.5Å; C66-I394 HydrophobicContact CB-CG2 3.99Å
67T95.8Very high92.8Very high0 Ų026.4 Ų26.40%013%0.13CC..Hα-helixtrans-72.4-36.9177.453.80000111.8Y31 Y35 L38 L63 W64 L65 S71Y31-T67 VanDerWaalsContact CE2-OG1 3.27Å; Y31-T67 WeakPolarHBondContact CE2-OG1 3.34Å; Y31-T67 VanDerWaalsContact CZ-OG1 3.28Å; Y31-T67 PolarHBondContact OH-OG1 3.14Å; Y35-T67 HydrophobicContact CD2-CG2 3.9Å; L38-T67 HydrophobicContact CB-CG2 4.11Å; L38-T67 HydrophobicContact CD1-CG2 3.31Å; L38-T67 HydrophobicContact CG-CG2 4.32Å; L63-T67 HydrophobicContact CG-CG2 4.38Å; L63-T67 WeakPolarHBondContact O-CG2 3.45Å; L63-T67 PolarHBondContact O-N 2.75Å; L63-T67 PolarHBondContact O-OG1 3.19Å; W64-T67 VanDerWaalsContact C-OG1 3.29Å; W64-T67 VanDerWaalsContact CA-OG1 3.24Å; W64-T67 WeakPolarHBondContact CA-OG1 3.18Å; W64-T67 PolarHBondContact O-N 3.37Å; W64-T67 PolarHBondContact O-OG1 3.29Å; L65-T67 VanDerWaalsContact C-N 3.3Å; L65-T67 PolarHBondContact O-N 3.14Å; T67-S71 WeakPolarHBondContact O-CB 3.44Å; T67-S71 PolarHBondContact O-N 3.02Å
68F95.6Very high93Very high43 Ų4327.1 Ų27.119%0.18913%0.132CC..Hα-helixtrans-62-50.7173.4176.1-101000111.2L27 Y31 W64 L65 L70 S71 V72 F117 L125L27-F68 HydrophobicContact CD2-CE2 4.35Å; Y31-F68 HydrophobicContact CD2-CB 4.47Å; Y31-F68 HydrophobicContact CE2-CB 4.12Å; W64-F68 PolarHBondContact O-N 2.69Å; L65-F68 PolarHBondContact O-N 2.98Å; F68-L70 PolarHBondContact O-N 2.97Å; F68-S71 WeakPolarHBondContact O-CB 3.14Å; F68-S71 PolarHBondContact O-N 3.06Å; F68-S71 VanDerWaalsContact O-N 3.15Å; F68-V72 HydrophobicContact CD1-CG2 4.39Å; F68-V72 HydrophobicContact CE1-CG2 3.98Å; F68-V72 HydrophobicContact CE2-CG2 4.33Å; F68-V72 HydrophobicContact CZ-CG2 3.95Å; F68-V72 WeakPolarHBondContact O-CG2 3.11Å; F68-V72 PolarHBondContact O-N 3.4Å; F68-F117 HydrophobicContact CZ-CB 4.26Å; F68-F117 HydrophobicContact CZ-CD1 4.04Å; F68-F117 HydrophobicContact CZ-CD2 4.36Å; F68-F117 HydrophobicContact CZ-CE1 4.48Å; F68-F117 AromaticContact CZ-CG 4Å; F68-F117 HydrophobicContact CZ-CG 4Å; F68-L125 HydrophobicContact CD1-CD1 3.63Å; F68-L125 HydrophobicContact CE1-CD1 3.7Å
69T95.8Very high93Very high0 Ų027.2 Ų27.20%013%0.132CC..Hα-helixtrans-64.5-38.9-179.853.10000113.2L65 C66 S71 V72 A73 L125 M126L65-T69 WeakPolarHBondContact O-CG2 3.49Å; L65-T69 PolarHBondContact O-N 2.97Å; L65-T69 PolarHBondContact O-OG1 3.44Å; L65-T69 VanDerWaalsContact O-OG1 3.04Å; C66-T69 WeakPolarHBondContact CA-OG1 3.45Å; C66-T69 PolarHBondContact O-OG1 3.41Å; T69-S71 VanDerWaalsContact C-N 3.34Å; T69-V72 PolarHBondContact O-N 3.05Å; T69-A73 PolarHBondContact O-N 3.27Å; T69-L125 HydrophobicContact CG2-CB 4.36Å; T69-L125 HydrophobicContact CG2-CD1 4.34Å; T69-M126 HydrophobicContact CG2-CE 3.51Å; T69-M126 HydrophobicContact CG2-CG 4.21Å; T69-M126 HydrophobicContact CG2-SD 3.81Å; T69-M126 WeakPolarHBondContact OG1-CE 3.22Å
70L95.8Very high92.8Very high17 Ų1725.9 Ų25.99%0.08913%0.125CC..Hα-helixtrans-64-39.3172.7-173.863.4000111.7C34 L38 C66 F68 A73 V74 L401C34-L70 HydrophobicContact CB-CB 4.31Å; C34-L70 HydrophobicContact CB-CD2 4.04Å; C34-L70 HydrophobicContact CB-CG 4.18Å; L38-L70 HydrophobicContact CD1-CB 4.16Å; L38-L70 HydrophobicContact CD1-CD2 3.6Å; L38-L70 HydrophobicContact CD2-CD2 4.46Å; L38-L70 HydrophobicContact CG-CD2 3.8Å; C66-L70 WeakPolarHBondContact O-CB 3.39Å; C66-L70 PolarHBondContact O-N 3.5Å; F68-L70 PolarHBondContact O-N 2.97Å; L70-A73 WeakPolarHBondContact O-CB 3.19Å; L70-A73 PolarHBondContact O-N 2.8Å; L70-V74 WeakPolarHBondContact O-CG2 3.17Å; L70-V74 PolarHBondContact O-N 2.83Å; L70-L401 HydrophobicContact CD1-CD1 3.81Å
71S96Very high92.8Very high0 Ų021.5 Ų21.50%011%0.107CC..Hα-helixtrans-60.6-45175-1760000111.6L30 Y31 C34 T67 F68 T69 A73 V74 C75L30-S71 VanDerWaalsContact CB-OG 3.25Å; L30-S71 WeakPolarHBondContact CB-OG 3.28Å; Y31-S71 PolarHBondContact N-OG 3.41Å; C34-S71 VanDerWaalsContact SG-CA 3.59Å; T67-S71 WeakPolarHBondContact O-CB 3.44Å; T67-S71 PolarHBondContact O-N 3.02Å; F68-S71 WeakPolarHBondContact O-CB 3.14Å; F68-S71 PolarHBondContact O-N 3.06Å; F68-S71 VanDerWaalsContact O-N 3.15Å; T69-S71 VanDerWaalsContact C-N 3.34Å; S71-A73 VanDerWaalsContact C-N 3.33Å; S71-A73 PolarHBondContact O-N 3.19Å; S71-V74 PolarHBondContact O-N 3Å; S71-C75 VanDerWaalsContact O-CB 3.31Å; S71-C75 WeakPolarHBondContact O-CB 3.21Å; S71-C75 PolarHBondContact O-N 2.97Å
72V94.4Very high92.6Very high2 Ų221.6 Ų21.61%0.01211%0.107CC..Hα-helixtrans-61.9-41.2174.3175.90000111.1F68 T69 C75 A76 F117 L402F68-V72 HydrophobicContact CD1-CG2 4.39Å; F68-V72 HydrophobicContact CE1-CG2 3.98Å; F68-V72 HydrophobicContact CE2-CG2 4.33Å; F68-V72 HydrophobicContact CZ-CG2 3.95Å; F68-V72 WeakPolarHBondContact O-CG2 3.11Å; F68-V72 PolarHBondContact O-N 3.4Å; T69-V72 PolarHBondContact O-N 3.05Å; V72-C75 WeakPolarHBondContact O-CB 3.48Å; V72-C75 PolarHBondContact O-N 3.35Å; V72-A76 PolarHBondContact O-N 3.04Å; V72-F117 HydrophobicContact CG1-CB 3.98Å; V72-F117 HydrophobicContact CG2-CB 3.76Å; V72-L402 HydrophobicContact CG1-CD1 4.14Å
73A94.4Very high92.3Very high3 Ų321.7 Ų21.73%0.02511%0.107CC..Hα-helixtrans-62.6-45177.100000112.2T69 L70 S71 C75 A76 V77 L402 S405T69-A73 PolarHBondContact O-N 3.27Å; L70-A73 WeakPolarHBondContact O-CB 3.19Å; L70-A73 PolarHBondContact O-N 2.8Å; S71-A73 VanDerWaalsContact C-N 3.33Å; S71-A73 PolarHBondContact O-N 3.19Å; A73-C75 VanDerWaalsContact C-N 3.34Å; A73-A76 PolarHBondContact O-N 3.36Å; A73-V77 WeakPolarHBondContact O-CG2 3.39Å; A73-V77 PolarHBondContact O-N 2.96Å; A73-L402 HydrophobicContact CB-CB 4.14Å; A73-L402 HydrophobicContact CB-CD1 3.86Å; A73-S405 WeakPolarHBondContact CA-OG 3.39Å; A73-S405 VanDerWaalsContact O-CB 3.26Å; A73-S405 WeakPolarHBondContact O-CB 3.43Å; A73-S405 PolarHBondContact O-OG 2.92Å
74V94.6Very high91.9Very high51 Ų5121.3 Ų21.331%0.30911%0.106SC..Hα-helixtrans-65.1-39.8175.7174.50000111L30 L70 S71 A76 V77 L78L30-V74 HydrophobicContact CD2-CG1 3.87Å; L70-V74 WeakPolarHBondContact O-CG2 3.17Å; L70-V74 PolarHBondContact O-N 2.83Å; S71-V74 PolarHBondContact O-N 3Å; V74-A76 VanDerWaalsContact C-N 3.35Å; V74-A76 PolarHBondContact O-N 3.3Å; V74-V77 PolarHBondContact O-N 3.48Å; V74-L78 HydrophobicContact CG1-CD1 3.86Å; V74-L78 HydrophobicContact CG1-CG 4.38Å; V74-L78 WeakPolarHBondContact O-CG 3.47Å; V74-L78 PolarHBondContact O-N 3.29Å
75C92.6Very high91.5Very high7 Ų719.3 Ų19.35%0.04710%0.104CC..Hα-helixtrans-59.4-45.9175.2-166.60000111.1L30 S71 V72 A73 V77 L78 L79 V114L30-C75 HydrophobicContact CD1-CB 3.79Å; S71-C75 VanDerWaalsContact O-CB 3.31Å; S71-C75 WeakPolarHBondContact O-CB 3.21Å; S71-C75 PolarHBondContact O-N 2.97Å; V72-C75 WeakPolarHBondContact O-CB 3.48Å; V72-C75 PolarHBondContact O-N 3.35Å; A73-C75 VanDerWaalsContact C-N 3.34Å; C75-V77 VanDerWaalsContact C-N 3.32Å; C75-V77 PolarHBondContact O-N 2.87Å; C75-L78 PolarHBondContact O-N 2.87Å; C75-L79 WeakPolarHBondContact O-CB 3.27Å; C75-L79 PolarHBondContact O-N 3.31Å; C75-V114 HydrophobicContact CB-CG2 4.22Å; C75-V114 WeakPolarHBondContact SG-CG2 3.17Å
76A90.3Very high90.9Very high5 Ų517.9 Ų17.94%0.04110%0.097CC..Hα-helixtrans-59.6-38.3176.300000113.3V72 A73 V74 V114V72-A76 PolarHBondContact O-N 3.04Å; A73-A76 PolarHBondContact O-N 3.36Å; V74-A76 VanDerWaalsContact C-N 3.35Å; V74-A76 PolarHBondContact O-N 3.3Å; A76-V114 HydrophobicContact CB-CG1 3.68Å
77V91.1Very high90.4Very high20 Ų2017.9 Ų17.912%0.12110%0.097CC..Hα-helixtrans-65.1-44.7174.9174.30000111.8A73 V74 C75 L79 P81 M366 S405 L408A73-V77 WeakPolarHBondContact O-CG2 3.39Å; A73-V77 PolarHBondContact O-N 2.96Å; V74-V77 PolarHBondContact O-N 3.48Å; C75-V77 VanDerWaalsContact C-N 3.32Å; C75-V77 PolarHBondContact O-N 2.87Å; V77-L79 VanDerWaalsContact C-N 3.34Å; V77-P81 WeakPolarHBondContact O-CD 3.49Å; V77-M366 HydrophobicContact CG1-CB 4.38Å; V77-M366 HydrophobicContact CG1-CG 3.75Å; V77-M366 HydrophobicContact CG2-CE 3.46Å; V77-M366 VanDerWaalsContact CG2-CE 3.46Å; V77-M366 HydrophobicContact CG2-CG 4.1Å; V77-M366 HydrophobicContact CG2-SD 3.97Å; V77-S405 VanDerWaalsContact CG2-CB 3.48Å; V77-L408 HydrophobicContact CG1-CD2 4.44Å
78L90.6Very high89.8Confident62 Ų6218.5 Ų18.533%0.32510%0.1SC..Hα-helixtrans-78.8-20.2-174.6-67.2175.4000113.1L30 V74 C75 L80 P81 I82L30-L78 HydrophobicContact CD2-CD1 4.19Å; V74-L78 HydrophobicContact CG1-CD1 3.86Å; V74-L78 HydrophobicContact CG1-CG 4.38Å; V74-L78 WeakPolarHBondContact O-CG 3.47Å; V74-L78 PolarHBondContact O-N 3.29Å; C75-L78 PolarHBondContact O-N 2.87Å; L78-L80 VanDerWaalsContact C-N 3.35Å; L78-L80 PolarHBondContact O-N 3.48Å; L78-P81 WeakPolarHBondContact O-CD 3.3Å; L78-I82 HydrophobicContact CB-CD1 3.9Å; L78-I82 VanDerWaalsContact O-CB 3.32Å; L78-I82 WeakPolarHBondContact O-CB 3.41Å; L78-I82 WeakPolarHBondContact O-CD1 3.47Å; L78-I82 WeakPolarHBondContact O-CG1 3.27Å; L78-I82 PolarHBondContact O-N 2.83Å
79L87.9Confident89.2Confident3 Ų318.7 Ų18.72%0.01610%0.104CC..Hα-helixtrans-55.5-47-175.8-172.166.7000112.8C75 V77 S83 L110 W111 V114C75-L79 WeakPolarHBondContact O-CB 3.27Å; C75-L79 PolarHBondContact O-N 3.31Å; V77-L79 VanDerWaalsContact C-N 3.34Å; L79-S83 WeakPolarHBondContact O-CB 2.99Å; L79-S83 PolarHBondContact O-N 3.4Å; L79-S83 PolarHBondContact O-OG 3.13Å; L79-L110 HydrophobicContact CD1-CB 4.02Å; L79-L110 HydrophobicContact CD1-CD2 3.39Å; L79-L110 HydrophobicContact CD1-CG 3.47Å; L79-L110 VanDerWaalsContact CD1-CG 3.47Å; L79-W111 HydrophobicContact CB-CZ2 4.47Å; L79-W111 HydrophobicContact CD1-CG 4.32Å; L79-W111 HydrophobicContact CD2-CB 4.37Å; L79-W111 HydrophobicContact CD2-CD2 3.25Å; L79-W111 VanDerWaalsContact CD2-CE2 3.48Å; L79-W111 HydrophobicContact CD2-CE3 3.39Å; L79-W111 HydrophobicContact CD2-CG 3.72Å; L79-W111 HydrophobicContact CD2-CH2 3.89Å; L79-W111 HydrophobicContact CD2-CZ2 3.81Å; L79-W111 HydrophobicContact CD2-CZ3 3.71Å; L79-W111 HydrophobicContact CG-CD2 3.79Å; L79-W111 VanDerWaalsContact CG-CE2 3.49Å; L79-W111 HydrophobicContact CG-CE3 4.33Å; L79-W111 HydrophobicContact CG-CG 4.1Å; L79-W111 HydrophobicContact CG-CH2 4.29Å; L79-W111 HydrophobicContact CG-CZ2 3.78Å; L79-V114 HydrophobicContact CD1-CG2 4.43Å; L79-V114 HydrophobicContact CD2-CB 4.18Å; L79-V114 HydrophobicContact CD2-CG1 4.24Å; L79-V114 HydrophobicContact CD2-CG2 4.36Å
80L85.2Confident88.5Confident3 Ų320.2 Ų20.22%0.01611%0.113CC..Hα-helixtrans-71-48.2-177.8-163.4160.6000111.8L78 I82 S83 I84 W111 I362 P409 T418L78-L80 VanDerWaalsContact C-N 3.35Å; L78-L80 PolarHBondContact O-N 3.48Å; L80-I82 PolarHBondContact O-N 2.88Å; L80-S83 PolarHBondContact O-N 2.69Å; L80-I84 HydrophobicContact CD2-CD1 3.59Å; L80-I84 HydrophobicContact CD2-CG1 4.37Å; L80-I84 WeakPolarHBondContact O-CG1 3.27Å; L80-I84 PolarHBondContact O-N 3.18Å; L80-I84 VanDerWaalsContact O-N 3.11Å; L80-W111 HydrophobicContact CB-CH2 4.29Å; L80-W111 HydrophobicContact CB-CZ2 4.11Å; L80-W111 HydrophobicContact CD1-CH2 4.4Å; L80-W111 HydrophobicContact CG-CZ2 4.39Å; L80-I362 HydrophobicContact CD2-CD1 3.17Å; L80-I362 HydrophobicContact CD2-CG1 4.11Å; L80-I362 HydrophobicContact CD2-CG2 4.34Å; L80-P409 HydrophobicContact CD1-CB 3.92Å; L80-P409 HydrophobicContact CD1-CG 4.32Å; L80-T418 HydrophobicContact CD2-CG2 4.19Å
81P88.8Confident87.8Confident5 Ų522.1 Ų22.13%0.03212%0.123CC..Hα-helixtrans-51.5-48.3167.7-3237.1000114.7V77 L78 S83 I84 L85 V359 I362 L363V77-P81 WeakPolarHBondContact O-CD 3.49Å; L78-P81 WeakPolarHBondContact O-CD 3.3Å; P81-S83 VanDerWaalsContact C-N 3.29Å; P81-S83 PolarHBondContact O-N 3.4Å; P81-I84 PolarHBondContact O-N 2.83Å; P81-L85 WeakPolarHBondContact O-CB 3.34Å; P81-L85 VanDerWaalsContact O-CG 3.3Å; P81-L85 WeakPolarHBondContact O-CG 3.36Å; P81-L85 PolarHBondContact O-N 2.97Å; P81-V359 HydrophobicContact CB-CG1 3.94Å; P81-I362 HydrophobicContact CG-CG2 4.23Å; P81-L363 HydrophobicContact CG-CD2 3.96Å; P81-L363 HydrophobicContact CG-CG 4.26Å
82I87.3Confident87.1Confident58 Ų5826 Ų2630%0.29715%0.147SC..Hα-helixtrans-62.1-41.8179.6-71.3167.4000109.7L78 L80 I84 L85 S86L78-I82 HydrophobicContact CB-CD1 3.9Å; L78-I82 VanDerWaalsContact O-CB 3.32Å; L78-I82 WeakPolarHBondContact O-CB 3.41Å; L78-I82 WeakPolarHBondContact O-CD1 3.47Å; L78-I82 WeakPolarHBondContact O-CG1 3.27Å; L78-I82 PolarHBondContact O-N 2.83Å; L80-I82 PolarHBondContact O-N 2.88Å; I82-I84 PolarHBondContact O-N 3.32Å; I82-L85 PolarHBondContact O-N 3.15Å; I82-S86 WeakPolarHBondContact O-CB 2.87Å; I82-S86 PolarHBondContact O-N 2.87Å; I82-S86 PolarHBondContact O-OG 3.44Å
83S85.8Confident86.5Confident1 Ų131.4 Ų31.41%0.00717%0.17CC..Hα-helixtrans-63.2-43.4-179.4-57.40000112.4L79 L80 P81 S86 N87 I107 W111 F420L79-S83 WeakPolarHBondContact O-CB 2.99Å; L79-S83 PolarHBondContact O-N 3.4Å; L79-S83 PolarHBondContact O-OG 3.13Å; L80-S83 PolarHBondContact O-N 2.69Å; P81-S83 VanDerWaalsContact C-N 3.29Å; P81-S83 PolarHBondContact O-N 3.4Å; S83-S86 PolarHBondContact O-N 3.01Å; S83-N87 PolarHBondContact O-N 3.46Å; S83-N87 VanDerWaalsContact O-N 3.13Å; S83-I107 VanDerWaalsContact OG-CG2 3.29Å; S83-I107 WeakPolarHBondContact OG-CG2 3.13Å; S83-W111 PolarHBondContact OG-NE1 3.04Å; S83-W111 VanDerWaalsContact OG-NE1 3.1Å; S83-F420 VanDerWaalsContact CB-CZ 3.46Å
84I84.5Confident85.6Confident1 Ų134.8 Ų34.81%0.00519%0.192CC..Hα-helixtrans-66.4-48.4177.4-63.9169000110.8L80 P81 I82 S86 N87 E88 A355 V359 I362 T418L80-I84 HydrophobicContact CD2-CD1 3.59Å; L80-I84 HydrophobicContact CD2-CG1 4.37Å; L80-I84 WeakPolarHBondContact O-CG1 3.27Å; L80-I84 PolarHBondContact O-N 3.18Å; L80-I84 VanDerWaalsContact O-N 3.11Å; P81-I84 PolarHBondContact O-N 2.83Å; I82-I84 PolarHBondContact O-N 3.32Å; I84-S86 VanDerWaalsContact C-N 3.26Å; I84-S86 PolarHBondContact O-N 3.08Å; I84-N87 PolarHBondContact O-N 3.24Å; I84-E88 PolarHBondContact O-N 3.34Å; I84-A355 HydrophobicContact CG2-CB 3.82Å; I84-V359 HydrophobicContact CB-CG2 3.89Å; I84-V359 HydrophobicContact CD1-CG2 4.28Å; I84-V359 HydrophobicContact CG2-CG2 3.79Å; I84-I362 HydrophobicContact CD1-CD1 3.65Å; I84-T418 HydrophobicContact CD1-CG2 3.76Å
85L84.8Confident84.6Confident86 Ų8640.8 Ų40.845%0.4522%0.216SC..Hα-helixtrans-59.7-41.3177.7-72.7172.4000111.2P81 I82 N87 E88 V89 V359P81-L85 WeakPolarHBondContact O-CB 3.34Å; P81-L85 VanDerWaalsContact O-CG 3.3Å; P81-L85 WeakPolarHBondContact O-CG 3.36Å; P81-L85 PolarHBondContact O-N 2.97Å; I82-L85 PolarHBondContact O-N 3.15Å; L85-N87 VanDerWaalsContact C-N 3.32Å; L85-N87 PolarHBondContact O-N 2.88Å; L85-E88 PolarHBondContact O-N 2.88Å; L85-V89 VanDerWaalsContact O-CB 3.28Å; L85-V89 WeakPolarHBondContact O-CB 3.45Å; L85-V89 WeakPolarHBondContact O-CG2 3.47Å; L85-V89 PolarHBondContact O-N 3.16Å; L85-V359 HydrophobicContact CD1-CG1 4.47Å; L85-V359 HydrophobicContact CD2-CG2 4.33Å; L85-V359 HydrophobicContact CG-CG2 4.09Å
86S83.6Confident84.1Confident8 Ų842.5 Ų42.56%0.05623%0.228CC..Hα-helixtrans-60.7-42.8179.4-62.70000111.7I82 S83 I84 V89 L90 L102I82-S86 WeakPolarHBondContact O-CB 2.87Å; I82-S86 PolarHBondContact O-N 2.87Å; I82-S86 PolarHBondContact O-OG 3.44Å; S83-S86 PolarHBondContact O-N 3.01Å; I84-S86 VanDerWaalsContact C-N 3.26Å; I84-S86 PolarHBondContact O-N 3.08Å; S86-V89 PolarHBondContact O-N 3.27Å; S86-L90 WeakPolarHBondContact O-CD1 3.37Å; S86-L90 WeakPolarHBondContact O-CG 3.43Å; S86-L90 PolarHBondContact O-N 2.8Å; S86-L102 VanDerWaalsContact CA-CD2 3.43Å; S86-L102 WeakPolarHBondContact OG-CD2 3.38Å
87N83.2Confident83.4Confident0 Ų049.8 Ų49.80%026%0.255CS..Hα-helixtrans-61.3-47.9176.5-173.373.3000112.8S83 I84 L85 V89 L90 L91 L342 G343 F347S83-N87 PolarHBondContact O-N 3.46Å; S83-N87 VanDerWaalsContact O-N 3.13Å; I84-N87 PolarHBondContact O-N 3.24Å; L85-N87 VanDerWaalsContact C-N 3.32Å; L85-N87 PolarHBondContact O-N 2.88Å; N87-V89 VanDerWaalsContact C-N 3.3Å; N87-V89 PolarHBondContact O-N 3.47Å; N87-L90 WeakPolarHBondContact O-CB 3.46Å; N87-L90 PolarHBondContact O-N 3.43Å; N87-L91 WeakPolarHBondContact O-CG 3.4Å; N87-L91 PolarHBondContact O-N 3.48Å; N87-L342 HydrophobicContact CB-CD2 4.04Å; N87-G343 PolarHBondContact OD1-N 3.05Å; N87-F347 HydrophobicContact CB-CD2 4.01Å; N87-F347 HydrophobicContact CB-CE2 3.5Å; N87-F347 VanDerWaalsContact ND2-CD2 3.27Å; N87-F347 WeakPolarHBondContact ND2-CD2 3.19Å; N87-F347 WeakPolarHBondContact ND2-CE2 3.27Å; N87-F347 WeakPolarHBondContact OD1-CE2 3.19Å
88E84.7Confident82.6Confident14 Ų1458 Ų587%0.06529%0.286CS..Hα-helixtrans-68.2-33.8-179.4-63.2-55131.900112.2I84 L85 L91 T92 S346 F347 A355I84-E88 PolarHBondContact O-N 3.34Å; L85-E88 PolarHBondContact O-N 2.88Å; E88-L91 PolarHBondContact O-N 3.22Å; E88-T92 WeakPolarHBondContact O-CB 2.96Å; E88-T92 PolarHBondContact O-N 2.82Å; E88-T92 PolarHBondContact O-OG1 2.86Å; E88-S346 WeakPolarHBondContact OE1-CA 3.29Å; E88-S346 PolarHBondContact OE2-OG 3.33Å; E88-F347 PolarHBondContact OE1-N 3.34Å; E88-A355 HydrophobicContact CG-CB 3.42Å; E88-A355 VanDerWaalsContact CG-CB 3.42Å
89V83Confident81.9Confident46 Ų4657.7 Ų57.728%0.27928%0.283SS..Hα-helixtrans-68.4-38.6176.9170.30000111.2L85 S86 N87 T92 F93 M99L85-V89 VanDerWaalsContact O-CB 3.28Å; L85-V89 WeakPolarHBondContact O-CB 3.45Å; L85-V89 WeakPolarHBondContact O-CG2 3.47Å; L85-V89 PolarHBondContact O-N 3.16Å; S86-V89 PolarHBondContact O-N 3.27Å; N87-V89 VanDerWaalsContact C-N 3.3Å; N87-V89 PolarHBondContact O-N 3.47Å; V89-T92 PolarHBondContact O-N 2.91Å; V89-F93 HydrophobicContact CG1-CD2 4.47Å; V89-F93 PolarHBondContact O-N 3.23Å; V89-F93 VanDerWaalsContact O-N 3.08Å; V89-M99 HydrophobicContact CB-SD 4.47Å; V89-M99 HydrophobicContact CG1-CE 3.16Å; V89-M99 HydrophobicContact CG1-CG 3.56Å; V89-M99 HydrophobicContact CG1-SD 3.12Å; V89-M99 WeakPolarHBondContact CG1-SD 3.29Å
90L80.9Confident81.1Confident33 Ų3361.8 Ų61.817%0.17330%0.302CS..Hα-helixtrans-61.3-43.3171-77.2154000111.9S86 N87 T92 F93 L102S86-L90 WeakPolarHBondContact O-CD1 3.37Å; S86-L90 WeakPolarHBondContact O-CG 3.43Å; S86-L90 PolarHBondContact O-N 2.8Å; N87-L90 WeakPolarHBondContact O-CB 3.46Å; N87-L90 PolarHBondContact O-N 3.43Å; L90-T92 VanDerWaalsContact C-N 3.31Å; L90-T92 PolarHBondContact O-N 3.4Å; L90-F93 CarbonylContact O-C 3.55Å; L90-F93 PolarHBondContact O-N 3.2Å; L90-L102 VanDerWaalsContact CD1-O 3.26Å; L90-L102 WeakPolarHBondContact CD1-O 3.46Å; L90-L102 WeakPolarHBondContact CD2-O 3.27Å
91L80Confident80.6Confident57 Ų5766.7 Ų66.730%0.29832%0.321SS..Hα-helixtrans-64.3-35.9176.8-72.3172000112.4N87 E88 G343N87-L91 WeakPolarHBondContact O-CG 3.4Å; N87-L91 PolarHBondContact O-N 3.48Å; E88-L91 PolarHBondContact O-N 3.22Å; L91-G343 WeakPolarHBondContact CD2-O 3.46Å
92T81.1Confident79.8Confident82 Ų8268.4 Ų68.450%0.50333%0.329SS..Hα-helixtrans-76.1-32.7-178-53.10000112.3E88 V89 L90 P94E88-T92 WeakPolarHBondContact O-CB 2.96Å; E88-T92 PolarHBondContact O-N 2.82Å; E88-T92 PolarHBondContact O-OG1 2.86Å; V89-T92 PolarHBondContact O-N 2.91Å; L90-T92 VanDerWaalsContact C-N 3.31Å; L90-T92 PolarHBondContact O-N 3.4Å; T92-P94 VanDerWaalsContact C-CD 3.5Å; T92-P94 WeakPolarHBondContact O-CD 3.49Å
93F81.2Confident79.2Confident114 Ų11468.2 Ų68.250%0.533%0.329SS..  trans-127.365.6-175.4-60.3-74.3000113.1V89 L90 H95 S96 M99V89-F93 HydrophobicContact CG1-CD2 4.47Å; V89-F93 PolarHBondContact O-N 3.23Å; V89-F93 VanDerWaalsContact O-N 3.08Å; L90-F93 CarbonylContact O-C 3.55Å; L90-F93 PolarHBondContact O-N 3.2Å; F93-H95 VanDerWaalsContact C-N 3.28Å; F93-H95 PolarHBondContact O-N 2.85Å; F93-S96 PolarHBondContact O-N 2.97Å; F93-M99 HydrophobicContact CB-CB 4.44Å; F93-M99 HydrophobicContact CD2-CE 4.25Å
94P76.6Confident78.7Confident75 Ų7569.2 Ų69.249%0.48734%0.339SS..THydrogen-bonded Turntrans-65.1-29.1-174.225.4-34.6000113.6T92 Q100T92-P94 VanDerWaalsContact C-CD 3.5Å; T92-P94 WeakPolarHBondContact O-CD 3.49Å; P94-Q100 PolarHBondContact O-NE2 2.94Å
95H74.1Confident78.4Confident177 Ų17772 Ų7282%0.81936%0.358SS*.THydrogen-bonded Turntrans-97.2-0.3-172.9-64.1-57.5000115.1F93F93-H95 VanDerWaalsContact C-N 3.28Å; F93-H95 PolarHBondContact O-N 2.85Å
96S82Confident78.3Confident42 Ų4268.5 Ų68.529%0.29434%0.34SS..  trans-88.3124.4-178.487.90000111.4F93 Y98 M99 Q100F93-S96 PolarHBondContact O-N 2.97Å; S96-Y98 VanDerWaalsContact C-N 3.28Å; S96-Y98 PolarHBondContact O-N 3.3Å; S96-M99 PolarHBondContact O-N 2.9Å; S96-M99 WeakPolarHBondContact OG-CB 3.34Å; S96-M99 PolarHBondContact OG-N 2.93Å; S96-Q100 WeakPolarHBondContact O-CG 3.41Å; S96-Q100 PolarHBondContact O-N 3.28Å
97Y74.3Confident78.2Confident158 Ų15868.4 Ų68.462%0.6234%0.339SS*.THydrogen-bonded Turntrans-59.3-38.1-179.1179.3-101.2000112.8Q100 W101Y97-Q100 PolarHBondContact O-N 2.87Å; Y97-W101 AromaticContact CD1-NE1 3.98Å; Y97-W101 HydrophobicContact CE1-CZ2 4.42Å; Y97-W101 AromaticContact CE1-NE1 3.44Å; Y97-W101 AromaticContact CZ-NE1 3.8Å
98Y74.7Confident78.1Confident193 Ų19371.2 Ų71.276%0.75735%0.352SS*.THydrogen-bonded Turntrans-69.9-34.5179.7-66-71.3000112.8S96 Q100 W101S96-Y98 VanDerWaalsContact C-N 3.28Å; S96-Y98 PolarHBondContact O-N 3.3Å; Y98-Q100 VanDerWaalsContact C-N 3.33Å; Y98-W101 VanDerWaalsContact O-CB 3.32Å; Y98-W101 WeakPolarHBondContact O-CB 3.18Å; Y98-W101 PolarHBondContact O-N 3.36Å
99M77Confident78Confident55 Ų5571.7 Ų71.727%0.27136%0.361SS..G310 helixtrans-76.5-25.1179.3-154.663.97900112.7V89 F93 S96 W101 L102V89-M99 HydrophobicContact CB-SD 4.47Å; V89-M99 HydrophobicContact CG1-CE 3.16Å; V89-M99 HydrophobicContact CG1-CG 3.56Å; V89-M99 HydrophobicContact CG1-SD 3.12Å; V89-M99 WeakPolarHBondContact CG1-SD 3.29Å; F93-M99 HydrophobicContact CB-CB 4.44Å; F93-M99 HydrophobicContact CD2-CE 4.25Å; S96-M99 PolarHBondContact O-N 2.9Å; S96-M99 WeakPolarHBondContact OG-CB 3.34Å; S96-M99 PolarHBondContact OG-N 2.93Å; M99-W101 PolarHBondContact O-N 3.29Å; M99-W101 VanDerWaalsContact O-N 3.14Å; M99-L102 VanDerWaalsContact O-CB 3.28Å; M99-L102 WeakPolarHBondContact O-CB 3.33Å; M99-L102 PolarHBondContact O-N 2.94Å; M99-L102 HydrophobicContact SD-CD2 4.37Å
100Q70.6Confident78.1Confident89 Ų8970.3 Ų70.342%0.41635%0.352SS..G310 helixtrans-68.1-2.8169-66.7171.71.200113.2P94 S96 Y97 Y98 L102 N103P94-Q100 PolarHBondContact O-NE2 2.94Å; S96-Q100 WeakPolarHBondContact O-CG 3.41Å; S96-Q100 PolarHBondContact O-N 3.28Å; Y97-Q100 PolarHBondContact O-N 2.87Å; Y98-Q100 VanDerWaalsContact C-N 3.33Å; Q100-L102 VanDerWaalsContact C-N 3.3Å; Q100-N103 PolarHBondContact O-ND2 2.9Å; Q100-N103 PolarHBondContact O-OD1 3.45Å
101W74.1Confident78.2Confident106 Ų10669 Ų6940%0.40234%0.344SS..G310 helixtrans-76.3-24.3167.6-7432.3000111.9R18 Y97 Y98 M99 N103R18-W101 HydrophobicContact CG-CE3 3.97Å; R18-W101 HydrophobicContact CG-CZ3 4.14Å; Y97-W101 AromaticContact CD1-NE1 3.98Å; Y97-W101 HydrophobicContact CE1-CZ2 4.42Å; Y97-W101 AromaticContact CE1-NE1 3.44Å; Y97-W101 AromaticContact CZ-NE1 3.8Å; Y98-W101 VanDerWaalsContact O-CB 3.32Å; Y98-W101 WeakPolarHBondContact O-CB 3.18Å; Y98-W101 PolarHBondContact O-N 3.36Å; M99-W101 PolarHBondContact O-N 3.29Å; M99-W101 VanDerWaalsContact O-N 3.14Å; W101-N103 PolarHBondContact O-N 3.48Å
102L73.1Confident78.4Confident42 Ų4271.2 Ų71.222%0.2236%0.357CS..SBendtrans-8265.8177.6-16373000109.3S86 L90 M99 Q100 L106S86-L102 VanDerWaalsContact CA-CD2 3.43Å; S86-L102 WeakPolarHBondContact OG-CD2 3.38Å; L90-L102 VanDerWaalsContact CD1-O 3.26Å; L90-L102 WeakPolarHBondContact CD1-O 3.46Å; L90-L102 WeakPolarHBondContact CD2-O 3.27Å; M99-L102 VanDerWaalsContact O-CB 3.28Å; M99-L102 WeakPolarHBondContact O-CB 3.33Å; M99-L102 PolarHBondContact O-N 2.94Å; M99-L102 HydrophobicContact SD-CD2 4.37Å; Q100-L102 VanDerWaalsContact C-N 3.3Å; L102-L106 HydrophobicContact CD1-CD2 4.31Å
103N74.7Confident78.7Confident54 Ų5469.8 Ų69.829%0.28935%0.346SS..  trans-86.7160.7-175.6-72.9-33.8000113Q100 W101 S105 L106 I107Q100-N103 PolarHBondContact O-ND2 2.9Å; Q100-N103 PolarHBondContact O-OD1 3.45Å; W101-N103 PolarHBondContact O-N 3.48Å; N103-S105 PolarHBondContact O-N 3.01Å; N103-L106 WeakPolarHBondContact O-CB 3.31Å; N103-L106 PolarHBondContact O-N 3.46Å; N103-L106 VanDerWaalsContact O-N 3.07Å; N103-I107 PolarHBondContact O-N 2.88Å
104G74.3Confident79Confident21 Ų2164.7 Ų64.722%0.21632%0.324CS..Hα-helixtrans-58.7-32.517300000113.7L106 I107 H108G104-L106 VanDerWaalsContact C-N 3.32Å; G104-L106 PolarHBondContact O-N 3.28Å; G104-I107 PolarHBondContact O-N 3.36Å; G104-H108 PolarHBondContact O-CD2 3.49Å; G104-H108 VanDerWaalsContact O-CD2 3.27Å; G104-H108 PolarHBondContact O-N 2.89Å
105S78.4Confident79.3Confident59 Ų5963.9 Ų63.941%0.41331%0.313SS..Hα-helixtrans-61.5-38.8174.266.40000112.8E19 N103 G109E19-S105 WeakPolarHBondContact OE1-CB 3.41Å; E19-S105 PolarHBondContact OE1-OG 3.18Å; N103-S105 PolarHBondContact O-N 3.01Å; S105-G109 PolarHBondContact O-N 3.32Å
106L82.2Confident79.8Confident14 Ų1460.6 Ų60.67%0.07330%0.301CS..Hα-helixtrans-65.3-45.7176.1176.572.6000110.6E19 I22 L102 N103 G104 G109 L110E19-L106 HydrophobicContact CB-CD1 3.91Å; E19-L106 HydrophobicContact CG-CB 4.16Å; E19-L106 HydrophobicContact CG-CD1 3.74Å; I22-L106 HydrophobicContact CB-CD1 4.3Å; I22-L106 HydrophobicContact CD1-CD1 4.36Å; I22-L106 HydrophobicContact CD1-CD2 4.14Å; I22-L106 HydrophobicContact CG2-CD1 4.34Å; I22-L106 HydrophobicContact CG2-CD2 4.4Å; L102-L106 HydrophobicContact CD1-CD2 4.31Å; N103-L106 WeakPolarHBondContact O-CB 3.31Å; N103-L106 PolarHBondContact O-N 3.46Å; N103-L106 VanDerWaalsContact O-N 3.07Å; G104-L106 VanDerWaalsContact C-N 3.32Å; G104-L106 PolarHBondContact O-N 3.28Å; L106-G109 PolarHBondContact O-N 3.07Å; L106-L110 WeakPolarHBondContact O-CB 3.44Å; L106-L110 PolarHBondContact O-N 3.36Å
107I82.6Confident80.2Confident5 Ų561 Ų613%0.02630%0.297CS..Hα-helixtrans-63.9-49-179.6-59.9172.1000109.6S83 N103 G104 G109 L110 W111 L342 L422S83-I107 VanDerWaalsContact OG-CG2 3.29Å; S83-I107 WeakPolarHBondContact OG-CG2 3.13Å; N103-I107 PolarHBondContact O-N 2.88Å; G104-I107 PolarHBondContact O-N 3.36Å; I107-G109 VanDerWaalsContact C-N 3.32Å; I107-G109 PolarHBondContact O-N 3.45Å; I107-L110 WeakPolarHBondContact O-CB 3.25Å; I107-L110 PolarHBondContact O-N 2.96Å; I107-L110 VanDerWaalsContact O-N 3.13Å; I107-W111 VanDerWaalsContact O-CD1 3.24Å; I107-W111 PolarHBondContact O-N 3.01Å; I107-L342 HydrophobicContact CD1-CD2 3.97Å; I107-L422 HydrophobicContact CB-CD2 4.1Å; I107-L422 HydrophobicContact CG2-CD2 3.6Å
108H80.6Confident80.9Confident59 Ų5953.7 Ų53.727%0.27327%0.27SS..Hα-helixtrans-57.9-42.9174.2-83.9-70.7000112.7G104 L110 W111 N112 L422G104-H108 PolarHBondContact O-CD2 3.49Å; G104-H108 VanDerWaalsContact O-CD2 3.27Å; G104-H108 PolarHBondContact O-N 2.89Å; H108-L110 VanDerWaalsContact C-N 3.31Å; H108-L110 PolarHBondContact O-N 3.36Å; H108-W111 PolarHBondContact O-N 2.89Å; H108-N112 PolarHBondContact O-N 3.39Å; H108-L422 WeakPolarHBondContact CE1-CG 3.35Å; H108-L422 WeakPolarHBondContact NE2-CD2 3.24Å
109G81.8Confident81.5Confident24 Ų2445.7 Ų45.725%0.24724%0.24CC..Hα-helixtrans-58.9-41.9174.800000112.4S105 L106 I107 N112 L113S105-G109 PolarHBondContact O-N 3.32Å; L106-G109 PolarHBondContact O-N 3.07Å; I107-G109 VanDerWaalsContact C-N 3.32Å; I107-G109 PolarHBondContact O-N 3.45Å; G109-N112 PolarHBondContact O-N 3.18Å; G109-L113 VanDerWaalsContact O-CB 3.29Å; G109-L113 WeakPolarHBondContact O-CB 3.07Å; G109-L113 PolarHBondContact O-N 3.47Å
110L84.9Confident82Confident17 Ų1746.4 Ų46.49%0.08924%0.244CC..Hα-helixtrans-66.1-41.4177.1-167.969.8000111.7L79 L106 I107 H108 L113 V114L79-L110 HydrophobicContact CD1-CB 4.02Å; L79-L110 HydrophobicContact CD1-CD2 3.39Å; L79-L110 HydrophobicContact CD1-CG 3.47Å; L79-L110 VanDerWaalsContact CD1-CG 3.47Å; L106-L110 WeakPolarHBondContact O-CB 3.44Å; L106-L110 PolarHBondContact O-N 3.36Å; I107-L110 WeakPolarHBondContact O-CB 3.25Å; I107-L110 PolarHBondContact O-N 2.96Å; I107-L110 VanDerWaalsContact O-N 3.13Å; H108-L110 VanDerWaalsContact C-N 3.31Å; H108-L110 PolarHBondContact O-N 3.36Å; L110-L113 PolarHBondContact O-N 3.44Å; L110-V114 WeakPolarHBondContact O-CB 3.34Å; L110-V114 VanDerWaalsContact O-CG2 3.27Å; L110-V114 WeakPolarHBondContact O-CG2 3.38Å; L110-V114 PolarHBondContact O-N 3.31Å
111W84.6Confident83Confident5 Ų542.1 Ų42.12%0.01923%0.225CC..Hα-helixtrans-59.1-48.1173.6-84.590.7000112.3L79 L80 S83 I107 H108 L113 V114 F115 P409 F426L79-W111 HydrophobicContact CB-CZ2 4.47Å; L79-W111 HydrophobicContact CD1-CG 4.32Å; L79-W111 HydrophobicContact CD2-CB 4.37Å; L79-W111 HydrophobicContact CD2-CD2 3.25Å; L79-W111 VanDerWaalsContact CD2-CE2 3.48Å; L79-W111 HydrophobicContact CD2-CE3 3.39Å; L79-W111 HydrophobicContact CD2-CG 3.72Å; L79-W111 HydrophobicContact CD2-CH2 3.89Å; L79-W111 HydrophobicContact CD2-CZ2 3.81Å; L79-W111 HydrophobicContact CD2-CZ3 3.71Å; L79-W111 HydrophobicContact CG-CD2 3.79Å; L79-W111 VanDerWaalsContact CG-CE2 3.49Å; L79-W111 HydrophobicContact CG-CE3 4.33Å; L79-W111 HydrophobicContact CG-CG 4.1Å; L79-W111 HydrophobicContact CG-CH2 4.29Å; L79-W111 HydrophobicContact CG-CZ2 3.78Å; L80-W111 HydrophobicContact CB-CH2 4.29Å; L80-W111 HydrophobicContact CB-CZ2 4.11Å; L80-W111 HydrophobicContact CD1-CH2 4.4Å; L80-W111 HydrophobicContact CG-CZ2 4.39Å; S83-W111 PolarHBondContact OG-NE1 3.04Å; S83-W111 VanDerWaalsContact OG-NE1 3.1Å; I107-W111 VanDerWaalsContact O-CD1 3.24Å; I107-W111 PolarHBondContact O-N 3.01Å; H108-W111 PolarHBondContact O-N 2.89Å; W111-L113 VanDerWaalsContact C-N 3.34Å; W111-L113 PolarHBondContact O-N 3.35Å; W111-V114 PolarHBondContact O-N 3.27Å; W111-F115 WeakPolarHBondContact O-CB 3.32Å; W111-F115 PolarHBondContact O-N 3.44Å; W111-P409 HydrophobicContact CH2-CB 3.62Å; W111-P409 HydrophobicContact CH2-CG 3.51Å; W111-P409 HydrophobicContact CZ3-CB 3.84Å; W111-P409 HydrophobicContact CZ3-CG 3.68Å; W111-F426 HydrophobicContact CE3-CE2 4.17Å; W111-F426 HydrophobicContact CE3-CZ 4.4Å
112N84Confident83.7Confident105 Ų10538.6 Ų38.656%0.56121%0.213SC*.Hα-helixtrans-64.2-40179-70.5-11.8000112.1H108 G109 F115 L116H108-N112 PolarHBondContact O-N 3.39Å; G109-N112 PolarHBondContact O-N 3.18Å; N112-F115 PolarHBondContact O-N 2.91Å; N112-L116 WeakPolarHBondContact O-CB 3.37Å; N112-L116 PolarHBondContact O-N 2.97Å
113L86.3Confident84.3Confident51 Ų5139.9 Ų39.927%0.26722%0.223SC..Hα-helixtrans-66.6-44.3178.2179.6144.6000111.9C23 G109 L110 W111 F115 L116 F117C23-L113 HydrophobicContact CB-CD1 4.29Å; G109-L113 VanDerWaalsContact O-CB 3.29Å; G109-L113 WeakPolarHBondContact O-CB 3.07Å; G109-L113 PolarHBondContact O-N 3.47Å; L110-L113 PolarHBondContact O-N 3.44Å; W111-L113 VanDerWaalsContact C-N 3.34Å; W111-L113 PolarHBondContact O-N 3.35Å; L113-F115 VanDerWaalsContact C-N 3.34Å; L113-L116 PolarHBondContact O-N 3.39Å; L113-F117 HydrophobicContact CD1-CE2 3.96Å; L113-F117 HydrophobicContact CD2-CD2 3.49Å; L113-F117 VanDerWaalsContact CD2-CD2 3.49Å; L113-F117 HydrophobicContact CD2-CE2 3.46Å; L113-F117 VanDerWaalsContact CD2-CE2 3.46Å; L113-F117 HydrophobicContact CG-CD2 3.79Å; L113-F117 HydrophobicContact CG-CE2 3.5Å; L113-F117 VanDerWaalsContact CG-CE2 3.5Å; L113-F117 HydrophobicContact CG-CZ 4.29Å; L113-F117 WeakPolarHBondContact O-CB 3.32Å; L113-F117 WeakPolarHBondContact O-CD2 3.5Å; L113-F117 WeakPolarHBondContact O-CG 3.34Å; L113-F117 PolarHBondContact O-N 3.35Å
114V87.9Confident84.9Confident8 Ų841.7 Ų41.75%0.04823%0.228CC..Hα-helixtrans-65.1-39.7176171.90000111.1C75 A76 L79 L110 W111 F117 S118C75-V114 HydrophobicContact CB-CG2 4.22Å; C75-V114 WeakPolarHBondContact SG-CG2 3.17Å; A76-V114 HydrophobicContact CB-CG1 3.68Å; L79-V114 HydrophobicContact CD1-CG2 4.43Å; L79-V114 HydrophobicContact CD2-CB 4.18Å; L79-V114 HydrophobicContact CD2-CG1 4.24Å; L79-V114 HydrophobicContact CD2-CG2 4.36Å; L110-V114 WeakPolarHBondContact O-CB 3.34Å; L110-V114 VanDerWaalsContact O-CG2 3.27Å; L110-V114 WeakPolarHBondContact O-CG2 3.38Å; L110-V114 PolarHBondContact O-N 3.31Å; W111-V114 PolarHBondContact O-N 3.27Å; V114-F117 PolarHBondContact O-N 3.06Å; V114-S118 WeakPolarHBondContact O-CB 3.36Å; V114-S118 PolarHBondContact O-N 3.43Å; V114-S118 PolarHBondContact O-OG 3.49Å
115F82.6Confident85.8Confident58 Ų5842.3 Ų42.325%0.25423%0.226SC..Hα-helixtrans-61.2-50.2174.7177-104.7000111.8W111 N112 L113 F117 S118 N119 Y195 F426W111-F115 WeakPolarHBondContact O-CB 3.32Å; W111-F115 PolarHBondContact O-N 3.44Å; N112-F115 PolarHBondContact O-N 2.91Å; L113-F115 VanDerWaalsContact C-N 3.34Å; F115-F117 PolarHBondContact O-N 2.78Å; F115-S118 WeakPolarHBondContact CA-OG 3.34Å; F115-S118 PolarHBondContact O-N 3.1Å; F115-S118 PolarHBondContact O-OG 3.36Å; F115-N119 WeakPolarHBondContact CD2-ND2 3.36Å; F115-N119 VanDerWaalsContact CE1-ND2 3.27Å; F115-N119 WeakPolarHBondContact CE1-ND2 3.47Å; F115-N119 WeakPolarHBondContact CE2-ND2 3.45Å; F115-N119 WeakPolarHBondContact CZ-ND2 3.35Å; F115-N119 WeakPolarHBondContact O-CB 3.28Å; F115-N119 PolarHBondContact O-N 3.32Å; F115-N119 PolarHBondContact O-ND2 3.43Å; F115-Y195 HydrophobicContact CE2-CD1 4.24Å; F115-Y195 HydrophobicContact CE2-CD2 4.46Å; F115-Y195 AromaticContact CE2-CE1 3.76Å; F115-Y195 HydrophobicContact CE2-CE1 3.76Å; F115-Y195 AromaticContact CE2-CE2 3.99Å; F115-Y195 HydrophobicContact CE2-CE2 3.99Å; F115-Y195 AromaticContact CE2-CZ 3.57Å; F115-F426 HydrophobicContact CB-CE2 4.16Å; F115-F426 HydrophobicContact CB-CZ 4.03Å; F115-F426 AromaticContact CD2-CE1 3.83Å; F115-F426 HydrophobicContact CD2-CE1 3.83Å; F115-F426 AromaticContact CD2-CE2 3.78Å; F115-F426 HydrophobicContact CD2-CE2 3.78Å; F115-F426 AromaticContact CD2-CZ 3.38Å; F115-F426 HydrophobicContact CD2-CZ 3.38Å; F115-F426 HydrophobicContact CE2-CE1 4.25Å; F115-F426 HydrophobicContact CE2-CE2 4.47Å; F115-F426 HydrophobicContact CE2-CZ 4.16Å; F115-F426 HydrophobicContact CG-CE2 4.18Å; F115-F426 HydrophobicContact CG-CZ 4.07Å
116L85.3Confident86.5Confident108 Ų10839.8 Ų39.857%0.56521%0.208SC*.Hα-helixtrans-57.1-49.6177.2-179.468.9000111.2N112 L113 N119 L120N112-L116 WeakPolarHBondContact O-CB 3.37Å; N112-L116 PolarHBondContact O-N 2.97Å; L113-L116 PolarHBondContact O-N 3.39Å; L116-N119 PolarHBondContact O-N 2.97Å; L116-L120 VanDerWaalsContact O-CB 3.24Å; L116-L120 WeakPolarHBondContact O-CB 3.37Å; L116-L120 PolarHBondContact O-N 3.41Å
117F90Very high87Confident49 Ų4940.5 Ų40.522%0.21521%0.213CC..Hα-helixtrans-71.4-32.7-177.8-69.2-31.7000113.6L27 F68 V72 L113 V114 F115 L120 S121L27-F117 HydrophobicContact CD2-CE2 4.15Å; F68-F117 HydrophobicContact CZ-CB 4.26Å; F68-F117 HydrophobicContact CZ-CD1 4.04Å; F68-F117 HydrophobicContact CZ-CD2 4.36Å; F68-F117 HydrophobicContact CZ-CE1 4.48Å; F68-F117 AromaticContact CZ-CG 4Å; F68-F117 HydrophobicContact CZ-CG 4Å; V72-F117 HydrophobicContact CG1-CB 3.98Å; V72-F117 HydrophobicContact CG2-CB 3.76Å; L113-F117 HydrophobicContact CD1-CE2 3.96Å; L113-F117 HydrophobicContact CD2-CD2 3.49Å; L113-F117 VanDerWaalsContact CD2-CD2 3.49Å; L113-F117 HydrophobicContact CD2-CE2 3.46Å; L113-F117 VanDerWaalsContact CD2-CE2 3.46Å; L113-F117 HydrophobicContact CG-CD2 3.79Å; L113-F117 HydrophobicContact CG-CE2 3.5Å; L113-F117 VanDerWaalsContact CG-CE2 3.5Å; L113-F117 HydrophobicContact CG-CZ 4.29Å; L113-F117 WeakPolarHBondContact O-CB 3.32Å; L113-F117 WeakPolarHBondContact O-CD2 3.5Å; L113-F117 WeakPolarHBondContact O-CG 3.34Å; L113-F117 PolarHBondContact O-N 3.35Å; V114-F117 PolarHBondContact O-N 3.06Å; F115-F117 PolarHBondContact O-N 2.78Å; F117-L120 HydrophobicContact CD1-CD2 4.37Å; F117-S121 WeakPolarHBondContact O-CB 3.38Å; F117-S121 PolarHBondContact O-N 3.19Å; F117-S121 PolarHBondContact O-OG 3.44Å
118S89.3Confident87.5Confident6 Ų642 Ų424%0.04222%0.22CC..Hα-helixtrans-68.1-42.2175.756.70000111.2V114 F115 S121 L122V114-S118 WeakPolarHBondContact O-CB 3.36Å; V114-S118 PolarHBondContact O-N 3.43Å; V114-S118 PolarHBondContact O-OG 3.49Å; F115-S118 WeakPolarHBondContact CA-OG 3.34Å; F115-S118 PolarHBondContact O-N 3.1Å; F115-S118 PolarHBondContact O-OG 3.36Å; S118-S121 PolarHBondContact O-N 3.29Å; S118-L122 VanDerWaalsContact O-CB 3.3Å; S118-L122 WeakPolarHBondContact O-CB 3.47Å; S118-L122 PolarHBondContact O-N 2.81Å
119N86.3Confident88.2Confident24 Ų2439.1 Ų39.113%0.12821%0.207CC..Hα-helixtrans-65.9-46.9174.8-73.2-28.1000112.8F115 L116 S121 L122 V123 Y195F115-N119 WeakPolarHBondContact CD2-ND2 3.36Å; F115-N119 VanDerWaalsContact CE1-ND2 3.27Å; F115-N119 WeakPolarHBondContact CE1-ND2 3.47Å; F115-N119 WeakPolarHBondContact CE2-ND2 3.45Å; F115-N119 WeakPolarHBondContact CZ-ND2 3.35Å; F115-N119 WeakPolarHBondContact O-CB 3.28Å; F115-N119 PolarHBondContact O-N 3.32Å; F115-N119 PolarHBondContact O-ND2 3.43Å; L116-N119 PolarHBondContact O-N 2.97Å; N119-S121 PolarHBondContact O-N 2.96Å; N119-L122 PolarHBondContact O-N 2.69Å; N119-V123 WeakPolarHBondContact O-CB 3.16Å; N119-V123 WeakPolarHBondContact O-CG2 3.46Å; N119-V123 PolarHBondContact O-N 2.94Å; N119-Y195 WeakPolarHBondContact OD1-CD2 3.39Å; N119-Y195 WeakPolarHBondContact OD1-CE2 3.4Å
120L88.4Confident88.7Confident70 Ų7043.2 Ų43.237%0.36622%0.215SC..Hα-helixtrans-56.2-43.2174.3-179.366.7000110.8L116 F117 F124 L125L116-L120 VanDerWaalsContact O-CB 3.24Å; L116-L120 WeakPolarHBondContact O-CB 3.37Å; L116-L120 PolarHBondContact O-N 3.41Å; F117-L120 HydrophobicContact CD1-CD2 4.37Å; L120-F124 HydrophobicContact CD1-CB 4.4Å; L120-F124 HydrophobicContact CD1-CD2 4.01Å; L120-F124 WeakPolarHBondContact O-CB 3.33Å; L120-F124 PolarHBondContact O-N 3.49Å; L120-F124 VanDerWaalsContact O-N 3.09Å; L120-L125 HydrophobicContact CG-CG 4.45Å; L120-L125 PolarHBondContact O-N 3.14Å
121S92.1Very high89.2Confident0 Ų044.4 Ų44.40%022%0.22CC..Iπ-helixtrans-66.2-49.9-179.9-64.80000112.4F117 S118 N119 L125 M126F117-S121 WeakPolarHBondContact O-CB 3.38Å; F117-S121 PolarHBondContact O-N 3.19Å; F117-S121 PolarHBondContact O-OG 3.44Å; S118-S121 PolarHBondContact O-N 3.29Å; N119-S121 PolarHBondContact O-N 2.96Å; S121-L125 PolarHBondContact O-N 2.9Å; S121-M126 VanDerWaalsContact O-CG 3.26Å; S121-M126 WeakPolarHBondContact O-CG 3.41Å; S121-M126 PolarHBondContact O-N 3.48Å
122L88.6Confident89.5Confident31 Ų3144.3 Ų44.316%0.16222%0.22CC..Iπ-helixtrans-70.3-45.6-173.8-165.4162.7000111.8S118 N119 P127 I198 L402 I403S118-L122 VanDerWaalsContact O-CB 3.3Å; S118-L122 WeakPolarHBondContact O-CB 3.47Å; S118-L122 PolarHBondContact O-N 2.81Å; N119-L122 PolarHBondContact O-N 2.69Å; L122-P127 WeakPolarHBondContact O-CD 3.34Å; L122-I198 HydrophobicContact CD1-CG2 3.64Å; L122-I198 HydrophobicContact CD2-CD1 3.81Å; L122-I198 HydrophobicContact CD2-CG2 4.4Å; L122-L402 HydrophobicContact CB-CD2 4.03Å; L122-I403 HydrophobicContact CD1-CG1 3.85Å
123V85.1Confident89.8Confident70 Ų7040.5 Ų40.542%0.42420%0.2SC..Iπ-helixtrans-81.4-39.1-174.5178.80000112.1N119N119-V123 WeakPolarHBondContact O-CB 3.16Å; N119-V123 WeakPolarHBondContact O-CG2 3.46Å; N119-V123 PolarHBondContact O-N 2.94Å
124F88.4Confident90Very high92 Ų9244.3 Ų44.340%0.40422%0.217SC..Iπ-helixtrans-111.4-55.4-172.2-60.2-76.9000113.3L120 M126 F128 L156L120-F124 HydrophobicContact CD1-CB 4.4Å; L120-F124 HydrophobicContact CD1-CD2 4.01Å; L120-F124 WeakPolarHBondContact O-CB 3.33Å; L120-F124 PolarHBondContact O-N 3.49Å; L120-F124 VanDerWaalsContact O-N 3.09Å; F124-M126 PolarHBondContact O-N 2.91Å; F124-F128 WeakPolarHBondContact O-CB 3.49Å; F124-F128 PolarHBondContact O-N 3.45Å; F124-F128 VanDerWaalsContact O-N 3.1Å; F124-L156 HydrophobicContact CD1-CD2 4.43Å
125L92.4Very high90.1Very high33 Ų3344 Ų4417%0.17322%0.215CC..Iπ-helixtrans-66.8-43.4-170.4-60.4178.3000112.7L65 F68 T69 L120 S121 F128 V129L65-L125 HydrophobicContact CD2-CD2 4.29Å; F68-L125 HydrophobicContact CD1-CD1 3.63Å; F68-L125 HydrophobicContact CE1-CD1 3.7Å; T69-L125 HydrophobicContact CG2-CB 4.36Å; T69-L125 HydrophobicContact CG2-CD1 4.34Å; L120-L125 HydrophobicContact CG-CG 4.45Å; L120-L125 PolarHBondContact O-N 3.14Å; S121-L125 PolarHBondContact O-N 2.9Å; L125-F128 PolarHBondContact O-N 3.42Å; L125-V129 WeakPolarHBondContact O-CB 3.01Å; L125-V129 WeakPolarHBondContact O-CG2 3.36Å; L125-V129 PolarHBondContact O-N 3.08Å
126M92.9Very high90.2Very high6 Ų649.4 Ų49.43%0.0324%0.241CC..Hα-helixtrans-70.1-47.2-175-66.8-62.3-150.700113.9T69 S121 F124 F128 V129 Y130 I395 C398 V399T69-M126 HydrophobicContact CG2-CE 3.51Å; T69-M126 HydrophobicContact CG2-CG 4.21Å; T69-M126 HydrophobicContact CG2-SD 3.81Å; T69-M126 WeakPolarHBondContact OG1-CE 3.22Å; S121-M126 VanDerWaalsContact O-CG 3.26Å; S121-M126 WeakPolarHBondContact O-CG 3.41Å; S121-M126 PolarHBondContact O-N 3.48Å; F124-M126 PolarHBondContact O-N 2.91Å; M126-F128 VanDerWaalsContact C-N 3.28Å; M126-F128 PolarHBondContact O-N 3.35Å; M126-V129 PolarHBondContact O-N 3.41Å; M126-Y130 PolarHBondContact O-N 2.95Å; M126-I395 HydrophobicContact SD-CG2 4.46Å; M126-C398 HydrophobicContact CE-CB 3.28Å; M126-V399 HydrophobicContact CB-CG2 3.58Å; M126-V399 HydrophobicContact CE-CG2 3.98Å; M126-V399 HydrophobicContact CG-CG2 3.56Å; M126-V399 HydrophobicContact SD-CG2 3.97Å
127P92.8Very high90.1Very high29 Ų2945.3 Ų45.319%0.18823%0.225CC..Hα-helixtrans-63.2-37.4173.2-2235.1000111.6L122 Y130 F131 L156 L159L122-P127 WeakPolarHBondContact O-CD 3.34Å; P127-Y130 PolarHBondContact O-N 3.4Å; P127-F131 HydrophobicContact CB-CE2 4.35Å; P127-F131 WeakPolarHBondContact O-CD2 3.31Å; P127-F131 WeakPolarHBondContact O-CG 3.33Å; P127-F131 PolarHBondContact O-N 3.11Å; P127-L156 HydrophobicContact CB-CD1 3.74Å; P127-L159 HydrophobicContact CB-CD2 3.99Å
128F93.7Very high89.8Confident36 Ų3647.8 Ų47.816%0.15824%0.236CC..Hα-helixtrans-59.3-48.5173.4172.7-101.2000111.9L65 F124 L125 M126 Y130 F131 F132 V149 A152 V153 L156L65-F128 HydrophobicContact CD1-CD1 4.01Å; L65-F128 HydrophobicContact CD1-CE1 3.93Å; F124-F128 WeakPolarHBondContact O-CB 3.49Å; F124-F128 PolarHBondContact O-N 3.45Å; F124-F128 VanDerWaalsContact O-N 3.1Å; L125-F128 PolarHBondContact O-N 3.42Å; M126-F128 VanDerWaalsContact C-N 3.28Å; M126-F128 PolarHBondContact O-N 3.35Å; F128-Y130 VanDerWaalsContact C-N 3.3Å; F128-Y130 PolarHBondContact O-N 3.34Å; F128-F131 PolarHBondContact O-N 2.66Å; F128-F132 HydrophobicContact CE1-CB 4.33Å; F128-F132 HydrophobicContact CE1-CG 4.41Å; F128-F132 HydrophobicContact CE2-CB 4.46Å; F128-F132 HydrophobicContact CZ-CB 4.24Å; F128-F132 HydrophobicContact CZ-CD2 4.37Å; F128-F132 HydrophobicContact CZ-CG 4.21Å; F128-F132 WeakPolarHBondContact O-CB 3.37Å; F128-F132 PolarHBondContact O-N 2.95Å; F128-V149 HydrophobicContact CE2-CG1 4.38Å; F128-V149 HydrophobicContact CZ-CG1 4.44Å; F128-A152 HydrophobicContact CD2-CB 4.2Å; F128-A152 HydrophobicContact CE2-CB 4.04Å; F128-V153 HydrophobicContact CD2-CG2 4.39Å; F128-V153 HydrophobicContact CE2-CG2 4.04Å; F128-L156 HydrophobicContact CB-CD2 4.3Å
129V94.3Very high89.2Confident0 Ų052.9 Ų52.90%028%0.278CS..Hα-helixtrans-59.5-43.6179.1172.50000110.7A62 L65 L125 M126 F132 T133 I395A62-V129 HydrophobicContact CB-CG1 3.8Å; L65-V129 HydrophobicContact CB-CG2 3.4Å; L65-V129 VanDerWaalsContact CB-CG2 3.4Å; L65-V129 HydrophobicContact CD1-CG2 3.46Å; L65-V129 VanDerWaalsContact CD1-CG2 3.46Å; L65-V129 HydrophobicContact CG-CG2 4.06Å; L125-V129 WeakPolarHBondContact O-CB 3.01Å; L125-V129 WeakPolarHBondContact O-CG2 3.36Å; L125-V129 PolarHBondContact O-N 3.08Å; M126-V129 PolarHBondContact O-N 3.41Å; V129-F132 PolarHBondContact O-N 3.35Å; V129-T133 WeakPolarHBondContact O-CG2 3.4Å; V129-T133 PolarHBondContact O-N 3.09Å; V129-T133 PolarHBondContact O-OG1 3.4Å; V129-T133 VanDerWaalsContact O-OG1 3.08Å; V129-I395 HydrophobicContact CG1-CD1 3.61Å; V129-I395 HydrophobicContact CG1-CG1 3.75Å
130Y93.6Very high88.6Confident109 Ų10956 Ų5643%0.42732%0.316SS..Hα-helixtrans-61.3-51.5177.9176.8-102.7000112.3M126 P127 F128 F132 T133 E134M126-Y130 PolarHBondContact O-N 2.95Å; P127-Y130 PolarHBondContact O-N 3.4Å; F128-Y130 VanDerWaalsContact C-N 3.3Å; F128-Y130 PolarHBondContact O-N 3.34Å; Y130-F132 VanDerWaalsContact C-N 3.31Å; Y130-F132 PolarHBondContact O-N 2.95Å; Y130-T133 PolarHBondContact O-N 3.39Å; Y130-T133 PolarHBondContact O-OG1 3.42Å; Y130-E134 PolarHBondContact O-N 2.88Å
131F93.9Very high88Confident43 Ų4355.8 Ų55.819%0.18932%0.32CS..Hα-helixtrans-65.9-35.1178-66.8-49.4000112.5P127 F128 T133 E134 S135 A152 L155 L159P127-F131 HydrophobicContact CB-CE2 4.35Å; P127-F131 WeakPolarHBondContact O-CD2 3.31Å; P127-F131 WeakPolarHBondContact O-CG 3.33Å; P127-F131 PolarHBondContact O-N 3.11Å; F128-F131 PolarHBondContact O-N 2.66Å; F131-T133 VanDerWaalsContact C-N 3.33Å; F131-T133 PolarHBondContact O-N 3.41Å; F131-E134 PolarHBondContact O-N 3.22Å; F131-S135 WeakPolarHBondContact O-CB 3.22Å; F131-S135 PolarHBondContact O-N 3.31Å; F131-S135 PolarHBondContact O-OG 3.03Å; F131-A152 HydrophobicContact CB-CB 3.98Å; F131-L155 HydrophobicContact CB-CB 4.49Å; F131-L155 HydrophobicContact CB-CD1 4.37Å; F131-L155 HydrophobicContact CD1-CB 4.29Å; F131-L155 HydrophobicContact CD1-CD1 4.07Å; F131-L155 HydrophobicContact CD2-CB 4.11Å; F131-L155 HydrophobicContact CE2-CB 4.39Å; F131-L155 HydrophobicContact CG-CB 4.06Å; F131-L155 HydrophobicContact CG-CD1 4.32Å; F131-L159 HydrophobicContact CE2-CB 4.26Å; F131-L159 HydrophobicContact CE2-CD2 3.71Å; F131-L159 HydrophobicContact CZ-CD2 4.01Å
132F92.3Very high87.1Confident2 Ų264.9 Ų64.91%0.00936%0.36CS..Hα-helixtrans-66.5-35.8178179.8-120.3000112.3V58 I61 F128 V129 Y130 E134 S135 V145 R148 V149 A152V58-F132 HydrophobicContact CB-CE1 4.06Å; V58-F132 HydrophobicContact CB-CZ 4.12Å; V58-F132 HydrophobicContact CG1-CD1 3.87Å; V58-F132 HydrophobicContact CG1-CE1 3.61Å; V58-F132 HydrophobicContact CG1-CG 4.44Å; V58-F132 HydrophobicContact CG1-CZ 3.97Å; V58-F132 HydrophobicContact CG2-CE1 4.19Å; V58-F132 HydrophobicContact CG2-CE2 4.22Å; V58-F132 HydrophobicContact CG2-CZ 3.74Å; I61-F132 HydrophobicContact CB-CE1 4.05Å; I61-F132 HydrophobicContact CD1-CE1 4.49Å; I61-F132 HydrophobicContact CD1-CZ 4.35Å; I61-F132 HydrophobicContact CG2-CE1 3.96Å; F128-F132 HydrophobicContact CE1-CB 4.33Å; F128-F132 HydrophobicContact CE1-CG 4.41Å; F128-F132 HydrophobicContact CE2-CB 4.46Å; F128-F132 HydrophobicContact CZ-CB 4.24Å; F128-F132 HydrophobicContact CZ-CD2 4.37Å; F128-F132 HydrophobicContact CZ-CG 4.21Å; F128-F132 WeakPolarHBondContact O-CB 3.37Å; F128-F132 PolarHBondContact O-N 2.95Å; V129-F132 PolarHBondContact O-N 3.35Å; Y130-F132 VanDerWaalsContact C-N 3.31Å; Y130-F132 PolarHBondContact O-N 2.95Å; F132-E134 VanDerWaalsContact C-N 3.34Å; F132-S135 WeakPolarHBondContact CA-OG 3.33Å; F132-S135 PolarHBondContact O-OG 3.24Å; F132-V145 HydrophobicContact CE2-CG1 4.09Å; F132-V145 HydrophobicContact CZ-CG1 3.84Å; F132-R148 HydrophobicContact CD2-CB 4.34Å; F132-R148 HydrophobicContact CE2-CB 4.17Å; F132-V149 HydrophobicContact CD2-CG2 4.04Å; F132-V149 HydrophobicContact CE2-CG2 3.51Å; F132-V149 HydrophobicContact CZ-CG2 4.27Å; F132-A152 HydrophobicContact CB-CB 4.07Å
133T89.8Confident86.4Confident26 Ų2672.3 Ų72.316%0.1639%0.391CS..Hα-helixtrans-72.7-27.4174.751.50000113.3A62 V129 Y130 F131 L391 I395A62-T133 HydrophobicContact CB-CG2 3.66Å; V129-T133 WeakPolarHBondContact O-CG2 3.4Å; V129-T133 PolarHBondContact O-N 3.09Å; V129-T133 PolarHBondContact O-OG1 3.4Å; V129-T133 VanDerWaalsContact O-OG1 3.08Å; Y130-T133 PolarHBondContact O-N 3.39Å; Y130-T133 PolarHBondContact O-OG1 3.42Å; F131-T133 VanDerWaalsContact C-N 3.33Å; F131-T133 PolarHBondContact O-N 3.41Å; T133-L391 HydrophobicContact CG2-CD2 3.43Å; T133-L391 VanDerWaalsContact CG2-CD2 3.43Å; T133-L391 HydrophobicContact CG2-CG 4.33Å; T133-I395 HydrophobicContact CG2-CD1 4.47Å
134E90Very high86.2Confident130 Ų13070 Ų7061%0.60738%0.381SS*.Hα-helixtrans-94.1-18.7-178.9-157.967.6178.100113.4Y130 F131 F132Y130-E134 PolarHBondContact O-N 2.88Å; F131-E134 PolarHBondContact O-N 3.22Å; F132-E134 VanDerWaalsContact C-N 3.34Å
135S89.9Confident86.1Confident3 Ų367.5 Ų67.52%0.02137%0.373CS..  trans-70.1137.3-178.3570000112.7F131 F132 R148 E151F131-S135 WeakPolarHBondContact O-CB 3.22Å; F131-S135 PolarHBondContact O-N 3.31Å; F131-S135 PolarHBondContact O-OG 3.03Å; F132-S135 WeakPolarHBondContact CA-OG 3.33Å; F132-S135 PolarHBondContact O-OG 3.24Å; S135-R148 WeakPolarHBondContact O-CD 3.32Å; S135-R148 WeakPolarHBondContact O-CG 3.23Å; S135-R148 PolarHBondContact O-NE 2.87Å; S135-R148 WeakPolarHBondContact OG-CB 3.38Å; S135-R148 PolarHBondContact OG-O 3.44Å; S135-E151 WeakPolarHBondContact CB-OE2 3.39Å
136E85Confident85.9Confident171 Ų17171.7 Ų71.780%0.79939%0.393SS*.  trans-106.2-16.3174.4-65.2-169.3164.200112.5E151E136-E151 PolarHBondContact N-OE2 2.9Å
137G83.3Confident85.6Confident21 Ų2171.8 Ų71.822%0.21640%0.395CS..  trans102.9151.1-174.500000112.6E151G137-E151 WeakPolarHBondContact CA-OE2 3.46Å; G137-E151 PolarHBondContact N-OE2 3.45Å
138F84.1Confident85.5Confident101 Ų10171.8 Ų71.844%0.44339%0.391SS..  trans-61.2140.8178.6-69.3-67.8000113G140 S141 E151 V154F138-G140 PolarHBondContact O-N 3.45Å; F138-G140 VanDerWaalsContact O-N 3.14Å; F138-S141 WeakPolarHBondContact O-CB 3.29Å; F138-S141 PolarHBondContact O-N 3.33Å; F138-E151 HydrophobicContact CD2-CB 4.36Å; F138-E151 HydrophobicContact CE1-CG 4.37Å; F138-E151 HydrophobicContact CE2-CB 4.04Å; F138-E151 HydrophobicContact CZ-CB 4.18Å; F138-E151 HydrophobicContact CZ-CG 4.3Å; F138-V154 HydrophobicContact CE2-CG2 4.33Å; F138-V154 HydrophobicContact CZ-CB 4.05Å; F138-V154 HydrophobicContact CZ-CG1 4.2Å; F138-V154 HydrophobicContact CZ-CG2 4.1Å
139A77.2Confident85.4Confident113 Ų11371.8 Ų71.893%0.93439%0.394SS*.THydrogen-bonded Turntrans-55.1118176.100000111.1
140G73.6Confident85.2Confident90 Ų9078.8 Ų78.893%0.92842%0.422SS*.THydrogen-bonded Turntrans96.4-5.2-178.800000115.5F138F138-G140 PolarHBondContact O-N 3.45Å; F138-G140 VanDerWaalsContact O-N 3.14Å
141S74.6Confident85.2Confident65 Ų6575.6 Ų75.646%0.45541%0.411SS..SBendtrans-76150.5169.8-1770000111.2F138 K143 A147F138-S141 WeakPolarHBondContact O-CB 3.29Å; F138-S141 PolarHBondContact O-N 3.33Å; S141-K143 PolarHBondContact O-N 3.01Å; S141-A147 WeakPolarHBondContact OG-CB 3.36Å
142K73.1Confident85.1Confident191 Ų19173.5 Ų73.583%0.8340%0.402SS*.PPolyproline II helixtrans-58.2132166.7-67.7-176.8179.4-179.70108.3G144K142-G144 PolarHBondContact O-N 3.5Å
143K74.1Confident85.2Confident188 Ų18876 Ų7682%0.81742%0.417SS*.SBendtrans-56.2135.9171.6-69.5-170.2173.2-167.90109.1S141S141-K143 PolarHBondContact O-N 3.01Å
144G81.3Confident85.3Confident20 Ų2078.4 Ų78.421%0.20643%0.431CS..SBendtrans160.2156.4-178.300000112.5E54 K142 M146 A147E54-G144 PolarHBondContact OE2-N 2.84Å; K142-G144 PolarHBondContact O-N 3.5Å; G144-M146 PolarHBondContact O-N 2.97Å; G144-A147 WeakPolarHBondContact O-CB 3.3Å; G144-A147 PolarHBondContact O-N 3.37Å
145V86.1Confident85.5Confident41 Ų4175 Ų7525%0.24842%0.417CS..Hα-helixtrans-55.8-37.8-177.1-175.50000112.2T57 V58 I61 F132 A147 R148 V149T57-V145 WeakPolarHBondContact OG1-CG2 3.44Å; V58-V145 HydrophobicContact CG2-CG1 4.43Å; I61-V145 HydrophobicContact CD1-CG1 4.5Å; F132-V145 HydrophobicContact CE2-CG1 4.09Å; F132-V145 HydrophobicContact CZ-CG1 3.84Å; V145-A147 VanDerWaalsContact C-N 3.33Å; V145-A147 PolarHBondContact O-N 3.22Å; V145-R148 WeakPolarHBondContact O-CB 3.32Å; V145-R148 PolarHBondContact O-N 2.92Å; V145-V149 WeakPolarHBondContact O-CG2 3.48Å; V145-V149 PolarHBondContact O-N 2.94Å
146M87.9Confident85.6Confident120 Ų12076.2 Ų76.259%0.59142%0.423SS*.Hα-helixtrans-65.6-33.2-180-66.6-60.8-78.400112.9G144 R148 V149 Y150G144-M146 PolarHBondContact O-N 2.97Å; M146-R148 VanDerWaalsContact C-N 3.33Å; M146-V149 PolarHBondContact O-N 3.21Å; M146-Y150 HydrophobicContact CB-CE2 4.23Å; M146-Y150 WeakPolarHBondContact O-CD2 3.4Å; M146-Y150 PolarHBondContact O-N 2.97Å
147A88.2Confident85.9Confident9 Ų972.8 Ų72.87%0.07441%0.409CS..Hα-helixtrans-65-40.4176.900000111.5S141 G144 V145 Y150 E151S141-A147 WeakPolarHBondContact OG-CB 3.36Å; G144-A147 WeakPolarHBondContact O-CB 3.3Å; G144-A147 PolarHBondContact O-N 3.37Å; V145-A147 VanDerWaalsContact C-N 3.33Å; V145-A147 PolarHBondContact O-N 3.22Å; A147-Y150 PolarHBondContact O-N 3.33Å; A147-E151 PolarHBondContact O-N 2.87Å; A147-E151 VanDerWaalsContact O-N 3.07Å
148R89.3Confident86.3Confident28 Ų2877.1 Ų77.111%0.10643%0.427CS..Hα-helixtrans-64.2-42.1173-68.5-172.9-177.5-168.711.2112.3D55 F132 S135 V145 M146 Y150 E151 A152D55-R148 IonicContact OD1-CZ 3.48Å; D55-R148 IonicContact OD1-NH1 3.58Å; D55-R148 PolarHBondContact OD1-NH1 3.49Å; D55-R148 IonicContact OD1-NH2 3.75Å; D55-R148 PolarHBondContact OD1-NH2 3.03Å; F132-R148 HydrophobicContact CD2-CB 4.34Å; F132-R148 HydrophobicContact CE2-CB 4.17Å; S135-R148 WeakPolarHBondContact O-CD 3.32Å; S135-R148 WeakPolarHBondContact O-CG 3.23Å; S135-R148 PolarHBondContact O-NE 2.87Å; S135-R148 WeakPolarHBondContact OG-CB 3.38Å; S135-R148 PolarHBondContact OG-O 3.44Å; V145-R148 WeakPolarHBondContact O-CB 3.32Å; V145-R148 PolarHBondContact O-N 2.92Å; M146-R148 VanDerWaalsContact C-N 3.33Å; R148-Y150 VanDerWaalsContact C-N 3.35Å; R148-Y150 PolarHBondContact O-N 3.1Å; R148-E151 PolarHBondContact O-N 3.34Å; R148-A152 WeakPolarHBondContact O-CB 3.41Å; R148-A152 PolarHBondContact O-N 3.29Å
149V91.4Very high86.6Confident36 Ų3675.1 Ų75.122%0.21842%0.421CS..Hα-helixtrans-59.2-45.8173.7175.40000110.9F128 F132 V145 M146 E151 A152 V153F128-V149 HydrophobicContact CE2-CG1 4.38Å; F128-V149 HydrophobicContact CZ-CG1 4.44Å; F132-V149 HydrophobicContact CD2-CG2 4.04Å; F132-V149 HydrophobicContact CE2-CG2 3.51Å; F132-V149 HydrophobicContact CZ-CG2 4.27Å; V145-V149 WeakPolarHBondContact O-CG2 3.48Å; V145-V149 PolarHBondContact O-N 2.94Å; M146-V149 PolarHBondContact O-N 3.21Å; V149-E151 PolarHBondContact O-N 3.44Å; V149-A152 PolarHBondContact O-N 3.35Å; V149-V153 HydrophobicContact CG1-CG2 4.16Å; V149-V153 WeakPolarHBondContact O-CB 3.39Å; V149-V153 VanDerWaalsContact O-CG2 3.24Å; V149-V153 WeakPolarHBondContact O-CG2 3.23Å; V149-V153 PolarHBondContact O-N 3.47Å
150Y91Very high87Confident147 Ų14771.8 Ų71.858%0.57639%0.393SS*.Hα-helixtrans-61.6-43.9178.2-71-58.8000112.2M146 A147 R148 V153 V154M146-Y150 HydrophobicContact CB-CE2 4.23Å; M146-Y150 WeakPolarHBondContact O-CD2 3.4Å; M146-Y150 PolarHBondContact O-N 2.97Å; A147-Y150 PolarHBondContact O-N 3.33Å; R148-Y150 VanDerWaalsContact C-N 3.35Å; R148-Y150 PolarHBondContact O-N 3.1Å; Y150-V153 PolarHBondContact O-N 3.24Å; Y150-V154 VanDerWaalsContact O-CG2 3.27Å; Y150-V154 WeakPolarHBondContact O-CG2 3.19Å; Y150-V154 PolarHBondContact O-N 2.88Å
151E93.3Very high87.6Confident42 Ų4272.8 Ų72.820%0.19638%0.376CS..Hα-helixtrans-60.1-50.3175-176.4-178.7-17600111.5S135 E136 G137 F138 A147 R148 V149 V153 V154 L155S135-E151 WeakPolarHBondContact CB-OE2 3.39Å; E136-E151 PolarHBondContact N-OE2 2.9Å; G137-E151 WeakPolarHBondContact CA-OE2 3.46Å; G137-E151 PolarHBondContact N-OE2 3.45Å; F138-E151 HydrophobicContact CD2-CB 4.36Å; F138-E151 HydrophobicContact CE1-CG 4.37Å; F138-E151 HydrophobicContact CE2-CB 4.04Å; F138-E151 HydrophobicContact CZ-CB 4.18Å; F138-E151 HydrophobicContact CZ-CG 4.3Å; A147-E151 PolarHBondContact O-N 2.87Å; A147-E151 VanDerWaalsContact O-N 3.07Å; R148-E151 PolarHBondContact O-N 3.34Å; V149-E151 PolarHBondContact O-N 3.44Å; E151-V153 VanDerWaalsContact C-N 3.32Å; E151-V153 PolarHBondContact O-N 2.98Å; E151-V154 PolarHBondContact O-N 3.46Å; E151-L155 HydrophobicContact CG-CD1 4.12Å; E151-L155 HydrophobicContact CG-CG 4.49Å; E151-L155 WeakPolarHBondContact O-CG 3.33Å; E151-L155 PolarHBondContact O-N 3.26Å
152A92.8Very high88.4Confident0 Ų074.8 Ų74.80%038%0.381CS..Hα-helixtrans-60.8-39.418000000112.6F128 F131 F132 R148 V149 L155 L156F128-A152 HydrophobicContact CD2-CB 4.2Å; F128-A152 HydrophobicContact CE2-CB 4.04Å; F131-A152 HydrophobicContact CB-CB 3.98Å; F132-A152 HydrophobicContact CB-CB 4.07Å; R148-A152 WeakPolarHBondContact O-CB 3.41Å; R148-A152 PolarHBondContact O-N 3.29Å; V149-A152 PolarHBondContact O-N 3.35Å; A152-L155 PolarHBondContact O-N 3.11Å; A152-L156 VanDerWaalsContact O-CB 3.31Å; A152-L156 WeakPolarHBondContact O-CB 3.37Å; A152-L156 PolarHBondContact O-N 2.84Å
153V92.8Very high88.9Confident55 Ų5568.2 Ų68.233%0.33336%0.357SS..Hα-helixtrans-67.4-41.4176.4170.40000111.3F128 V149 Y150 E151 L156 I157F128-V153 HydrophobicContact CD2-CG2 4.39Å; F128-V153 HydrophobicContact CE2-CG2 4.04Å; V149-V153 HydrophobicContact CG1-CG2 4.16Å; V149-V153 WeakPolarHBondContact O-CB 3.39Å; V149-V153 VanDerWaalsContact O-CG2 3.24Å; V149-V153 WeakPolarHBondContact O-CG2 3.23Å; V149-V153 PolarHBondContact O-N 3.47Å; Y150-V153 PolarHBondContact O-N 3.24Å; E151-V153 VanDerWaalsContact C-N 3.32Å; E151-V153 PolarHBondContact O-N 2.98Å; V153-L156 WeakPolarHBondContact O-CB 3.34Å; V153-L156 PolarHBondContact O-N 3.26Å; V153-I157 HydrophobicContact CG1-CD1 4Å; V153-I157 WeakPolarHBondContact O-CG1 3.45Å; V153-I157 PolarHBondContact O-N 3.08Å
154V93.4Very high89.1Confident75 Ų7561.7 Ų61.746%0.45533%0.331SS..Hα-helixtrans-63.8-44.1176.1170.50000110.7F138 Y150 E151 L156 I157 L158F138-V154 HydrophobicContact CE2-CG2 4.33Å; F138-V154 HydrophobicContact CZ-CB 4.05Å; F138-V154 HydrophobicContact CZ-CG1 4.2Å; F138-V154 HydrophobicContact CZ-CG2 4.1Å; Y150-V154 VanDerWaalsContact O-CG2 3.27Å; Y150-V154 WeakPolarHBondContact O-CG2 3.19Å; Y150-V154 PolarHBondContact O-N 2.88Å; E151-V154 PolarHBondContact O-N 3.46Å; V154-L156 VanDerWaalsContact C-N 3.31Å; V154-L156 PolarHBondContact O-N 2.95Å; V154-I157 PolarHBondContact O-N 2.94Å; V154-L158 WeakPolarHBondContact O-CB 3.48Å; V154-L158 PolarHBondContact O-N 3.19Å
155L93.4Very high89.2Confident60 Ų6062.2 Ų62.231%0.31434%0.336SS..Hα-helixtrans-62-38.8174.6-70.1175.5000112F131 E151 A152 L158 L159F131-L155 HydrophobicContact CB-CB 4.49Å; F131-L155 HydrophobicContact CB-CD1 4.37Å; F131-L155 HydrophobicContact CD1-CB 4.29Å; F131-L155 HydrophobicContact CD1-CD1 4.07Å; F131-L155 HydrophobicContact CD2-CB 4.11Å; F131-L155 HydrophobicContact CE2-CB 4.39Å; F131-L155 HydrophobicContact CG-CB 4.06Å; F131-L155 HydrophobicContact CG-CD1 4.32Å; E151-L155 HydrophobicContact CG-CD1 4.12Å; E151-L155 HydrophobicContact CG-CG 4.49Å; E151-L155 WeakPolarHBondContact O-CG 3.33Å; E151-L155 PolarHBondContact O-N 3.26Å; A152-L155 PolarHBondContact O-N 3.11Å; L155-L158 PolarHBondContact O-N 3.48Å; L155-L159 WeakPolarHBondContact O-CB 3.26Å; L155-L159 PolarHBondContact O-N 3.46Å
156L92.1Very high89.1Confident28 Ų2865.2 Ų65.215%0.14735%0.35CS..Hα-helixtrans-63.6-43.8175.5-175.470.8000111.9F124 P127 F128 A152 V153 V154 L158 L159 A160F124-L156 HydrophobicContact CD1-CD2 4.43Å; P127-L156 HydrophobicContact CB-CD1 3.74Å; F128-L156 HydrophobicContact CB-CD2 4.3Å; A152-L156 VanDerWaalsContact O-CB 3.31Å; A152-L156 WeakPolarHBondContact O-CB 3.37Å; A152-L156 PolarHBondContact O-N 2.84Å; V153-L156 WeakPolarHBondContact O-CB 3.34Å; V153-L156 PolarHBondContact O-N 3.26Å; V154-L156 VanDerWaalsContact C-N 3.31Å; V154-L156 PolarHBondContact O-N 2.95Å; L156-L158 VanDerWaalsContact C-N 3.34Å; L156-L159 PolarHBondContact O-N 3.01Å; L156-A160 WeakPolarHBondContact O-CB 3.48Å; L156-A160 PolarHBondContact O-N 2.87Å
157I90.5Very high88.6Confident98 Ų9860.8 Ų60.850%0.50333%0.329SS..Hα-helixtrans-63.3-43.5176.3-68.5165.6000110.1V153 V154 A160 L161V153-I157 HydrophobicContact CG1-CD1 4Å; V153-I157 WeakPolarHBondContact O-CG1 3.45Å; V153-I157 PolarHBondContact O-N 3.08Å; V154-I157 PolarHBondContact O-N 2.94Å; I157-A160 PolarHBondContact O-N 3.48Å; I157-L161 HydrophobicContact CG2-CD1 4.21Å; I157-L161 WeakPolarHBondContact O-CG 3.29Å; I157-L161 PolarHBondContact O-N 2.9Å
158L92.4Very high88Confident112 Ų11266.3 Ų66.359%0.58635%0.348SS*.Hα-helixtrans-62-44176.9-172.472.6000111.5V154 L155 L156 L161 L162V154-L158 WeakPolarHBondContact O-CB 3.48Å; V154-L158 PolarHBondContact O-N 3.19Å; L155-L158 PolarHBondContact O-N 3.48Å; L156-L158 VanDerWaalsContact C-N 3.34Å; L158-L161 PolarHBondContact O-N 2.92Å; L158-L162 WeakPolarHBondContact O-CB 3.42Å; L158-L162 PolarHBondContact O-N 2.93Å
159L90.5Very high87.7Confident60 Ų6068.5 Ų68.531%0.31437%0.365SS..Hα-helixtrans-61.3-44.4175.1178.566.3000111.2P127 F131 L155 L156 L161 L162 V163P127-L159 HydrophobicContact CB-CD2 3.99Å; F131-L159 HydrophobicContact CE2-CB 4.26Å; F131-L159 HydrophobicContact CE2-CD2 3.71Å; F131-L159 HydrophobicContact CZ-CD2 4.01Å; L155-L159 WeakPolarHBondContact O-CB 3.26Å; L155-L159 PolarHBondContact O-N 3.46Å; L156-L159 PolarHBondContact O-N 3.01Å; L159-L161 PolarHBondContact O-N 3.02Å; L159-L162 WeakPolarHBondContact O-CB 3.38Å; L159-L162 PolarHBondContact O-N 3.41Å; L159-V163 HydrophobicContact CD1-CG2 4.24Å; L159-V163 HydrophobicContact CG-CG2 4.45Å; L159-V163 WeakPolarHBondContact O-CG2 3.38Å; L159-V163 PolarHBondContact O-N 3.25Å
160A85.4Confident87Confident42 Ų4268.8 Ų68.835%0.34737%0.371SS..Hα-helixtrans-60.7-45.8177.600000111.3L156 I157 L162 V163 L164L156-A160 WeakPolarHBondContact O-CB 3.48Å; L156-A160 PolarHBondContact O-N 2.87Å; I157-A160 PolarHBondContact O-N 3.48Å; A160-L162 VanDerWaalsContact C-N 3.33Å; A160-L162 PolarHBondContact O-N 2.72Å; A160-V163 PolarHBondContact O-N 3.49Å; A160-L164 WeakPolarHBondContact O-CB 3.44Å; A160-L164 WeakPolarHBondContact O-CD1 3.45Å; A160-L164 WeakPolarHBondContact O-CG 3.44Å; A160-L164 PolarHBondContact O-N 3.47Å
161L86.6Confident86Confident111 Ų11163.1 Ų63.158%0.58135%0.353SS*.Hα-helixtrans-61.6-40175.4-70.8174.1000112.3I157 L158 L159 G165I157-L161 HydrophobicContact CG2-CD1 4.21Å; I157-L161 WeakPolarHBondContact O-CG 3.29Å; I157-L161 PolarHBondContact O-N 2.9Å; L158-L161 PolarHBondContact O-N 2.92Å; L159-L161 PolarHBondContact O-N 3.02Å; L161-G165 PolarHBondContact O-N 2.89Å
162L89.9Confident85.1Confident107 Ų10762.7 Ų62.756%0.5636%0.357SS*.Hα-helixtrans-62.9-49.8176.1-178.672.6000111.4L158 L159 A160 G165 I166L158-L162 WeakPolarHBondContact O-CB 3.42Å; L158-L162 PolarHBondContact O-N 2.93Å; L159-L162 WeakPolarHBondContact O-CB 3.38Å; L159-L162 PolarHBondContact O-N 3.41Å; A160-L162 VanDerWaalsContact C-N 3.33Å; A160-L162 PolarHBondContact O-N 2.72Å; L162-G165 PolarHBondContact O-N 3.05Å; L162-I166 HydrophobicContact CG-CD1 4.14Å; L162-I166 WeakPolarHBondContact O-CG1 3.48Å; L162-I166 PolarHBondContact O-N 3.31Å
163V84.2Confident84.3Confident54 Ų5469.2 Ų69.233%0.32739%0.391SS..Hα-helixtrans-61.3-46.5179.21710000110.3L159 A160 G165 I166 V167 L194L159-V163 HydrophobicContact CD1-CG2 4.24Å; L159-V163 HydrophobicContact CG-CG2 4.45Å; L159-V163 WeakPolarHBondContact O-CG2 3.38Å; L159-V163 PolarHBondContact O-N 3.25Å; A160-V163 PolarHBondContact O-N 3.49Å; V163-G165 VanDerWaalsContact C-N 3.3Å; V163-G165 PolarHBondContact O-N 3.25Å; V163-I166 PolarHBondContact O-N 3.06Å; V163-V167 HydrophobicContact CG1-CG2 4.4Å; V163-V167 VanDerWaalsContact O-CG2 3.29Å; V163-V167 WeakPolarHBondContact O-CG2 3.36Å; V163-V167 PolarHBondContact O-N 3.11Å; V163-L194 HydrophobicContact CG1-CD1 4.23Å; V163-L194 HydrophobicContact CG1-CD2 3.74Å
164L79.6Confident83.2Confident51 Ų5173.2 Ų73.227%0.26741%0.409SS..Hα-helixtrans-59.6-41.3176-71.4169.3000111.7A160 V167 W168 L186 L194A160-L164 WeakPolarHBondContact O-CB 3.44Å; A160-L164 WeakPolarHBondContact O-CD1 3.45Å; A160-L164 WeakPolarHBondContact O-CG 3.44Å; A160-L164 PolarHBondContact O-N 3.47Å; L164-V167 PolarHBondContact O-N 3.29Å; L164-W168 VanDerWaalsContact O-CB 3.28Å; L164-W168 WeakPolarHBondContact O-CB 3.48Å; L164-W168 PolarHBondContact O-N 3.38Å; L164-L186 HydrophobicContact CB-CD2 4.18Å; L164-L186 HydrophobicContact CD1-CD2 3.64Å; L164-L186 HydrophobicContact CD2-CD2 3.59Å; L164-L186 HydrophobicContact CD2-CG 4.42Å; L164-L186 HydrophobicContact CG-CD2 3.98Å; L164-L194 HydrophobicContact CD2-CD1 4.33Å
165G82Confident81.9Confident31 Ų3174.5 Ų74.532%0.3241%0.41SS..Hα-helixtrans-60.9-43.9174.200000112.8L161 L162 V163 W168 V169L161-G165 PolarHBondContact O-N 2.89Å; L162-G165 PolarHBondContact O-N 3.05Å; V163-G165 VanDerWaalsContact C-N 3.3Å; V163-G165 PolarHBondContact O-N 3.25Å; G165-W168 PolarHBondContact O-N 2.83Å; G165-V169 WeakPolarHBondContact O-CG2 3.06Å; G165-V169 PolarHBondContact O-N 3.37Å
166I83.9Confident80.2Confident103 Ų10378.7 Ų78.753%0.52843%0.433SS..Hα-helixtrans-63.8-45.7177-66.7164.3000110.9L162 V163 W168 V169 A170L162-I166 HydrophobicContact CG-CD1 4.14Å; L162-I166 WeakPolarHBondContact O-CG1 3.48Å; L162-I166 PolarHBondContact O-N 3.31Å; V163-I166 PolarHBondContact O-N 3.06Å; I166-W168 VanDerWaalsContact C-N 3.3Å; I166-W168 PolarHBondContact O-N 2.86Å; I166-V169 PolarHBondContact O-N 3.14Å; I166-A170 WeakPolarHBondContact O-CB 3.12Å; I166-A170 PolarHBondContact O-N 3.49Å
167V77.6Confident78.4Confident27 Ų2785 Ų8516%0.16447%0.467CS..Hα-helixtrans-64.8-38.5179-175.50000110.6V163 L164 A170 S171 Y190 L194V163-V167 HydrophobicContact CG1-CG2 4.4Å; V163-V167 VanDerWaalsContact O-CG2 3.29Å; V163-V167 WeakPolarHBondContact O-CG2 3.36Å; V163-V167 PolarHBondContact O-N 3.11Å; L164-V167 PolarHBondContact O-N 3.29Å; V167-A170 PolarHBondContact O-N 3.26Å; V167-S171 WeakPolarHBondContact O-CB 3.33Å; V167-S171 PolarHBondContact O-N 3.06Å; V167-S171 PolarHBondContact O-OG 3.29Å; V167-Y190 HydrophobicContact CB-CD1 4.33Å; V167-Y190 HydrophobicContact CG1-CD1 3.67Å; V167-Y190 HydrophobicContact CG1-CE1 4.39Å; V167-L194 HydrophobicContact CG2-CD1 4.28Å; V167-L194 HydrophobicContact CG2-CD2 3.44Å; V167-L194 VanDerWaalsContact CG2-CD2 3.44Å; V167-L194 HydrophobicContact CG2-CG 3.79Å
168W76.9Confident76.7Confident125 Ų12584.8 Ų84.847%0.47347%0.47SS..Hα-helixtrans-62.3-42.9174.7-178.679.9000112.6L164 G165 I166 S171 A172 Y190L164-W168 VanDerWaalsContact O-CB 3.28Å; L164-W168 WeakPolarHBondContact O-CB 3.48Å; L164-W168 PolarHBondContact O-N 3.38Å; G165-W168 PolarHBondContact O-N 2.83Å; I166-W168 VanDerWaalsContact C-N 3.3Å; I166-W168 PolarHBondContact O-N 2.86Å; W168-S171 PolarHBondContact O-OG 2.73Å; W168-A172 WeakPolarHBondContact O-CB 3.34Å; W168-A172 PolarHBondContact O-N 2.93Å; W168-Y190 HydrophobicContact CB-CE1 4.35Å
169V82.4Confident74.8Confident75 Ų7581.3 Ų81.346%0.45546%0.457SS..Hα-helixtrans-65.1-43.3173.7173.40000110.9G165 I166 S171 A172 L173G165-V169 WeakPolarHBondContact O-CG2 3.06Å; G165-V169 PolarHBondContact O-N 3.37Å; I166-V169 PolarHBondContact O-N 3.14Å; V169-S171 PolarHBondContact O-N 3.11Å; V169-A172 PolarHBondContact O-N 3.11Å; V169-L173 HydrophobicContact CG1-CD1 4.15Å; V169-L173 WeakPolarHBondContact O-CG 3.34Å; V169-L173 PolarHBondContact O-N 2.73Å
170A76.2Confident73.2Confident42 Ų4289.3 Ų89.335%0.34748%0.483SS..Hα-helixtrans-64.3-39.3179.300000112.4I166 V167 L173 L174I166-A170 WeakPolarHBondContact O-CB 3.12Å; I166-A170 PolarHBondContact O-N 3.49Å; V167-A170 PolarHBondContact O-N 3.26Å; A170-L173 PolarHBondContact O-N 3.48Å; A170-L174 WeakPolarHBondContact O-CG 3.43Å; A170-L174 PolarHBondContact O-N 3.48Å
171S71Confident71.7Confident28 Ų2895.7 Ų95.720%0.19651%0.506CS..Hα-helixtrans-68.5-40.5176.667.40000111.6V167 W168 V169 L173 L174 H175 Y190V167-S171 WeakPolarHBondContact O-CB 3.33Å; V167-S171 PolarHBondContact O-N 3.06Å; V167-S171 PolarHBondContact O-OG 3.29Å; W168-S171 PolarHBondContact O-OG 2.73Å; V169-S171 PolarHBondContact O-N 3.11Å; S171-L173 VanDerWaalsContact C-N 3.3Å; S171-L173 PolarHBondContact O-N 3.24Å; S171-L174 PolarHBondContact O-N 3.47Å; S171-H175 PolarHBondContact O-N 2.87Å; S171-Y190 WeakPolarHBondContact OG-CE1 2.94Å
172A73.4Confident70.4Confident33 Ų3393.7 Ų93.727%0.27350%0.501SS..Hα-helixtrans-62.6-35.2175.700000112.7W168 V169 A179W168-A172 WeakPolarHBondContact O-CB 3.34Å; W168-A172 PolarHBondContact O-N 2.93Å; V169-A172 PolarHBondContact O-N 3.11Å; A172-A179 HydrophobicContact CB-CB 4.3Å
173L76.3Confident68.7Low137 Ų13795.5 Ų95.572%0.71751%0.511SS*.Hα-helixtrans-72.5-29.3175.8-72.4171000113.5V169 A170 S171V169-L173 HydrophobicContact CG1-CD1 4.15Å; V169-L173 WeakPolarHBondContact O-CG 3.34Å; V169-L173 PolarHBondContact O-N 2.73Å; A170-L173 PolarHBondContact O-N 3.48Å; S171-L173 VanDerWaalsContact C-N 3.3Å; S171-L173 PolarHBondContact O-N 3.24Å
174L70.5Confident67.2Low138 Ų138102.6 Ų102.672%0.72353%0.533SS*.Hα-helixtrans-89-28.6-177.4-71.7170.6000113A170 S171A170-L174 WeakPolarHBondContact O-CG 3.43Å; A170-L174 PolarHBondContact O-N 3.48Å; S171-L174 PolarHBondContact O-N 3.47Å
175H64.7Low66.2Low102 Ų102103 Ų10347%0.47254%0.535SS..  trans-131.498.6-178-64.683.8000110.8S171 N177 V178S171-H175 PolarHBondContact O-N 2.87Å; H175-N177 PolarHBondContact O-N 2.69Å; H175-V178 HydrophobicContact CB-CG2 4.37Å
176D58.2Low65Low149 Ų149103.5 Ų103.580%0.79753%0.531SS*.THydrogen-bonded Turntrans-59.3-17.1-177.6-79.2-34.6000114.9
177N54.2Low63.7Low160 Ų160107.5 Ų107.586%0.85654%0.539SS*.THydrogen-bonded Turntrans-118-1-167.5-69.9-36.2000116.5H175H175-N177 PolarHBondContact O-N 2.69Å
178V55.4Low62.9Low93 Ų93113.6 Ų113.656%0.56457%0.566SS**  trans-114.1-1-169.5-168.50000113.5H175 R180H175-V178 HydrophobicContact CB-CG2 4.37Å; V178-R180 PolarHBondContact O-N 3.44Å
179A52.9Low62.1Low39 Ų39112.2 Ų112.232%0.32256%0.561SS.*  trans-77.919.4-168.400000116.6A172A172-A179 HydrophobicContact CB-CB 4.3Å
180R56.3Low61.2Low229 Ų229109.8 Ų109.886%0.86454%0.544SS*.  trans-133.589.9177.4-69.5-174.7-157.5158.38.3111.5V178V178-R180 PolarHBondContact O-N 3.44Å
181Q53.4Low60.6Low176 Ų176111.2 Ų111.282%0.82255%0.545SS*.  trans-167.7169.4146.9-100.2150.525.900110.4D185Q181-D185 VanDerWaalsContact C-OD2 3.27Å; Q181-D185 WeakPolarHBondContact CB-OD2 3.06Å
182S58.8Low60.4Low68 Ų68113.1 Ų113.148%0.47656%0.557SS.*  trans-58.6170.1-148.372.40000118.5Y184 D185S182-Y184 PolarHBondContact O-N 3.24Å; S182-Y184 PolarHBondContact OG-N 2.78Å; S182-D185 PolarHBondContact N-OD2 3.41Å; S182-D185 WeakPolarHBondContact O-CB 3.46Å; S182-D185 PolarHBondContact O-N 3.03Å; S182-D185 PolarHBondContact OG-OD2 3.12Å
183L54.5Low60Low146 Ų146115.9 Ų115.976%0.76456%0.561SS**Hα-helixtrans-55.3-20.1169.7-72.8171.1000114L186L183-L186 HydrophobicContact CD2-CD1 4.5Å; L183-L186 WeakPolarHBondContact O-CB 3.09Å; L183-L186 PolarHBondContact O-N 3.35Å
184Y52.9Low59.5Low202 Ų202111.8 Ų111.879%0.79254%0.54SS*.Hα-helixtrans-73.4-32.4175.4-92.8-86.3000112.3S182 L186 W187S182-Y184 PolarHBondContact O-N 3.24Å; S182-Y184 PolarHBondContact OG-N 2.78Å; Y184-L186 PolarHBondContact O-N 3.4Å; Y184-W187 PolarHBondContact O-N 3.12Å
185D58.1Low59.6Low60 Ų60106 Ų10632%0.32151%0.508SS..Hα-helixtrans-67.4-18.9171.4-58.5-62.4000111.5Q181 S182 W187 Y189Q181-D185 VanDerWaalsContact C-OD2 3.27Å; Q181-D185 WeakPolarHBondContact CB-OD2 3.06Å; S182-D185 PolarHBondContact N-OD2 3.41Å; S182-D185 WeakPolarHBondContact O-CB 3.46Å; S182-D185 PolarHBondContact O-N 3.03Å; S182-D185 PolarHBondContact OG-OD2 3.12Å; D185-W187 VanDerWaalsContact C-N 3.35Å; D185-W187 PolarHBondContact O-N 3.12Å; D185-Y189 WeakPolarHBondContact O-CA 3.05Å; D185-Y189 WeakPolarHBondContact O-CB 3.38Å; D185-Y189 PolarHBondContact O-N 2.83Å
186L57.2Low60Low42 Ų42102.2 Ų102.222%0.2249%0.493CS..Iπ-helixtrans-63.1-40177.1-138.3107.5000112.4L164 L183 Y184 Y190L164-L186 HydrophobicContact CB-CD2 4.18Å; L164-L186 HydrophobicContact CD1-CD2 3.64Å; L164-L186 HydrophobicContact CD2-CD2 3.59Å; L164-L186 HydrophobicContact CD2-CG 4.42Å; L164-L186 HydrophobicContact CG-CD2 3.98Å; L183-L186 HydrophobicContact CD2-CD1 4.5Å; L183-L186 WeakPolarHBondContact O-CB 3.09Å; L183-L186 PolarHBondContact O-N 3.35Å; Y184-L186 PolarHBondContact O-N 3.4Å; L186-Y190 VanDerWaalsContact CA-CD2 3.49Å; L186-Y190 HydrophobicContact CB-CD2 4.39Å; L186-Y190 HydrophobicContact CD1-CD2 4.43Å; L186-Y190 HydrophobicContact CD1-CE2 4.34Å; L186-Y190 HydrophobicContact CG-CD2 4.1Å; L186-Y190 HydrophobicContact CG-CE2 4.49Å; L186-Y190 HydrophobicContact CG-CG 4.42Å; L186-Y190 VanDerWaalsContact O-CB 3.3Å; L186-Y190 WeakPolarHBondContact O-CB 3.3Å; L186-Y190 PolarHBondContact O-N 3.14Å
187W56.3Low60.8Low186 Ų18697 Ų9771%0.70548%0.475SS*.Iπ-helixtrans-77.4-40.2-179.2-177.2-100.9000112.3Y184 D185 L191Y184-W187 PolarHBondContact O-N 3.12Å; D185-W187 VanDerWaalsContact C-N 3.35Å; D185-W187 PolarHBondContact O-N 3.12Å; W187-L191 HydrophobicContact CD2-CD1 3.96Å; W187-L191 HydrophobicContact CE3-CD1 3.52Å; W187-L191 HydrophobicContact CH2-CD1 3.72Å; W187-L191 HydrophobicContact CZ2-CD1 4.13Å; W187-L191 HydrophobicContact CZ3-CD1 3.39Å; W187-L191 VanDerWaalsContact O-CB 3.28Å; W187-L191 WeakPolarHBondContact O-CB 3.48Å
188E61.3Low62.1Low156 Ų15691.3 Ų91.373%0.72944%0.444SS*.Iπ-helixtrans-86.6-33.9-173.1-157.6165.8-16300112.7P192E188-P192 WeakPolarHBondContact O-CD 3.31Å; E188-P192 WeakPolarHBondContact O-CG 3.48Å
189Y59.8Low63.2Low96 Ų9687 Ų8738%0.37642%0.418SS..Iπ-helixtrans-93.5-49.9-179.2-162-105.6000112.3D185 P192 Y193D185-Y189 WeakPolarHBondContact O-CA 3.05Å; D185-Y189 WeakPolarHBondContact O-CB 3.38Å; D185-Y189 PolarHBondContact O-N 2.83Å; Y189-P192 WeakPolarHBondContact O-CD 3.42Å; Y189-Y193 AromaticContact CD1-CD2 3.88Å; Y189-Y193 HydrophobicContact CD1-CD2 3.88Å; Y189-Y193 AromaticContact CD1-CE2 3.55Å; Y189-Y193 HydrophobicContact CD1-CE2 3.55Å; Y189-Y193 HydrophobicContact CD2-CE2 4.03Å; Y189-Y193 AromaticContact CE1-CD2 3.9Å; Y189-Y193 HydrophobicContact CE1-CD2 3.9Å; Y189-Y193 AromaticContact CE1-CE2 3.21Å; Y189-Y193 HydrophobicContact CE1-CE2 3.21Å; Y189-Y193 AromaticContact CE1-CZ 3.98Å; Y189-Y193 AromaticContact CE2-CE2 3.74Å; Y189-Y193 HydrophobicContact CE2-CE2 3.74Å; Y189-Y193 HydrophobicContact CG-CD2 4.37Å; Y189-Y193 AromaticContact CG-CE2 3.95Å; Y189-Y193 HydrophobicContact CG-CE2 3.95Å; Y189-Y193 AromaticContact CZ-CE2 3.32Å; Y189-Y193 AromaticContact CZ-CZ 3.77Å; Y189-Y193 WeakPolarHBondContact O-CD2 3.47Å; Y189-Y193 PolarHBondContact OH-OH 3.14Å
190Y63.2Low64.5Low24 Ų2488.4 Ų88.49%0.09442%0.42CS..Iπ-helixtrans-81-28.2-167.5-64.8-104.2000114.1V167 W168 S171 L186 Y193 L194V167-Y190 HydrophobicContact CB-CD1 4.33Å; V167-Y190 HydrophobicContact CG1-CD1 3.67Å; V167-Y190 HydrophobicContact CG1-CE1 4.39Å; W168-Y190 HydrophobicContact CB-CE1 4.35Å; S171-Y190 WeakPolarHBondContact OG-CE1 2.94Å; L186-Y190 VanDerWaalsContact CA-CD2 3.49Å; L186-Y190 HydrophobicContact CB-CD2 4.39Å; L186-Y190 HydrophobicContact CD1-CD2 4.43Å; L186-Y190 HydrophobicContact CD1-CE2 4.34Å; L186-Y190 HydrophobicContact CG-CD2 4.1Å; L186-Y190 HydrophobicContact CG-CE2 4.49Å; L186-Y190 HydrophobicContact CG-CG 4.42Å; L186-Y190 VanDerWaalsContact O-CB 3.3Å; L186-Y190 WeakPolarHBondContact O-CB 3.3Å; L186-Y190 PolarHBondContact O-N 3.14Å; Y190-Y193 PolarHBondContact O-N 3.46Å; Y190-L194 PolarHBondContact O-N 3.48Å
191L63.7Low65.9Low71 Ų7182.9 Ų82.937%0.37240%0.402SS..Hα-helixtrans-66.8-42.5179.8-153.7153.3000111.8W187 Y193 L194 Y195W187-L191 HydrophobicContact CD2-CD1 3.96Å; W187-L191 HydrophobicContact CE3-CD1 3.52Å; W187-L191 HydrophobicContact CH2-CD1 3.72Å; W187-L191 HydrophobicContact CZ2-CD1 4.13Å; W187-L191 HydrophobicContact CZ3-CD1 3.39Å; W187-L191 VanDerWaalsContact O-CB 3.28Å; W187-L191 WeakPolarHBondContact O-CB 3.48Å; L191-Y193 PolarHBondContact O-N 3.47Å; L191-L194 PolarHBondContact O-N 3.01Å; L191-Y195 PolarHBondContact O-N 2.78Å
192P66.6Low67.6Low68 Ų6874.5 Ų74.544%0.44236%0.363SS..Hα-helixtrans-60-38.3167.8-27.135.4000114.8E188 Y189 Y195 S196E188-P192 WeakPolarHBondContact O-CD 3.31Å; E188-P192 WeakPolarHBondContact O-CG 3.48Å; Y189-P192 WeakPolarHBondContact O-CD 3.42Å; P192-Y195 PolarHBondContact O-N 2.79Å; P192-S196 VanDerWaalsContact O-CB 3.31Å; P192-S196 WeakPolarHBondContact O-CB 3.44Å; P192-S196 PolarHBondContact O-N 2.88Å
193Y65.5Low69Low92 Ų9271.3 Ų71.336%0.36134%0.341SS..Hα-helixtrans-67.8-42.3176.9-80.1-71.9000112.7Y189 Y190 L191 Y195 S196 G197Y189-Y193 AromaticContact CD1-CD2 3.88Å; Y189-Y193 HydrophobicContact CD1-CD2 3.88Å; Y189-Y193 AromaticContact CD1-CE2 3.55Å; Y189-Y193 HydrophobicContact CD1-CE2 3.55Å; Y189-Y193 HydrophobicContact CD2-CE2 4.03Å; Y189-Y193 AromaticContact CE1-CD2 3.9Å; Y189-Y193 HydrophobicContact CE1-CD2 3.9Å; Y189-Y193 AromaticContact CE1-CE2 3.21Å; Y189-Y193 HydrophobicContact CE1-CE2 3.21Å; Y189-Y193 AromaticContact CE1-CZ 3.98Å; Y189-Y193 AromaticContact CE2-CE2 3.74Å; Y189-Y193 HydrophobicContact CE2-CE2 3.74Å; Y189-Y193 HydrophobicContact CG-CD2 4.37Å; Y189-Y193 AromaticContact CG-CE2 3.95Å; Y189-Y193 HydrophobicContact CG-CE2 3.95Å; Y189-Y193 AromaticContact CZ-CE2 3.32Å; Y189-Y193 AromaticContact CZ-CZ 3.77Å; Y189-Y193 WeakPolarHBondContact O-CD2 3.47Å; Y189-Y193 PolarHBondContact OH-OH 3.14Å; Y190-Y193 PolarHBondContact O-N 3.46Å; L191-Y193 PolarHBondContact O-N 3.47Å; Y193-Y195 VanDerWaalsContact C-N 3.33Å; Y193-Y195 PolarHBondContact O-N 3.39Å; Y193-S196 WeakPolarHBondContact O-CB 3.32Å; Y193-S196 PolarHBondContact O-N 3.42Å; Y193-G197 PolarHBondContact O-N 2.84Å
194L67Low70.7Confident51 Ų5168.4 Ų68.427%0.26733%0.326SS..Hα-helixtrans-58.3-47.4173.8-87.2169000111V163 L164 V167 Y190 L191 S196 G197 I198V163-L194 HydrophobicContact CG1-CD1 4.23Å; V163-L194 HydrophobicContact CG1-CD2 3.74Å; L164-L194 HydrophobicContact CD2-CD1 4.33Å; V167-L194 HydrophobicContact CG2-CD1 4.28Å; V167-L194 HydrophobicContact CG2-CD2 3.44Å; V167-L194 VanDerWaalsContact CG2-CD2 3.44Å; V167-L194 HydrophobicContact CG2-CG 3.79Å; Y190-L194 PolarHBondContact O-N 3.48Å; L191-L194 PolarHBondContact O-N 3.01Å; L194-S196 VanDerWaalsContact C-N 3.35Å; L194-S196 PolarHBondContact O-N 3.03Å; L194-G197 PolarHBondContact O-N 3.35Å; L194-I198 WeakPolarHBondContact O-CD1 3.5Å; L194-I198 VanDerWaalsContact O-CG1 3.3Å; L194-I198 WeakPolarHBondContact O-CG1 3.3Å; L194-I198 PolarHBondContact O-N 3.37Å
195Y72.6Confident72.5Confident15 Ų1559.7 Ų59.76%0.05929%0.293CS..Hα-helixtrans-63.4-41176-173.8-95.8000112.3F115 N119 L191 P192 Y193 G197 I198 S199 F426 Y429F115-Y195 HydrophobicContact CE2-CD1 4.24Å; F115-Y195 HydrophobicContact CE2-CD2 4.46Å; F115-Y195 AromaticContact CE2-CE1 3.76Å; F115-Y195 HydrophobicContact CE2-CE1 3.76Å; F115-Y195 AromaticContact CE2-CE2 3.99Å; F115-Y195 HydrophobicContact CE2-CE2 3.99Å; F115-Y195 AromaticContact CE2-CZ 3.57Å; N119-Y195 WeakPolarHBondContact OD1-CD2 3.39Å; N119-Y195 WeakPolarHBondContact OD1-CE2 3.4Å; L191-Y195 PolarHBondContact O-N 2.78Å; P192-Y195 PolarHBondContact O-N 2.79Å; Y193-Y195 VanDerWaalsContact C-N 3.33Å; Y193-Y195 PolarHBondContact O-N 3.39Å; Y195-G197 VanDerWaalsContact C-N 3.32Å; Y195-G197 PolarHBondContact O-N 3.32Å; Y195-I198 PolarHBondContact O-N 3.5Å; Y195-S199 WeakPolarHBondContact O-CB 3.11Å; Y195-S199 PolarHBondContact O-N 2.94Å; Y195-F426 HydrophobicContact CE1-CD1 4.35Å; Y195-F426 HydrophobicContact CE1-CE1 4.43Å; Y195-F426 VanDerWaalsContact OH-CE1 3.25Å; Y195-F426 WeakPolarHBondContact OH-CE1 3.41Å; Y195-Y429 AromaticContact CD1-CE1 3.83Å; Y195-Y429 HydrophobicContact CD1-CE1 3.83Å; Y195-Y429 AromaticContact CD1-CZ 3.59Å; Y195-Y429 WeakPolarHBondContact CD1-OH 3.12Å; Y195-Y429 HydrophobicContact CE1-CE1 4.33Å; Y195-Y429 HydrophobicContact CE1-CE2 4.36Å; Y195-Y429 AromaticContact CE1-CZ 3.62Å; Y195-Y429 WeakPolarHBondContact CE1-OH 3.27Å
196S72.8Confident74.1Confident23 Ų2356.8 Ų56.816%0.16128%0.277CS..Hα-helixtrans-60-41.4175.7-170.30000111.9P192 Y193 L194 S199 L200 Y429P192-S196 VanDerWaalsContact O-CB 3.31Å; P192-S196 WeakPolarHBondContact O-CB 3.44Å; P192-S196 PolarHBondContact O-N 2.88Å; Y193-S196 WeakPolarHBondContact O-CB 3.32Å; Y193-S196 PolarHBondContact O-N 3.42Å; L194-S196 VanDerWaalsContact C-N 3.35Å; L194-S196 PolarHBondContact O-N 3.03Å; S196-S199 PolarHBondContact O-N 2.97Å; S196-L200 VanDerWaalsContact O-CB 3.25Å; S196-L200 WeakPolarHBondContact O-CB 3.26Å; S196-L200 PolarHBondContact O-N 3.15Å; S196-Y429 WeakPolarHBondContact OG-CD1 3.44Å
197G74.9Confident75.8Confident40 Ų4055.2 Ų55.241%0.41227%0.269SS..Hα-helixtrans-64-44.1175.200000112.9Y193 L194 Y195 L200 F201Y193-G197 PolarHBondContact O-N 2.84Å; L194-G197 PolarHBondContact O-N 3.35Å; Y195-G197 VanDerWaalsContact C-N 3.32Å; Y195-G197 PolarHBondContact O-N 3.32Å; G197-L200 PolarHBondContact O-N 3.37Å; G197-F201 WeakPolarHBondContact O-CB 3.3Å; G197-F201 PolarHBondContact O-N 3.2Å
198I79.9Confident77.4Confident41 Ų4151.6 Ų51.621%0.2126%0.263CS..Hα-helixtrans-63.6-44176.3-66.1161.3000110.8L122 L194 Y195 F201 G202L122-I198 HydrophobicContact CD1-CG2 3.64Å; L122-I198 HydrophobicContact CD2-CD1 3.81Å; L122-I198 HydrophobicContact CD2-CG2 4.4Å; L194-I198 WeakPolarHBondContact O-CD1 3.5Å; L194-I198 VanDerWaalsContact O-CG1 3.3Å; L194-I198 WeakPolarHBondContact O-CG1 3.3Å; L194-I198 PolarHBondContact O-N 3.37Å; Y195-I198 PolarHBondContact O-N 3.5Å; I198-F201 PolarHBondContact O-N 3.29Å; I198-G202 PolarHBondContact O-N 3.01Å
199S78.7Confident78.8Confident1 Ų144.7 Ų44.71%0.00723%0.231CC..Hα-helixtrans-63.6-45.8177.3-176.10000111.5Y195 S196 F201 G202 V203Y195-S199 WeakPolarHBondContact O-CB 3.11Å; Y195-S199 PolarHBondContact O-N 2.94Å; S196-S199 PolarHBondContact O-N 2.97Å; S199-F201 PolarHBondContact O-N 3.21Å; S199-G202 PolarHBondContact O-N 3.3Å; S199-G202 VanDerWaalsContact O-N 3.14Å; S199-V203 WeakPolarHBondContact O-CG2 3.41Å; S199-V203 PolarHBondContact O-N 3.28Å
200L81Confident80.3Confident69 Ų6940.1 Ų40.136%0.36121%0.213SC..Hα-helixtrans-61-43.6176.3-179.6140.7000111.5S196 G197 G202 V203 L204 W431S196-L200 VanDerWaalsContact O-CB 3.25Å; S196-L200 WeakPolarHBondContact O-CB 3.26Å; S196-L200 PolarHBondContact O-N 3.15Å; G197-L200 PolarHBondContact O-N 3.37Å; L200-G202 VanDerWaalsContact C-N 3.35Å; L200-G202 PolarHBondContact O-N 3.06Å; L200-V203 PolarHBondContact O-N 2.8Å; L200-L204 HydrophobicContact CD2-CD1 3.63Å; L200-L204 HydrophobicContact CD2-CG 4.45Å; L200-L204 HydrophobicContact CG-CD1 4.36Å; L200-L204 WeakPolarHBondContact O-CB 3.17Å; L200-L204 WeakPolarHBondContact O-CG 3.2Å; L200-L204 PolarHBondContact O-N 3.24Å; L200-W431 HydrophobicContact CD1-CD2 4.42Å; L200-W431 HydrophobicContact CD1-CG 4.37Å
201F86.6Confident81.6Confident113 Ų11339.3 Ų39.350%0.49621%0.211SC..Hα-helixtrans-59.4-45.7172.9177-100.3000111.6G197 I198 S199 V203 L204 L205 I403G197-F201 WeakPolarHBondContact O-CB 3.3Å; G197-F201 PolarHBondContact O-N 3.2Å; I198-F201 PolarHBondContact O-N 3.29Å; S199-F201 PolarHBondContact O-N 3.21Å; F201-V203 PolarHBondContact O-N 3.09Å; F201-L204 PolarHBondContact O-N 2.97Å; F201-L205 HydrophobicContact CE1-CD1 4.01Å; F201-L205 HydrophobicContact CZ-CD1 4.08Å; F201-L205 VanDerWaalsContact O-CB 3.32Å; F201-L205 WeakPolarHBondContact O-CB 3.49Å; F201-L205 PolarHBondContact O-N 3.19Å; F201-I403 HydrophobicContact CD1-CG2 4.24Å
202G88.6Confident82.8Confident0 Ų040.2 Ų40.20%021%0.212CC..Hα-helixtrans-61.5-41.6176.900000113.2I198 S199 L200 L205 L206 A407I198-G202 PolarHBondContact O-N 3.01Å; S199-G202 PolarHBondContact O-N 3.3Å; S199-G202 VanDerWaalsContact O-N 3.14Å; L200-G202 VanDerWaalsContact C-N 3.35Å; L200-G202 PolarHBondContact O-N 3.06Å; G202-L205 PolarHBondContact O-N 3.33Å; G202-L206 WeakPolarHBondContact O-CG 3.37Å; G202-L206 PolarHBondContact O-N 2.94Å; G202-A407 VanDerWaalsContact C-CB 3.45Å
203V88.1Confident84Confident2 Ų237 Ų371%0.01219%0.191CC..Hα-helixtrans-70.1-36.91791740000111.9S199 L200 F201 L206 L207 A407 V410 W431 Y441S199-V203 WeakPolarHBondContact O-CG2 3.41Å; S199-V203 PolarHBondContact O-N 3.28Å; L200-V203 PolarHBondContact O-N 2.8Å; F201-V203 PolarHBondContact O-N 3.09Å; V203-L206 PolarHBondContact O-N 3.26Å; V203-L207 PolarHBondContact O-N 2.97Å; V203-A407 HydrophobicContact CG2-CB 3.92Å; V203-V410 HydrophobicContact CG2-CB 3.99Å; V203-V410 HydrophobicContact CG2-CG1 3.88Å; V203-W431 HydrophobicContact CG1-CH2 4.04Å; V203-W431 HydrophobicContact CG2-CZ2 4.49Å; V203-Y441 HydrophobicContact CG1-CD2 4.35Å; V203-Y441 HydrophobicContact CG1-CE1 4.36Å; V203-Y441 HydrophobicContact CG1-CE2 3.45Å; V203-Y441 VanDerWaalsContact CG1-CE2 3.45Å; V203-Y441 VanDerWaalsContact CG1-CZ 3.47Å; V203-Y441 WeakPolarHBondContact CG1-OH 3.3Å; V203-Y441 PolarHBondContact O-OH 3.07Å
204L89.9Confident85.1Confident84 Ų8432.8 Ų32.844%0.4418%0.175SC..Hα-helixtrans-66.7-39.1171.5-73.7173.1000111.9L200 F201 L207 L208L200-L204 HydrophobicContact CD2-CD1 3.63Å; L200-L204 HydrophobicContact CD2-CG 4.45Å; L200-L204 HydrophobicContact CG-CD1 4.36Å; L200-L204 WeakPolarHBondContact O-CB 3.17Å; L200-L204 WeakPolarHBondContact O-CG 3.2Å; L200-L204 PolarHBondContact O-N 3.24Å; F201-L204 PolarHBondContact O-N 2.97Å; L204-L207 HydrophobicContact CD2-CD2 4.43Å; L204-L207 WeakPolarHBondContact O-CB 3.25Å; L204-L207 PolarHBondContact O-N 2.88Å; L204-L208 PolarHBondContact O-N 3.48Å
205L90.8Very high86Confident19 Ų1932 Ų3210%0.09917%0.174CC..Hα-helixtrans-64.9-42.9175.3-172147.7000110.7F201 G202 L207 L208 C209 F373 F379 L404F201-L205 HydrophobicContact CE1-CD1 4.01Å; F201-L205 HydrophobicContact CZ-CD1 4.08Å; F201-L205 VanDerWaalsContact O-CB 3.32Å; F201-L205 WeakPolarHBondContact O-CB 3.49Å; F201-L205 PolarHBondContact O-N 3.19Å; G202-L205 PolarHBondContact O-N 3.33Å; L205-L207 PolarHBondContact O-N 3.24Å; L205-L208 PolarHBondContact O-N 2.83Å; L205-C209 VanDerWaalsContact O-CB 3.22Å; L205-C209 WeakPolarHBondContact O-CB 3.47Å; L205-C209 PolarHBondContact O-N 3.45Å; L205-C209 PolarHBondContact O-SG 3.49Å; L205-F373 HydrophobicContact CD1-CD2 4.22Å; L205-F373 HydrophobicContact CD1-CE2 4.02Å; L205-F373 HydrophobicContact CD2-CD2 3.86Å; L205-F373 HydrophobicContact CD2-CE2 4.38Å; L205-F373 HydrophobicContact CG-CD2 4.43Å; L205-F379 HydrophobicContact CD1-CE2 4.21Å; L205-F379 HydrophobicContact CD1-CZ 4.38Å; L205-L404 HydrophobicContact CD2-CD1 3.44Å; L205-L404 VanDerWaalsContact CD2-CD1 3.44Å
206L91.8Very high86.7Confident0 Ų036.1 Ų36.10%019%0.189CC..Hα-helixtrans-58.2-44.9171.8-78.4170.4000112G202 V203 L208 C209 T210 S369 L404 A407 F411G202-L206 WeakPolarHBondContact O-CG 3.37Å; G202-L206 PolarHBondContact O-N 2.94Å; V203-L206 PolarHBondContact O-N 3.26Å; L206-L208 VanDerWaalsContact C-N 3.28Å; L206-L208 PolarHBondContact O-N 3.49Å; L206-C209 PolarHBondContact O-N 2.89Å; L206-T210 VanDerWaalsContact O-CB 3.31Å; L206-T210 WeakPolarHBondContact O-CB 3.24Å; L206-T210 VanDerWaalsContact O-CG2 3.24Å; L206-T210 WeakPolarHBondContact O-CG2 3.33Å; L206-T210 PolarHBondContact O-N 3.49Å; L206-T210 PolarHBondContact O-OG1 3.03Å; L206-S369 VanDerWaalsContact CD2-CB 3.46Å; L206-L404 HydrophobicContact CD2-CD1 3.28Å; L206-L404 HydrophobicContact CD2-CG 3.82Å; L206-L404 HydrophobicContact CG-CD1 3.72Å; L206-A407 HydrophobicContact CD1-CB 3.58Å; L206-F411 HydrophobicContact CB-CD1 4.47Å; L206-F411 HydrophobicContact CB-CD2 4.02Å; L206-F411 HydrophobicContact CB-CE2 4.22Å; L206-F411 HydrophobicContact CB-CG 4.11Å; L206-F411 HydrophobicContact CD1-CB 3.56Å; L206-F411 HydrophobicContact CD1-CD1 4.15Å; L206-F411 HydrophobicContact CD1-CD2 4.49Å; L206-F411 HydrophobicContact CD1-CG 3.83Å; L206-F411 HydrophobicContact CG-CG 4.49Å
207L91.9Very high87.4Confident8 Ų836.6 Ų36.64%0.04219%0.189CC..Hα-helixtrans-54.9-42178.9-179.263.1000112.8V203 L204 L205 P211 Y441 L444 F445V203-L207 PolarHBondContact O-N 2.97Å; L204-L207 HydrophobicContact CD2-CD2 4.43Å; L204-L207 WeakPolarHBondContact O-CB 3.25Å; L204-L207 PolarHBondContact O-N 2.88Å; L205-L207 PolarHBondContact O-N 3.24Å; L207-P211 WeakPolarHBondContact O-CD 3.36Å; L207-P211 WeakPolarHBondContact O-CG 3.5Å; L207-Y441 HydrophobicContact CB-CE2 3.65Å; L207-Y441 WeakPolarHBondContact CB-OH 3.01Å; L207-Y441 HydrophobicContact CD1-CD2 4.32Å; L207-Y441 HydrophobicContact CD1-CE1 4.19Å; L207-Y441 HydrophobicContact CD1-CE2 3.93Å; L207-Y441 HydrophobicContact CD2-CD2 3.84Å; L207-Y441 HydrophobicContact CD2-CE2 3.69Å; L207-Y441 HydrophobicContact CG-CD2 4.48Å; L207-Y441 HydrophobicContact CG-CE2 3.95Å; L207-L444 HydrophobicContact CD1-CB 4.45Å; L207-L444 HydrophobicContact CD2-CB 4.32Å; L207-L444 HydrophobicContact CD2-CD1 4.41Å; L207-F445 HydrophobicContact CD1-CB 3.51Å; L207-F445 HydrophobicContact CD1-CD2 4.03Å; L207-F445 HydrophobicContact CD1-CG 4.27Å
208L90.6Very high87.8Confident111 Ų11135.1 Ų35.158%0.58117%0.172SC*.Hα-helixtrans-85.9-41.2-176.8-63.2176.8000112.1L204 L205 L206 P211 L448L204-L208 PolarHBondContact O-N 3.48Å; L205-L208 PolarHBondContact O-N 2.83Å; L206-L208 VanDerWaalsContact C-N 3.28Å; L206-L208 PolarHBondContact O-N 3.49Å; L208-P211 WeakPolarHBondContact O-CD 3.38Å; L208-L448 HydrophobicContact CD2-CD1 4.27Å
209C91.1Very high87.8Confident10 Ų1036.2 Ų36.27%0.06818%0.183CC..Hα-helixtrans-72-36.3-176.3-68.50000112.3L205 L206 F212 G213 G372L205-C209 VanDerWaalsContact O-CB 3.22Å; L205-C209 WeakPolarHBondContact O-CB 3.47Å; L205-C209 PolarHBondContact O-N 3.45Å; L205-C209 PolarHBondContact O-SG 3.49Å; L206-C209 PolarHBondContact O-N 2.89Å; C209-F212 PolarHBondContact O-N 3.23Å; C209-G213 PolarHBondContact O-N 3.25Å; C209-G372 WeakPolarHBondContact O-CA 3.14Å
210T91.6Very high87.8Confident0 Ų038.6 Ų38.60%020%0.197CC..Hα-helixtrans-59-58.7-17944.90000113.8L206 F212 G213 L214 F411 F445L206-T210 VanDerWaalsContact O-CB 3.31Å; L206-T210 WeakPolarHBondContact O-CB 3.24Å; L206-T210 VanDerWaalsContact O-CG2 3.24Å; L206-T210 WeakPolarHBondContact O-CG2 3.33Å; L206-T210 PolarHBondContact O-N 3.49Å; L206-T210 PolarHBondContact O-OG1 3.03Å; T210-F212 VanDerWaalsContact C-N 3.26Å; T210-F212 PolarHBondContact O-N 3.18Å; T210-G213 WeakPolarHBondContact O-CA 3.49Å; T210-G213 PolarHBondContact O-N 3.46Å; T210-L214 WeakPolarHBondContact O-CG 3.48Å; T210-L214 PolarHBondContact O-N 3.05Å; T210-F411 HydrophobicContact CG2-CE1 3.98Å; T210-F411 HydrophobicContact CG2-CZ 3.81Å; T210-F445 VanDerWaalsContact OG1-CE2 3.31Å; T210-F445 WeakPolarHBondContact OG1-CE2 3.4Å
211P90.8Very high87.5Confident8 Ų836.5 Ų36.55%0.05219%0.187CC..Hα-helixtrans-61.2-35.7-178.725.4-35.8000112.4L207 L208 L214 S215 L448 T449L207-P211 WeakPolarHBondContact O-CD 3.36Å; L207-P211 WeakPolarHBondContact O-CG 3.5Å; L208-P211 WeakPolarHBondContact O-CD 3.38Å; P211-L214 PolarHBondContact O-N 3.29Å; P211-S215 PolarHBondContact O-N 3.12Å; P211-L448 HydrophobicContact CB-CB 3.9Å; P211-L448 HydrophobicContact CG-CB 3.82Å; P211-L448 HydrophobicContact CG-CD1 4.25Å; P211-T449 HydrophobicContact CB-CG2 3.9Å
212F88.9Confident86.5Confident89 Ų8931.9 Ų31.939%0.3917%0.172SC..Hα-helixtrans-64.8-44.8174.9-172.1-106.9000111.5C209 T210 S215 R216 S375C209-F212 PolarHBondContact O-N 3.23Å; T210-F212 VanDerWaalsContact C-N 3.26Å; T210-F212 PolarHBondContact O-N 3.18Å; F212-S215 PolarHBondContact O-N 3.39Å; F212-R216 HydrophobicContact CD1-CG 4.24Å; F212-R216 HydrophobicContact CE1-CG 3.97Å; F212-R216 HydrophobicContact CZ-CG 4.24Å; F212-R216 WeakPolarHBondContact O-CG 3.38Å; F212-R216 PolarHBondContact O-N 3.27Å; F212-S375 VanDerWaalsContact CE1-CB 3.49Å; F212-S375 WeakPolarHBondContact CE1-O 3.49Å
213G89.9Confident85.3Confident0 Ų036.1 Ų36.10%020%0.201CC..Hα-helixtrans-59.1-44.4174.700000113.2C209 T210 S215 R216 M217 S368 G372C209-G213 PolarHBondContact O-N 3.25Å; T210-G213 WeakPolarHBondContact O-CA 3.49Å; T210-G213 PolarHBondContact O-N 3.46Å; G213-S215 PolarHBondContact O-N 2.97Å; G213-R216 CarbonylContact O-C 3.59Å; G213-R216 PolarHBondContact O-N 3.42Å; G213-R216 VanDerWaalsContact O-N 3.12Å; G213-M217 WeakPolarHBondContact O-CG 3.35Å; G213-M217 PolarHBondContact O-N 2.88Å; G213-S368 VanDerWaalsContact CA-O 3.3Å; G213-S368 WeakPolarHBondContact CA-O 2.98Å; G213-G372 VanDerWaalsContact CA-CA 3.48Å
214L89.3Confident83.8Confident5 Ų542.1 Ų42.13%0.02623%0.233CC..Hα-helixtrans-55.4-49.8175.9-62.5177.8000111.3T210 P211 R216 M217 F218 T312 Y364 S368 T449T210-L214 WeakPolarHBondContact O-CG 3.48Å; T210-L214 PolarHBondContact O-N 3.05Å; P211-L214 PolarHBondContact O-N 3.29Å; L214-R216 VanDerWaalsContact C-N 3.32Å; L214-R216 PolarHBondContact O-N 2.84Å; L214-M217 PolarHBondContact O-N 3.49Å; L214-F218 WeakPolarHBondContact O-CD2 3.15Å; L214-F218 PolarHBondContact O-N 3.21Å; L214-F218 VanDerWaalsContact O-N 3.12Å; L214-T312 HydrophobicContact CB-CG2 4.41Å; L214-T312 HydrophobicContact CD1-CG2 4.09Å; L214-T312 HydrophobicContact CD2-CG2 3.92Å; L214-T312 HydrophobicContact CG-CG2 4.37Å; L214-Y364 HydrophobicContact CD2-CD1 4.45Å; L214-Y364 HydrophobicContact CD2-CE1 3.42Å; L214-Y364 VanDerWaalsContact CD2-CE1 3.42Å; L214-Y364 HydrophobicContact CD2-CE2 4.34Å; L214-Y364 WeakPolarHBondContact CD2-OH 3.39Å; L214-S368 WeakPolarHBondContact CD2-OG 3.45Å; L214-T449 HydrophobicContact CD1-CG2 3.89Å
215S87.2Confident82.1Confident33 Ų3340.8 Ų40.823%0.23123%0.226CC..Hα-helixtrans-61.6-40177.4-173.40000112.2P211 F212 G213 F218 S219 T456P211-S215 PolarHBondContact O-N 3.12Å; F212-S215 PolarHBondContact O-N 3.39Å; G213-S215 PolarHBondContact O-N 2.97Å; S215-F218 PolarHBondContact O-N 3.43Å; S215-S219 PolarHBondContact O-N 3.28Å; S215-S219 VanDerWaalsContact O-N 3.14Å; S215-T456 PolarHBondContact OG-OG1 2.84Å
216R86.8Confident80.2Confident103 Ų10343.3 Ų43.339%0.38924%0.242SC..Hα-helixtrans-67.3-38.8176.2-67.9-61.6-62.6168.7-1.3112.2F212 G213 L214 F218 S219 V220 V371F212-R216 HydrophobicContact CD1-CG 4.24Å; F212-R216 HydrophobicContact CE1-CG 3.97Å; F212-R216 HydrophobicContact CZ-CG 4.24Å; F212-R216 WeakPolarHBondContact O-CG 3.38Å; F212-R216 PolarHBondContact O-N 3.27Å; G213-R216 CarbonylContact O-C 3.59Å; G213-R216 PolarHBondContact O-N 3.42Å; G213-R216 VanDerWaalsContact O-N 3.12Å; L214-R216 VanDerWaalsContact C-N 3.32Å; L214-R216 PolarHBondContact O-N 2.84Å; R216-F218 PolarHBondContact O-N 2.96Å; R216-S219 WeakPolarHBondContact O-CB 3.32Å; R216-S219 PolarHBondContact O-N 3.06Å; R216-S219 VanDerWaalsContact O-N 3.14Å; R216-V220 WeakPolarHBondContact O-CB 3.44Å; R216-V220 VanDerWaalsContact O-CG2 3.26Å; R216-V220 WeakPolarHBondContact O-CG2 3.44Å; R216-V220 PolarHBondContact O-N 3.37Å; R216-V371 HydrophobicContact CB-CG1 4.14Å
217M86.4Confident78.5Confident33 Ų3345.8 Ų45.816%0.16325%0.253CS..Hα-helixtrans-62.4-41.4176.2-72.2-177.1106.100111.7G213 L214 S219 V220 T221 L308 Y364 V367 S368 V371G213-M217 WeakPolarHBondContact O-CG 3.35Å; G213-M217 PolarHBondContact O-N 2.88Å; L214-M217 PolarHBondContact O-N 3.49Å; M217-S219 VanDerWaalsContact C-N 3.34Å; M217-S219 PolarHBondContact O-N 3.09Å; M217-V220 PolarHBondContact O-N 2.84Å; M217-T221 VanDerWaalsContact O-CB 3.28Å; M217-T221 WeakPolarHBondContact O-CB 3.45Å; M217-T221 PolarHBondContact O-N 2.9Å; M217-T221 PolarHBondContact O-OG1 2.83Å; M217-L308 HydrophobicContact CB-CD1 4.18Å; M217-L308 HydrophobicContact CB-CD2 4Å; M217-Y364 HydrophobicContact SD-CE2 4.19Å; M217-V367 HydrophobicContact CE-CB 4.22Å; M217-V367 HydrophobicContact CE-CG1 3.45Å; M217-V367 VanDerWaalsContact CE-CG1 3.45Å; M217-S368 PolarHBondContact SD-OG 3.18Å; M217-V371 HydrophobicContact CG-CB 4.34Å; M217-V371 HydrophobicContact CG-CG1 4.04Å; M217-V371 HydrophobicContact CG-CG2 4.39Å
218F84Confident76.5Confident9 Ų947 Ų474%0.03926%0.261CS..Hα-helixtrans-60.4-43.2171.8-78.6-69.2000112.2L214 S215 R216 G222 M305 L308 L309 T312 L453 T456L214-F218 WeakPolarHBondContact O-CD2 3.15Å; L214-F218 PolarHBondContact O-N 3.21Å; L214-F218 VanDerWaalsContact O-N 3.12Å; S215-F218 PolarHBondContact O-N 3.43Å; R216-F218 PolarHBondContact O-N 2.96Å; F218-G222 PolarHBondContact O-N 3.34Å; F218-M305 HydrophobicContact CD1-CE 3.39Å; F218-M305 HydrophobicContact CD1-SD 3.64Å; F218-M305 HydrophobicContact CE1-CE 3.86Å; F218-M305 HydrophobicContact CE1-SD 4.16Å; F218-M305 HydrophobicContact CG-CE 4.39Å; F218-L308 HydrophobicContact CB-CD2 4.19Å; F218-L308 HydrophobicContact CD1-CB 4.37Å; F218-L308 HydrophobicContact CD1-CD2 3.27Å; F218-L308 HydrophobicContact CD1-CG 4.4Å; F218-L308 HydrophobicContact CD2-CD2 3.56Å; F218-L308 HydrophobicContact CE1-CB 3.89Å; F218-L308 HydrophobicContact CE1-CD2 3.41Å; F218-L308 VanDerWaalsContact CE1-CD2 3.41Å; F218-L308 HydrophobicContact CE1-CG 4.17Å; F218-L308 HydrophobicContact CE2-CD2 3.67Å; F218-L308 HydrophobicContact CG-CD2 3.37Å; F218-L308 HydrophobicContact CZ-CB 4.29Å; F218-L308 HydrophobicContact CZ-CD2 3.61Å; F218-L308 HydrophobicContact CZ-CG 4.3Å; F218-L309 HydrophobicContact CE1-CB 4.34Å; F218-L309 HydrophobicContact CZ-CB 4.45Å; F218-L309 HydrophobicContact CZ-CD1 4.43Å; F218-T312 HydrophobicContact CE2-CG2 3.82Å; F218-T312 HydrophobicContact CZ-CG2 4.08Å; F218-L453 HydrophobicContact CE2-CD1 4.04Å; F218-L453 HydrophobicContact CZ-CD1 4.04Å; F218-T456 HydrophobicContact CB-CG2 3.49Å; F218-T456 VanDerWaalsContact CB-CG2 3.49Å; F218-T456 HydrophobicContact CD1-CG2 4.33Å; F218-T456 HydrophobicContact CD2-CG2 3.97Å; F218-T456 HydrophobicContact CG-CG2 3.71Å
219S79.1Confident74.7Confident63 Ų6347.6 Ų47.644%0.44126%0.255SS..Hα-helixtrans-66-41.6177.7-176.10000112.7S215 R216 M217 G222 S223S215-S219 PolarHBondContact O-N 3.28Å; S215-S219 VanDerWaalsContact O-N 3.14Å; R216-S219 WeakPolarHBondContact O-CB 3.32Å; R216-S219 PolarHBondContact O-N 3.06Å; R216-S219 VanDerWaalsContact O-N 3.14Å; M217-S219 VanDerWaalsContact C-N 3.34Å; M217-S219 PolarHBondContact O-N 3.09Å; S219-G222 PolarHBondContact O-N 2.94Å; S219-S223 PolarHBondContact O-N 3.33Å; S219-S223 VanDerWaalsContact O-N 3.15Å; S219-S223 PolarHBondContact O-OG 2.91Å
220V78.8Confident72.5Confident51 Ų5153.1 Ų53.131%0.30928%0.284SS..Hα-helixtrans-71.5-44.7-177.7168.70000110.6R216 M217 G222 S223 L224R216-V220 WeakPolarHBondContact O-CB 3.44Å; R216-V220 VanDerWaalsContact O-CG2 3.26Å; R216-V220 WeakPolarHBondContact O-CG2 3.44Å; R216-V220 PolarHBondContact O-N 3.37Å; M217-V220 PolarHBondContact O-N 2.84Å; V220-G222 PolarHBondContact O-N 3.5Å; V220-S223 WeakPolarHBondContact CA-OG 3.25Å; V220-S223 PolarHBondContact O-N 2.84Å; V220-S223 PolarHBondContact O-OG 3.17Å; V220-L224 HydrophobicContact CG1-CD1 3.4Å; V220-L224 HydrophobicContact CG1-CG 3.93Å; V220-L224 WeakPolarHBondContact O-CB 3.34Å; V220-L224 WeakPolarHBondContact O-CG 3.46Å; V220-L224 PolarHBondContact O-N 2.86Å
221T74.6Confident70.3Confident25 Ų2561.2 Ų61.215%0.15333%0.326CS..Hα-helixtrans-58.8-38.7171.6-60.10000110.8M217 S223 L225 A304M217-T221 VanDerWaalsContact O-CB 3.28Å; M217-T221 WeakPolarHBondContact O-CB 3.45Å; M217-T221 PolarHBondContact O-N 2.9Å; M217-T221 PolarHBondContact O-OG1 2.83Å; T221-S223 VanDerWaalsContact C-N 3.27Å; T221-S223 PolarHBondContact O-N 3.38Å; T221-L225 HydrophobicContact CG2-CD1 4.48Å; T221-L225 PolarHBondContact O-N 3.18Å; T221-A304 HydrophobicContact CG2-CB 4.16Å
222G66.1Low68.5Low17 Ų1764.7 Ų64.718%0.17534%0.342CS..Hα-helixtrans-64-23.8174.300000115.5F218 S219 V220F218-G222 PolarHBondContact O-N 3.34Å; S219-G222 PolarHBondContact O-N 2.94Å; V220-G222 PolarHBondContact O-N 3.5Å
223S64.4Low67.2Low88 Ų8864.4 Ų64.462%0.61534%0.344SS*.Hα-helixtrans-99.8-34.5177.859.60000114.1S219 V220 T221S219-S223 PolarHBondContact O-N 3.33Å; S219-S223 VanDerWaalsContact O-N 3.15Å; S219-S223 PolarHBondContact O-OG 2.91Å; V220-S223 WeakPolarHBondContact CA-OG 3.25Å; V220-S223 PolarHBondContact O-N 2.84Å; V220-S223 PolarHBondContact O-OG 3.17Å; T221-S223 VanDerWaalsContact C-N 3.27Å; T221-S223 PolarHBondContact O-N 3.38Å
224L55.2Low66.1Low129 Ų12966.3 Ų66.368%0.67535%0.354SS*.Hα-helixtrans-82.5-38.4-177.2-72.6179.6000111.8V220V220-L224 HydrophobicContact CG1-CD1 3.4Å; V220-L224 HydrophobicContact CG1-CG 3.93Å; V220-L224 WeakPolarHBondContact O-CB 3.34Å; V220-L224 WeakPolarHBondContact O-CG 3.46Å; V220-L224 PolarHBondContact O-N 2.86Å
225L53.8Low65.2Low56 Ų5671.8 Ų71.829%0.29338%0.379SS..SBendtrans-87121.7170.5-83.375.6000108.3T221 K227 G300 Y301 A304T221-L225 HydrophobicContact CG2-CD1 4.48Å; T221-L225 PolarHBondContact O-N 3.18Å; L225-K227 PolarHBondContact O-N 3.03Å; L225-G300 VanDerWaalsContact CD2-O 3.31Å; L225-G300 WeakPolarHBondContact CD2-O 3.34Å; L225-Y301 HydrophobicContact CB-CD2 3.43Å; L225-Y301 VanDerWaalsContact CB-CD2 3.43Å; L225-Y301 HydrophobicContact CB-CE2 4.33Å; L225-Y301 HydrophobicContact CB-CG 4.17Å; L225-Y301 VanDerWaalsContact CD2-N 3.34Å; L225-Y301 VanDerWaalsContact O-CD2 3.3Å; L225-Y301 WeakPolarHBondContact O-CD2 3.39Å; L225-Y301 WeakPolarHBondContact O-CE2 3.37Å; L225-A304 HydrophobicContact CD2-CB 4.12Å
226V52.1Low64.7Low71 Ų7174.3 Ų74.343%0.4339%0.39SS..  trans-52109.9174.2176.20000107.8P228 R289V226-P228 WeakPolarHBondContact O-CD 3.41Å; V226-P228 VanDerWaalsContact O-N 3.1Å; V226-R289 VanDerWaalsContact CG1-NH1 3.29Å
227K55.8Low64.3Low53 Ų5371.6 Ų71.623%0.2339%0.385CS..  trans-49.7124.3175.6-71.9-171.6173.1-160.80108.2L225 R229 Y301 R463L225-K227 PolarHBondContact O-N 3.03Å; K227-R229 PolarHBondContact O-N 3.29Å; K227-Y301 HydrophobicContact CG-CE2 3.88Å; K227-R463 VanDerWaalsContact NZ-NH1 3.18Å
228P50.3Low64.1Low34 Ų3471.3 Ų71.322%0.22138%0.384CS..  trans-65.696.3169.626.8-30.5000105.2V226 L230 Y301V226-P228 WeakPolarHBondContact O-CD 3.41Å; V226-P228 VanDerWaalsContact O-N 3.1Å; P228-L230 PolarHBondContact O-N 3.5Å; P228-Y301 VanDerWaalsContact CD-CG 3.46Å; P228-Y301 HydrophobicContact CG-CD1 3.96Å; P228-Y301 HydrophobicContact CG-CG 4.31Å
229R53Low64Low122 Ų12273 Ų7346%0.4640%0.397SS..  trans-73.472.7162.6-65.5-164.6-170.2-174.26.9105.3K227 L231 E232K227-R229 PolarHBondContact O-N 3.29Å; R229-L231 PolarHBondContact O-N 3.22Å; R229-E232 HydrophobicContact CB-CB 4.2Å; R229-E232 VanDerWaalsContact CD-OE2 3.3Å; R229-E232 WeakPolarHBondContact CD-OE2 3.23Å; R229-E232 IonicContact CZ-OE2 3.41Å; R229-E232 IonicContact NE-OE2 2.88Å; R229-E232 IonicContact NH1-OE2 2.95Å; R229-E232 PolarHBondContact NH1-OE2 2.8Å
230L44.6Very low64.4Low126 Ų12673.3 Ų73.366%0.6640%0.399SS*.SBendtrans-69.3-8.7-174.5-157.6130.5000111.4P228P228-L230 PolarHBondContact O-N 3.5Å
231L44.8Very low64.7Low170 Ų17071.1 Ų71.189%0.8939%0.385SS*.SBendtrans-134.40.5-172.8-82.3163.5000114.7R229R229-L231 PolarHBondContact O-N 3.22Å
232E53.5Low65.4Low82 Ų8271.9 Ų71.938%0.38339%0.39SS..SBendtrans-106.6111.7173.6-156.9172.4-154.800107.4R229 I234R229-E232 HydrophobicContact CB-CB 4.2Å; R229-E232 VanDerWaalsContact CD-OE2 3.3Å; R229-E232 WeakPolarHBondContact CD-OE2 3.23Å; R229-E232 IonicContact CZ-OE2 3.41Å; R229-E232 IonicContact NE-OE2 2.88Å; R229-E232 IonicContact NH1-OE2 2.95Å; R229-E232 PolarHBondContact NH1-OE2 2.8Å; E232-I234 VanDerWaalsContact C-N 3.26Å; E232-I234 PolarHBondContact O-N 3.1Å
233D61.9Low66.5Low83 Ų8377.5 Ų77.544%0.44441%0.409SS..  trans-68.688.7-178-157.6-27000108.7E235 D236 T237D233-E235 PolarHBondContact O-N 3.05Å; D233-E235 WeakPolarHBondContact OD1-CB 3.36Å; D233-E235 PolarHBondContact OD1-N 2.95Å; D233-D236 HydrophobicContact CB-CB 3.77Å; D233-D236 WeakPolarHBondContact CB-OD2 3.4Å; D233-D236 VanDerWaalsContact CG-OD2 3.3Å; D233-D236 PolarHBondContact O-N 2.8Å; D233-D236 VanDerWaalsContact O-N 3.09Å; D233-D236 PolarHBondContact OD1-N 3.3Å; D233-T237 PolarHBondContact O-N 3.39Å; D233-T237 PolarHBondContact O-OG1 3.47Å
234I66.6Low67.8Low40 Ų4077.3 Ų77.321%0.20540%0.399CS..Hα-helixtrans-61.4-28.4178.5-62.2177.1000109.1E232 T237 L238E232-I234 VanDerWaalsContact C-N 3.26Å; E232-I234 PolarHBondContact O-N 3.1Å; I234-T237 WeakPolarHBondContact CA-OG1 3.31Å; I234-T237 PolarHBondContact O-OG1 2.98Å; I234-L238 WeakPolarHBondContact O-CB 3.32Å; I234-L238 PolarHBondContact O-N 3.49Å
235E70.3Confident69.4Low119 Ų11971.9 Ų71.956%0.55637%0.37SS*.Hα-helixtrans-63-48.4172.4-148.586.1-131.400110.1D233 L238 S239 K286D233-E235 PolarHBondContact O-N 3.05Å; D233-E235 WeakPolarHBondContact OD1-CB 3.36Å; D233-E235 PolarHBondContact OD1-N 2.95Å; E235-L238 PolarHBondContact O-N 3.4Å; E235-S239 WeakPolarHBondContact O-CB 3.31Å; E235-S239 PolarHBondContact O-N 3.46Å; E235-S239 PolarHBondContact O-OG 3.26Å; E235-K286 VanDerWaalsContact CD-NZ 3.32Å; E235-K286 IonicContact OE1-NZ 3.17Å; E235-K286 PolarHBondContact OE1-NZ 3.37Å; E235-K286 IonicContact OE2-NZ 2.69Å
236D75.8Confident71Confident87 Ų8772.6 Ų72.647%0.46537%0.374SS..Hα-helixtrans-64.9-46.8177.1-68.2-14.5000111.8D233 L238 S239 C240D233-D236 HydrophobicContact CB-CB 3.77Å; D233-D236 WeakPolarHBondContact CB-OD2 3.4Å; D233-D236 VanDerWaalsContact CG-OD2 3.3Å; D233-D236 PolarHBondContact O-N 2.8Å; D233-D236 VanDerWaalsContact O-N 3.09Å; D233-D236 PolarHBondContact OD1-N 3.3Å; D236-L238 VanDerWaalsContact C-N 3.34Å; D236-L238 PolarHBondContact O-N 2.98Å; D236-S239 WeakPolarHBondContact CA-OG 3.24Å; D236-S239 PolarHBondContact O-N 2.95Å; D236-S239 PolarHBondContact O-OG 3.02Å; D236-C240 WeakPolarHBondContact O-CB 3.44Å; D236-C240 PolarHBondContact O-N 3.12Å; D236-C240 PolarHBondContact O-SG 2.97Å
237T78.1Confident72.8Confident45 Ų4571.1 Ų71.128%0.27637%0.367SS..Hα-helixtrans-65.9-37.9179.356.80000112.1D233 I234 T241D233-T237 PolarHBondContact O-N 3.39Å; D233-T237 PolarHBondContact O-OG1 3.47Å; I234-T237 WeakPolarHBondContact CA-OG1 3.31Å; I234-T237 PolarHBondContact O-OG1 2.98Å; T237-T241 VanDerWaalsContact O-CG2 3.27Å; T237-T241 WeakPolarHBondContact O-CG2 3.21Å; T237-T241 PolarHBondContact O-N 2.83Å; T237-T241 PolarHBondContact O-OG1 2.95Å
238L82.8Confident74.2Confident28 Ų2869.5 Ų69.515%0.14736%0.361CS..Hα-helixtrans-63.6-48.1173.6-173.286.9000110.1I234 E235 D236 T241 V242 L282 V283 K286I234-L238 WeakPolarHBondContact O-CB 3.32Å; I234-L238 PolarHBondContact O-N 3.49Å; E235-L238 PolarHBondContact O-N 3.4Å; D236-L238 VanDerWaalsContact C-N 3.34Å; D236-L238 PolarHBondContact O-N 2.98Å; L238-T241 WeakPolarHBondContact CA-OG1 3.29Å; L238-T241 PolarHBondContact O-N 3.28Å; L238-T241 PolarHBondContact O-OG1 3.12Å; L238-V242 VanDerWaalsContact O-CG2 3.29Å; L238-V242 WeakPolarHBondContact O-CG2 3.24Å; L238-V242 PolarHBondContact O-N 3.17Å; L238-L282 HydrophobicContact CD1-CB 4.17Å; L238-V283 HydrophobicContact CD1-CG2 3.73Å; L238-K286 HydrophobicContact CD2-CD 4.16Å
239S83.1Confident75.9Confident45 Ų4573.2 Ų73.232%0.31537%0.371SS..Hα-helixtrans-62.3-45.7179.967.30000111.3E235 D236 T241 V242 F243E235-S239 WeakPolarHBondContact O-CB 3.31Å; E235-S239 PolarHBondContact O-N 3.46Å; E235-S239 PolarHBondContact O-OG 3.26Å; D236-S239 WeakPolarHBondContact CA-OG 3.24Å; D236-S239 PolarHBondContact O-N 2.95Å; D236-S239 PolarHBondContact O-OG 3.02Å; S239-T241 PolarHBondContact O-N 2.91Å; S239-V242 PolarHBondContact O-N 2.89Å; S239-F243 WeakPolarHBondContact O-CD2 3.26Å; S239-F243 WeakPolarHBondContact O-CG 3.38Å; S239-F243 PolarHBondContact O-N 2.61Å
240C86.1Confident77.4Confident69 Ų6974.2 Ų74.247%0.46638%0.375SS..Hα-helixtrans-55.4-47.6172.2-68.80000112.1D236 V242 F243 E244D236-C240 WeakPolarHBondContact O-CB 3.44Å; D236-C240 PolarHBondContact O-N 3.12Å; D236-C240 PolarHBondContact O-SG 2.97Å; C240-V242 VanDerWaalsContact C-N 3.33Å; C240-V242 PolarHBondContact O-N 2.9Å; C240-F243 PolarHBondContact O-N 3.32Å; C240-E244 WeakPolarHBondContact O-CG 3.23Å; C240-E244 PolarHBondContact O-N 2.8Å
241T85.6Confident79.2Confident4 Ų474.1 Ų74.13%0.02537%0.369CS..Hα-helixtrans-66.3-33.1179.257.10000113.4T237 L238 S239 E244 E245 L282T237-T241 VanDerWaalsContact O-CG2 3.27Å; T237-T241 WeakPolarHBondContact O-CG2 3.21Å; T237-T241 PolarHBondContact O-N 2.83Å; T237-T241 PolarHBondContact O-OG1 2.95Å; L238-T241 WeakPolarHBondContact CA-OG1 3.29Å; L238-T241 PolarHBondContact O-N 3.28Å; L238-T241 PolarHBondContact O-OG1 3.12Å; S239-T241 PolarHBondContact O-N 2.91Å; T241-E244 PolarHBondContact O-N 3.27Å; T241-E245 WeakPolarHBondContact O-CB 3.41Å; T241-E245 PolarHBondContact O-N 3.25Å; T241-L282 HydrophobicContact CG2-CD1 4.07Å
242V89.7Confident81Confident41 Ų4168.1 Ų68.125%0.24834%0.338CS..Hα-helixtrans-67.6-44.3174.1169.80000110.1L238 S239 C240 E244 E245 D246L238-V242 VanDerWaalsContact O-CG2 3.29Å; L238-V242 WeakPolarHBondContact O-CG2 3.24Å; L238-V242 PolarHBondContact O-N 3.17Å; S239-V242 PolarHBondContact O-N 2.89Å; C240-V242 VanDerWaalsContact C-N 3.33Å; C240-V242 PolarHBondContact O-N 2.9Å; V242-E244 VanDerWaalsContact C-N 3.33Å; V242-E244 PolarHBondContact O-N 3.38Å; V242-E245 PolarHBondContact O-N 3.33Å; V242-D246 WeakPolarHBondContact O-CB 3.24Å; V242-D246 PolarHBondContact O-N 3.5Å
243F89.6Confident82.2Confident135 Ų13568.8 Ų68.859%0.59234%0.344SS*.Hα-helixtrans-63.2-39175.3-69.7-57.3000112.4S239 C240 S247S239-F243 WeakPolarHBondContact O-CD2 3.26Å; S239-F243 WeakPolarHBondContact O-CG 3.38Å; S239-F243 PolarHBondContact O-N 2.61Å; C240-F243 PolarHBondContact O-N 3.32Å; F243-S247 VanDerWaalsContact O-CB 3.3Å; F243-S247 WeakPolarHBondContact O-CB 3.41Å; F243-S247 PolarHBondContact O-N 2.82Å
244E90.3Very high82.6Confident85 Ų8573.8 Ų73.840%0.39736%0.358SS..Hα-helixtrans-61.2-48.8172.9-76.4175.6-176.100111.3C240 T241 V242 D246 S247 L248 V275C240-E244 WeakPolarHBondContact O-CG 3.23Å; C240-E244 PolarHBondContact O-N 2.8Å; T241-E244 PolarHBondContact O-N 3.27Å; V242-E244 VanDerWaalsContact C-N 3.33Å; V242-E244 PolarHBondContact O-N 3.38Å; E244-D246 PolarHBondContact O-N 2.92Å; E244-S247 PolarHBondContact O-N 3.3Å; E244-S247 PolarHBondContact O-OG 3.23Å; E244-L248 WeakPolarHBondContact O-CG 3.45Å; E244-L248 PolarHBondContact O-N 2.81Å; E244-V275 HydrophobicContact CB-CG1 4.26Å
245E90.3Very high82.4Confident14 Ų1474.4 Ų74.47%0.06538%0.375CS..Hα-helixtrans-57.6-49.6176.6-172.8-176.2-179.600111.4T241 V242 S247 L248 Y249 Y272 V275 R279T241-E245 WeakPolarHBondContact O-CB 3.41Å; T241-E245 PolarHBondContact O-N 3.25Å; V242-E245 PolarHBondContact O-N 3.33Å; E245-S247 VanDerWaalsContact C-N 3.28Å; E245-S247 PolarHBondContact O-N 2.7Å; E245-L248 PolarHBondContact O-N 3.22Å; E245-Y249 VanDerWaalsContact O-CB 3.3Å; E245-Y249 WeakPolarHBondContact O-CB 3.4Å; E245-Y249 PolarHBondContact O-N 3.38Å; E245-Y272 HydrophobicContact CG-CD2 4.42Å; E245-Y272 HydrophobicContact CG-CE2 3.72Å; E245-V275 HydrophobicContact CB-CG1 4.08Å; E245-R279 IonicContact OE1-NH1 2.69Å; E245-R279 PolarHBondContact OE1-NH1 3.4Å; E245-R279 WeakPolarHBondContact OE2-CD 3.45Å; E245-R279 IonicContact OE2-CZ 3.54Å; E245-R279 IonicContact OE2-NE 3.89Å; E245-R279 IonicContact OE2-NH1 3.57Å; E245-R279 PolarHBondContact OE2-NH1 3.13Å
246D87.8Confident81.5Confident72 Ų7273.9 Ų73.939%0.38538%0.384SS..Hα-helixtrans-65.4-31.6-180-75.4-19.4000112.4V242 E244 R250V242-D246 WeakPolarHBondContact O-CB 3.24Å; V242-D246 PolarHBondContact O-N 3.5Å; E244-D246 PolarHBondContact O-N 2.92Å; D246-R250 WeakPolarHBondContact O-CB 3.02Å; D246-R250 VanDerWaalsContact O-CG 3.29Å; D246-R250 WeakPolarHBondContact O-CG 3.06Å; D246-R250 PolarHBondContact O-N 3.42Å; D246-R250 VanDerWaalsContact O-N 3.13Å; D246-R250 PolarHBondContact O-NE 2.89Å; D246-R250 VanDerWaalsContact O-NE 3.08Å
247S88.1Confident80.5Confident39 Ų3975.1 Ų75.127%0.27340%0.397SS..Hα-helixtrans-70-42.5174.9820000111.6F243 E244 E245 K251F243-S247 VanDerWaalsContact O-CB 3.3Å; F243-S247 WeakPolarHBondContact O-CB 3.41Å; F243-S247 PolarHBondContact O-N 2.82Å; E244-S247 PolarHBondContact O-N 3.3Å; E244-S247 PolarHBondContact O-OG 3.23Å; E245-S247 VanDerWaalsContact C-N 3.28Å; E245-S247 PolarHBondContact O-N 2.7Å; S247-K251 VanDerWaalsContact O-CG 3.31Å; S247-K251 WeakPolarHBondContact O-CG 3.4Å; S247-K251 PolarHBondContact O-N 3.41Å
248L86.4Confident79.2Confident19 Ų1977.9 Ų77.910%0.09942%0.418CS..Hα-helixtrans-70.6-41178.5-72.5175000111.2E244 E245 R250 K251 L252 M268 E271 Y272 V275E244-L248 WeakPolarHBondContact O-CG 3.45Å; E244-L248 PolarHBondContact O-N 2.81Å; E245-L248 PolarHBondContact O-N 3.22Å; L248-R250 PolarHBondContact O-N 3.42Å; L248-K251 PolarHBondContact O-N 3.02Å; L248-L252 WeakPolarHBondContact O-CB 3.49Å; L248-L252 PolarHBondContact O-N 3.24Å; L248-M268 HydrophobicContact CD2-SD 4.04Å; L248-E271 HydrophobicContact CD1-CB 4.48Å; L248-Y272 HydrophobicContact CB-CD2 4.04Å; L248-V275 HydrophobicContact CD1-CB 4.44Å; L248-V275 HydrophobicContact CD1-CG2 4.01Å
249Y85.1Confident77.7Confident113 Ų11381.9 Ų81.944%0.44345%0.447SS..Hα-helixtrans-59.8-45.1175.3-177.9-105.9000111.5E245 L252 N253 Y272E245-Y249 VanDerWaalsContact O-CB 3.3Å; E245-Y249 WeakPolarHBondContact O-CB 3.4Å; E245-Y249 PolarHBondContact O-N 3.38Å; Y249-L252 PolarHBondContact O-N 2.87Å; Y249-N253 VanDerWaalsContact CE1-ND2 3.27Å; Y249-N253 WeakPolarHBondContact CE1-ND2 3.3Å; Y249-N253 PolarHBondContact O-N 2.93Å; Y249-N253 PolarHBondContact OH-ND2 3.02Å; Y249-Y272 HydrophobicContact CD2-CE2 4.43Å
250R84.8Confident76.1Confident142 Ų14291.1 Ų91.154%0.53648%0.475SS..Hα-helixtrans-61.6-47.8174.2-78.2-177.9-79.7174.1-8.6111.5D246 L248 L252 N253 Y254D246-R250 WeakPolarHBondContact O-CB 3.02Å; D246-R250 VanDerWaalsContact O-CG 3.29Å; D246-R250 WeakPolarHBondContact O-CG 3.06Å; D246-R250 PolarHBondContact O-N 3.42Å; D246-R250 VanDerWaalsContact O-N 3.13Å; D246-R250 PolarHBondContact O-NE 2.89Å; D246-R250 VanDerWaalsContact O-NE 3.08Å; L248-R250 PolarHBondContact O-N 3.42Å; R250-L252 PolarHBondContact O-N 2.95Å; R250-N253 PolarHBondContact O-N 2.88Å; R250-Y254 HydrophobicContact CB-CD2 4.28Å; R250-Y254 HydrophobicContact CB-CE2 4.46Å; R250-Y254 HydrophobicContact CG-CE2 4.49Å; R250-Y254 VanDerWaalsContact O-CD2 3.23Å; R250-Y254 WeakPolarHBondContact O-CD2 3.28Å; R250-Y254 PolarHBondContact O-N 2.94Å
251K82.4Confident74.6Confident124 Ų12492.7 Ų92.754%0.53948%0.482SS..Hα-helixtrans-61-32.4177.7-72.7174.7180178.20113S247 L248 M268S247-K251 VanDerWaalsContact O-CG 3.31Å; S247-K251 WeakPolarHBondContact O-CG 3.4Å; S247-K251 PolarHBondContact O-N 3.41Å; L248-K251 PolarHBondContact O-N 3.02Å; K251-M268 HydrophobicContact CB-CE 3.73Å; K251-M268 HydrophobicContact CB-SD 4.04Å; K251-M268 HydrophobicContact CD-SD 4.11Å
252L81.9Confident73.2Confident44 Ų44102.8 Ų102.823%0.2353%0.526CS..Hα-helixtrans-71.8-39.7175.7-159.688.9000112L248 Y249 R250 M265L248-L252 WeakPolarHBondContact O-CB 3.49Å; L248-L252 PolarHBondContact O-N 3.24Å; Y249-L252 PolarHBondContact O-N 2.87Å; R250-L252 PolarHBondContact O-N 2.95Å; L252-M265 HydrophobicContact CD1-CE 3.65Å; L252-M265 HydrophobicContact CD1-SD 4.07Å; L252-M265 HydrophobicContact CG-CE 3.82Å; L252-M265 WeakPolarHBondContact O-CE 3.45Å
253N78.8Confident71.8Confident97 Ų97105.7 Ų105.752%0.51954%0.54SS..Hα-helixtrans-80-31.4-177.7-81.4-1.3000114Y249 R250 G255Y249-N253 VanDerWaalsContact CE1-ND2 3.27Å; Y249-N253 WeakPolarHBondContact CE1-ND2 3.3Å; Y249-N253 PolarHBondContact O-N 2.93Å; Y249-N253 PolarHBondContact OH-ND2 3.02Å; R250-N253 PolarHBondContact O-N 2.88Å; N253-G255 PolarHBondContact O-N 2.95Å; N253-G255 VanDerWaalsContact O-N 3.14Å
254Y71.9Confident71Confident187 Ų187104.3 Ų104.373%0.73354%0.538SS*.THydrogen-bonded Turntrans-8227.1176.7-77.6-75.2000113.2R250 S256R250-Y254 HydrophobicContact CB-CD2 4.28Å; R250-Y254 HydrophobicContact CB-CE2 4.46Å; R250-Y254 HydrophobicContact CG-CE2 4.49Å; R250-Y254 VanDerWaalsContact O-CD2 3.23Å; R250-Y254 WeakPolarHBondContact O-CD2 3.28Å; R250-Y254 PolarHBondContact O-N 2.94Å; Y254-S256 PolarHBondContact O-N 2.78Å
255G61.1Low70.2Confident54 Ų54104.3 Ų104.356%0.55754%0.539SS*.  trans-6539.5-173.200000117.1N253N253-G255 PolarHBondContact O-N 2.95Å; N253-G255 VanDerWaalsContact O-N 3.14Å
256S52.2Low69.6Low107 Ų107110.6 Ų110.675%0.74857%0.569SS**  trans-85.9115.5157.6-92.80000108.3Y254 S258Y254-S256 PolarHBondContact O-N 2.78Å; S256-S258 PolarHBondContact O-N 2.85Å
257P54.9Low69.3Low114 Ų114109 Ų10974%0.7457%0.566SS**  trans-65.8107176.127.5-31.7000108.1C259P257-C259 PolarHBondContact O-N 3.37Å
258S50.3Low68.8Low102 Ų102108.2 Ų108.271%0.71356%0.558SS**  trans-59.9129.8153.757.70000106.4S256 W260S256-S258 PolarHBondContact O-N 2.85Å; S258-W260 PolarHBondContact O-N 3.01Å
259C51.7Low68.7Low113 Ų113115.3 Ų115.376%0.76458%0.583SS**THydrogen-bonded Turntrans-57.713-154.3-164.20000118P257P257-C259 PolarHBondContact O-N 3.37Å
260W48.5Very low68.7Low238 Ų238117.2 Ų117.290%0.90259%0.594SS**THydrogen-bonded Turntrans-136.94.7-166.6-74.392000117.4S258S258-W260 PolarHBondContact O-N 3.01Å
261V55.2Low68.8Low102 Ų102115.8 Ų115.862%0.61859%0.594SS**  trans-134.1116.3172.8-173.10000110.5L263V261-L263 HydrophobicContact CB-CD1 4.48Å; V261-L263 HydrophobicContact CG1-CD1 3.89Å; V261-L263 PolarHBondContact O-N 3.31Å
262K55.8Low68.9Low216 Ų216111.7 Ų111.794%0.93958%0.575SS**  trans-7175.7172.9-153.6178.2-169.7-179.80108.5N264K262-N264 PolarHBondContact O-N 3.17Å
263L61.8Low69.2Low103 Ų103114.2 Ų114.254%0.53959%0.588SS.*  trans-66.3120.4-179.5-134.289.4000108.7V261 M265 M268V261-L263 HydrophobicContact CB-CD1 4.48Å; V261-L263 HydrophobicContact CG1-CD1 3.89Å; V261-L263 PolarHBondContact O-N 3.31Å; L263-M265 VanDerWaalsContact C-N 3.34Å; L263-M265 PolarHBondContact O-N 3.17Å; L263-M268 HydrophobicContact CD2-CE 3.47Å; L263-M268 VanDerWaalsContact CD2-CE 3.47Å; L263-M268 HydrophobicContact CD2-SD 4.21Å
264N72.7Confident69.7Low106 Ų106112.2 Ų112.257%0.56759%0.585SS**  trans-76.188178-167.8-1.3000109.8K262 E266 A267 M268K262-N264 PolarHBondContact O-N 3.17Å; N264-E266 PolarHBondContact O-N 2.68Å; N264-A267 HydrophobicContact CB-CB 4.12Å; N264-A267 PolarHBondContact O-N 3.19Å; N264-A267 VanDerWaalsContact O-N 3.08Å; N264-M268 PolarHBondContact O-N 2.92Å
265M72.9Confident70.4Confident84 Ų84104.3 Ų104.341%0.41456%0.556SS.*Hα-helixtrans-57.9-31.8-174.7-162.464.316400112.8L252 L263 M268 R269L252-M265 HydrophobicContact CD1-CE 3.65Å; L252-M265 HydrophobicContact CD1-SD 4.07Å; L252-M265 HydrophobicContact CG-CE 3.82Å; L252-M265 WeakPolarHBondContact O-CE 3.45Å; L263-M265 VanDerWaalsContact C-N 3.34Å; L263-M265 PolarHBondContact O-N 3.17Å; M265-M268 HydrophobicContact SD-CE 4.44Å; M265-R269 WeakPolarHBondContact O-CB 3.26Å; M265-R269 PolarHBondContact O-N 3.15Å
266E77.6Confident71.6Confident146 Ų146105.1 Ų105.168%0.68255%0.546SS*.Hα-helixtrans-69.9-36.8177.6-65-173.9177.800112.8N264 R269 K270N264-E266 PolarHBondContact O-N 2.68Å; E266-R269 PolarHBondContact O-N 3.35Å; E266-K270 WeakPolarHBondContact O-CG 3.37Å; E266-K270 PolarHBondContact O-N 3.24Å; E266-K270 VanDerWaalsContact O-N 3.11Å
267A81.1Confident73Confident39 Ų39103.7 Ų103.732%0.32254%0.535SS..Hα-helixtrans-67.8-45.3176.300000110.9N264 R269 K270 E271N264-A267 HydrophobicContact CB-CB 4.12Å; N264-A267 PolarHBondContact O-N 3.19Å; N264-A267 VanDerWaalsContact O-N 3.08Å; A267-R269 VanDerWaalsContact C-N 3.32Å; A267-R269 PolarHBondContact O-N 3.35Å; A267-K270 WeakPolarHBondContact O-CB 3.48Å; A267-K270 PolarHBondContact O-N 2.94Å; A267-E271 PolarHBondContact O-N 3.26Å
268M78.9Confident74.3Confident23 Ų23105.1 Ų105.111%0.11353%0.526CS..Hα-helixtrans-63.2-36.7175.4-86.3-140.6-51.100112.8L248 K251 L263 N264 M265 K270 E271 Y272L248-M268 HydrophobicContact CD2-SD 4.04Å; K251-M268 HydrophobicContact CB-CE 3.73Å; K251-M268 HydrophobicContact CB-SD 4.04Å; K251-M268 HydrophobicContact CD-SD 4.11Å; L263-M268 HydrophobicContact CD2-CE 3.47Å; L263-M268 VanDerWaalsContact CD2-CE 3.47Å; L263-M268 HydrophobicContact CD2-SD 4.21Å; N264-M268 PolarHBondContact O-N 2.92Å; M265-M268 HydrophobicContact SD-CE 4.44Å; M268-K270 VanDerWaalsContact C-N 3.33Å; M268-E271 PolarHBondContact O-N 3.02Å; M268-Y272 WeakPolarHBondContact O-CB 3.33Å; M268-Y272 PolarHBondContact O-N 3.33Å
269R82.7Confident75.7Confident167 Ų167104.8 Ų104.863%0.6351%0.509SS*.Hα-helixtrans-65.4-38175.8-167177.6-174.8-162.41.8111.7M265 E266 A267 L273M265-R269 WeakPolarHBondContact O-CB 3.26Å; M265-R269 PolarHBondContact O-N 3.15Å; E266-R269 PolarHBondContact O-N 3.35Å; A267-R269 VanDerWaalsContact C-N 3.32Å; A267-R269 PolarHBondContact O-N 3.35Å; R269-L273 WeakPolarHBondContact O-CG 3.44Å; R269-L273 PolarHBondContact O-N 3.34Å; R269-L273 VanDerWaalsContact O-N 3.08Å
270K86.5Confident77.1Confident153 Ų153103.9 Ų103.967%0.66550%0.5SS*.Hα-helixtrans-65.6-43.3173.3-75.5178.5-177.8175.10111.9E266 A267 M268 L273 A274E266-K270 WeakPolarHBondContact O-CG 3.37Å; E266-K270 PolarHBondContact O-N 3.24Å; E266-K270 VanDerWaalsContact O-N 3.11Å; A267-K270 WeakPolarHBondContact O-CB 3.48Å; A267-K270 PolarHBondContact O-N 2.94Å; M268-K270 VanDerWaalsContact C-N 3.33Å; K270-L273 PolarHBondContact O-N 3.5Å; K270-A274 WeakPolarHBondContact O-CB 2.98Å; K270-A274 PolarHBondContact O-N 3.33Å
271E85.4Confident78.5Confident113 Ų11395.7 Ų95.753%0.52848%0.483SS..Hα-helixtrans-63.3-42.6175.5-74.1-179.6179.200112L248 A267 M268 L273 A274 V275L248-E271 HydrophobicContact CD1-CB 4.48Å; A267-E271 PolarHBondContact O-N 3.26Å; M268-E271 PolarHBondContact O-N 3.02Å; E271-L273 PolarHBondContact O-N 2.89Å; E271-A274 WeakPolarHBondContact O-CB 2.9Å; E271-A274 PolarHBondContact O-N 3.46Å; E271-A274 VanDerWaalsContact O-N 3.17Å; E271-V275 WeakPolarHBondContact O-CG2 3.02Å; E271-V275 PolarHBondContact O-N 3.08Å
272Y85.7Confident79.3Confident37 Ų3792.8 Ų92.815%0.14546%0.464CS..Hα-helixtrans-58.3-47.8174.9175.7-100.4000111.7E245 L248 Y249 M268 A274 V275 Q276E245-Y272 HydrophobicContact CG-CD2 4.42Å; E245-Y272 HydrophobicContact CG-CE2 3.72Å; L248-Y272 HydrophobicContact CB-CD2 4.04Å; Y249-Y272 HydrophobicContact CD2-CE2 4.43Å; M268-Y272 WeakPolarHBondContact O-CB 3.33Å; M268-Y272 PolarHBondContact O-N 3.33Å; Y272-A274 VanDerWaalsContact C-N 3.3Å; Y272-A274 PolarHBondContact O-N 3.22Å; Y272-V275 PolarHBondContact O-N 3.5Å; Y272-Q276 VanDerWaalsContact O-CB 3.28Å; Y272-Q276 WeakPolarHBondContact O-CB 3.28Å; Y272-Q276 PolarHBondContact O-N 2.81Å
273L88.2Confident80.1Confident97 Ų9784.2 Ų84.251%0.50843%0.429SS..Hα-helixtrans-62.6-36.9176.1-71.3170.1000112.2R269 K270 E271 S277R269-L273 WeakPolarHBondContact O-CG 3.44Å; R269-L273 PolarHBondContact O-N 3.34Å; R269-L273 VanDerWaalsContact O-N 3.08Å; K270-L273 PolarHBondContact O-N 3.5Å; E271-L273 PolarHBondContact O-N 2.89Å; L273-S277 WeakPolarHBondContact O-CB 3.25Å; L273-S277 PolarHBondContact O-N 2.65Å
274A88.3Confident80.2Confident56 Ų5682.5 Ų82.546%0.46343%0.426SS..Hα-helixtrans-65.8-46.917600000111.7K270 E271 Y272 Q276 S277 R278K270-A274 WeakPolarHBondContact O-CB 2.98Å; K270-A274 PolarHBondContact O-N 3.33Å; E271-A274 WeakPolarHBondContact O-CB 2.9Å; E271-A274 PolarHBondContact O-N 3.46Å; E271-A274 VanDerWaalsContact O-N 3.17Å; Y272-A274 VanDerWaalsContact C-N 3.3Å; Y272-A274 PolarHBondContact O-N 3.22Å; A274-Q276 VanDerWaalsContact C-N 3.35Å; A274-Q276 PolarHBondContact O-N 2.8Å; A274-S277 PolarHBondContact O-N 3.07Å; A274-S277 PolarHBondContact O-OG 3.19Å; A274-R278 WeakPolarHBondContact O-CB 2.89Å; A274-R278 PolarHBondContact O-N 2.99Å
275V86.9Confident79.7Confident20 Ų2080.3 Ų80.312%0.12142%0.417CS..Hα-helixtrans-64.1-40176.9174.10000111E244 E245 L248 E271 Y272 R278 R279E244-V275 HydrophobicContact CB-CG1 4.26Å; E245-V275 HydrophobicContact CB-CG1 4.08Å; L248-V275 HydrophobicContact CD1-CB 4.44Å; L248-V275 HydrophobicContact CD1-CG2 4.01Å; E271-V275 WeakPolarHBondContact O-CG2 3.02Å; E271-V275 PolarHBondContact O-N 3.08Å; Y272-V275 PolarHBondContact O-N 3.5Å; V275-R278 WeakPolarHBondContact O-CB 2.83Å; V275-R278 PolarHBondContact O-N 3.3Å; V275-R279 PolarHBondContact O-N 3.39Å
276Q86.2Confident79.2Confident72 Ų7279.4 Ų79.434%0.33641%0.411SS..Hα-helixtrans-62.5-44.9175.6-169.6176.830.300111.6Y272 A274 R278 R279 V280Y272-Q276 VanDerWaalsContact O-CB 3.28Å; Y272-Q276 WeakPolarHBondContact O-CB 3.28Å; Y272-Q276 PolarHBondContact O-N 2.81Å; A274-Q276 VanDerWaalsContact C-N 3.35Å; A274-Q276 PolarHBondContact O-N 2.8Å; Q276-R278 VanDerWaalsContact C-N 3.28Å; Q276-R278 PolarHBondContact O-N 3.4Å; Q276-R279 PolarHBondContact O-N 3.04Å; Q276-V280 WeakPolarHBondContact O-CG2 3.03Å; Q276-V280 PolarHBondContact O-N 2.86Å
277S82.7Confident78.6Confident76 Ų7678.5 Ų78.553%0.53141%0.407SS..Hα-helixtrans-62-37.4175.176.90000112L273 A274 V280 A281L273-S277 WeakPolarHBondContact O-CB 3.25Å; L273-S277 PolarHBondContact O-N 2.65Å; A274-S277 PolarHBondContact O-N 3.07Å; A274-S277 PolarHBondContact O-OG 3.19Å; S277-V280 PolarHBondContact O-N 3.04Å; S277-A281 WeakPolarHBondContact O-CB 3.24Å; S277-A281 PolarHBondContact O-N 3Å
278R80.8Confident77.6Confident145 Ų14583.7 Ų83.755%0.54743%0.426SS..Hα-helixtrans-65.3-43.6176.1-168.7-179.5-174.3-170.92.2111.4A274 V275 Q276 A281 L282A274-R278 WeakPolarHBondContact O-CB 2.89Å; A274-R278 PolarHBondContact O-N 2.99Å; V275-R278 WeakPolarHBondContact O-CB 2.83Å; V275-R278 PolarHBondContact O-N 3.3Å; Q276-R278 VanDerWaalsContact C-N 3.28Å; Q276-R278 PolarHBondContact O-N 3.4Å; R278-A281 PolarHBondContact O-N 2.98Å; R278-L282 HydrophobicContact CG-CD1 4.31Å; R278-L282 VanDerWaalsContact O-CG 3.26Å; R278-L282 WeakPolarHBondContact O-CG 2.93Å; R278-L282 PolarHBondContact O-N 2.75Å
279R80.8Confident76.4Confident95 Ų9585.3 Ų85.336%0.35843%0.431SS..Hα-helixtrans-61.3-49.2174.8179.5-176.1168-147.2-1.1111.4E245 V275 Q276 A281 L282 V283E245-R279 IonicContact OE1-NH1 2.69Å; E245-R279 PolarHBondContact OE1-NH1 3.4Å; E245-R279 WeakPolarHBondContact OE2-CD 3.45Å; E245-R279 IonicContact OE2-CZ 3.54Å; E245-R279 IonicContact OE2-NE 3.89Å; E245-R279 IonicContact OE2-NH1 3.57Å; E245-R279 PolarHBondContact OE2-NH1 3.13Å; V275-R279 PolarHBondContact O-N 3.39Å; Q276-R279 PolarHBondContact O-N 3.04Å; R279-A281 VanDerWaalsContact C-N 3.26Å; R279-A281 PolarHBondContact O-N 3.13Å; R279-L282 PolarHBondContact O-N 3.17Å; R279-V283 HydrophobicContact CG-CG2 3.92Å; R279-V283 WeakPolarHBondContact O-CB 3.13Å; R279-V283 VanDerWaalsContact O-CG2 3.27Å; R279-V283 WeakPolarHBondContact O-CG2 3.48Å; R279-V283 PolarHBondContact O-N 3.11Å
280V79.9Confident75.2Confident94 Ų9488.3 Ų88.357%0.5744%0.442SS*.Hα-helixtrans-59-40.7179.1174.10000111Q276 S277 L282 V283 S284Q276-V280 WeakPolarHBondContact O-CG2 3.03Å; Q276-V280 PolarHBondContact O-N 2.86Å; S277-V280 PolarHBondContact O-N 3.04Å; V280-L282 VanDerWaalsContact C-N 3.31Å; V280-L282 PolarHBondContact O-N 3.23Å; V280-V283 PolarHBondContact O-N 3.3Å; V280-S284 WeakPolarHBondContact O-CB 3.35Å; V280-S284 PolarHBondContact O-N 3.35Å; V280-S284 VanDerWaalsContact O-N 3.08Å
281A77.9Confident73.8Confident65 Ų6590.5 Ų90.554%0.53745%0.452SS..Hα-helixtrans-66.2-27.1175.600000114S277 R278 R279 P285S277-A281 WeakPolarHBondContact O-CB 3.24Å; S277-A281 PolarHBondContact O-N 3Å; R278-A281 PolarHBondContact O-N 2.98Å; R279-A281 VanDerWaalsContact C-N 3.26Å; R279-A281 PolarHBondContact O-N 3.13Å; A281-P285 WeakPolarHBondContact O-CD 3.33Å; A281-P285 VanDerWaalsContact O-CG 3.27Å; A281-P285 WeakPolarHBondContact O-CG 3.14Å
282L73.3Confident72.4Confident42 Ų4287.3 Ų87.322%0.2245%0.445CS..Hα-helixtrans-86.5-34.4176.2-68.3171.3000112.8L238 T241 R278 R279 V280L238-L282 HydrophobicContact CD1-CB 4.17Å; T241-L282 HydrophobicContact CG2-CD1 4.07Å; R278-L282 HydrophobicContact CG-CD1 4.31Å; R278-L282 VanDerWaalsContact O-CG 3.26Å; R278-L282 WeakPolarHBondContact O-CG 2.93Å; R278-L282 PolarHBondContact O-N 2.75Å; R279-L282 PolarHBondContact O-N 3.17Å; V280-L282 VanDerWaalsContact C-N 3.31Å; V280-L282 PolarHBondContact O-N 3.23Å
283V71.7Confident71.2Confident36 Ų3688 Ų8822%0.21846%0.455CS..Hα-helixtrans-72.2-45.9-179.9171.10000111.6L238 R279 V280 K286 E287L238-V283 HydrophobicContact CD1-CG2 3.73Å; R279-V283 HydrophobicContact CG-CG2 3.92Å; R279-V283 WeakPolarHBondContact O-CB 3.13Å; R279-V283 VanDerWaalsContact O-CG2 3.27Å; R279-V283 WeakPolarHBondContact O-CG2 3.48Å; R279-V283 PolarHBondContact O-N 3.11Å; V280-V283 PolarHBondContact O-N 3.3Å; V283-K286 WeakPolarHBondContact O-CA 3.23Å; V283-K286 WeakPolarHBondContact O-CB 3.32Å; V283-K286 PolarHBondContact O-N 3.23Å; V283-E287 HydrophobicContact CG1-CG 4.11Å; V283-E287 WeakPolarHBondContact CG1-OE1 3.46Å; V283-E287 PolarHBondContact O-N 2.89Å
284S64.1Low69.8Low67 Ų6788.2 Ų88.247%0.46946%0.462SS..Hα-helixtrans-55.6-45-176.4171.50000113.1V280 K286 M288V280-S284 WeakPolarHBondContact O-CB 3.35Å; V280-S284 PolarHBondContact O-N 3.35Å; V280-S284 VanDerWaalsContact O-N 3.08Å; S284-K286 PolarHBondContact O-N 3.31Å; S284-M288 PolarHBondContact O-N 2.85Å
285P63Low68.3Low59 Ų5994.7 Ų94.738%0.38348%0.475SS..Hα-helixtrans-66.8-32.6172.4-22.233.7000114.3A281 R289A281-P285 WeakPolarHBondContact O-CD 3.33Å; A281-P285 VanDerWaalsContact O-CG 3.27Å; A281-P285 WeakPolarHBondContact O-CG 3.14Å; P285-R289 WeakPolarHBondContact O-CB 3.22Å; P285-R289 VanDerWaalsContact O-CG 3.26Å; P285-R289 WeakPolarHBondContact O-CG 3.47Å; P285-R289 PolarHBondContact O-N 3.46Å
286K62.4Low67.1Low66 Ų66100.4 Ų100.429%0.28750%0.5SS..Hα-helixtrans-68.9-41.1180-169.8175.9-178.6173.40111.2E235 L238 V283 S284 R289 R290E235-K286 VanDerWaalsContact CD-NZ 3.32Å; E235-K286 IonicContact OE1-NZ 3.17Å; E235-K286 PolarHBondContact OE1-NZ 3.37Å; E235-K286 IonicContact OE2-NZ 2.69Å; L238-K286 HydrophobicContact CD2-CD 4.16Å; V283-K286 WeakPolarHBondContact O-CA 3.23Å; V283-K286 WeakPolarHBondContact O-CB 3.32Å; V283-K286 PolarHBondContact O-N 3.23Å; S284-K286 PolarHBondContact O-N 3.31Å; K286-R289 WeakPolarHBondContact O-CB 3.33Å; K286-R289 PolarHBondContact O-N 3.37Å; K286-R290 PolarHBondContact O-N 3.14Å; K286-R290 VanDerWaalsContact O-N 3.15Å
287E64.6Low65.9Low127 Ų127102.6 Ų102.659%0.59351%0.506SS*.Hα-helixtrans-66.2-42.3175.2-70.7-179.7172.600112V283 R289 R290V283-E287 HydrophobicContact CG1-CG 4.11Å; V283-E287 WeakPolarHBondContact CG1-OE1 3.46Å; V283-E287 PolarHBondContact O-N 2.89Å; E287-R289 VanDerWaalsContact C-N 3.27Å; E287-R289 PolarHBondContact O-N 3.46Å; E287-R290 PolarHBondContact O-N 3.48Å
288M58.9Low65.1Low148 Ų148103 Ų10373%0.72950%0.502SS*.Hα-helixtrans-60.9-37.5174.4-146.899.6103.600111.5S284S284-M288 PolarHBondContact O-N 2.85Å
289R53.9Low64.5Low57 Ų5799.6 Ų99.622%0.21549%0.494CS..Hα-helixtrans-69.6-25.9176-79.4-176.5-153.4-133.711.1114.4V226 P285 K286 E287 K291 A292V226-R289 VanDerWaalsContact CG1-NH1 3.29Å; P285-R289 WeakPolarHBondContact O-CB 3.22Å; P285-R289 VanDerWaalsContact O-CG 3.26Å; P285-R289 WeakPolarHBondContact O-CG 3.47Å; P285-R289 PolarHBondContact O-N 3.46Å; K286-R289 WeakPolarHBondContact O-CB 3.33Å; K286-R289 PolarHBondContact O-N 3.37Å; E287-R289 VanDerWaalsContact C-N 3.27Å; E287-R289 PolarHBondContact O-N 3.46Å; R289-K291 PolarHBondContact O-N 2.98Å; R289-A292 PolarHBondContact O-N 3.41Å
290R59Low64.1Low229 Ų22996.1 Ų96.186%0.86449%0.488SS*.Hα-helixtrans-71.2-21.5-179.5-158.4178-174.6-173.92.2112.1K286 E287K286-R290 PolarHBondContact O-N 3.14Å; K286-R290 VanDerWaalsContact O-N 3.15Å; E287-R290 PolarHBondContact O-N 3.48Å
291K55.8Low63.8Low200 Ų20093.5 Ų93.587%0.8747%0.468SS*.THydrogen-bonded Turntrans-90.4-6.6177.5-62.7-176.6-179.3-178.80114.1R289R289-K291 PolarHBondContact O-N 2.98Å
292A56.1Low63.8Low46 Ų4693 Ų9338%0.3846%0.46SS..SBendtrans-104145.6-175.300000112.6R289R289-A292 PolarHBondContact O-N 3.41Å
293S61.2Low64.2Low50 Ų5095.1 Ų95.135%0.3547%0.47SS..  trans-62.8144.1-17870.80000112.4W295 Q296 R297S293-W295 PolarHBondContact O-N 3.33Å; S293-Q296 PolarHBondContact O-N 3.07Å; S293-Q296 WeakPolarHBondContact OG-CB 3.48Å; S293-Q296 WeakPolarHBondContact OG-CG 3.33Å; S293-Q296 PolarHBondContact OG-N 2.97Å; S293-Q296 PolarHBondContact OG-OE1 2.79Å; S293-R297 WeakPolarHBondContact O-CB 3.3Å; S293-R297 PolarHBondContact O-N 3.42Å
294P58.6Low64.8Low102 Ų10294.9 Ų94.966%0.66247%0.472SS*.Hα-helixtrans-58.4-32.1-179-23.732.4000113.9R297 N298P294-R297 WeakPolarHBondContact O-CB 3.43Å; P294-R297 PolarHBondContact O-N 2.88Å; P294-N298 PolarHBondContact O-N 2.87Å
295W56.9Low65.7Low192 Ų19293.9 Ų93.973%0.72746%0.461SS*.Hα-helixtrans-71.5-45.2-178.1-127.775.1000112.5S293 R297 L299 G300S293-W295 PolarHBondContact O-N 3.33Å; W295-R297 PolarHBondContact O-N 3.41Å; W295-L299 HydrophobicContact CD2-CD2 4.06Å; W295-L299 HydrophobicContact CE3-CD2 4.04Å; W295-L299 HydrophobicContact CH2-CD2 3.55Å; W295-L299 HydrophobicContact CZ2-CD2 3.54Å; W295-L299 HydrophobicContact CZ3-CD2 3.8Å; W295-L299 WeakPolarHBondContact O-CB 3.33Å; W295-L299 PolarHBondContact O-N 3.39Å; W295-G300 PolarHBondContact O-N 3.34Å
296Q61.1Low66.7Low141 Ų14196.6 Ų96.666%0.65947%0.471SS*.Hα-helixtrans-64.1-25.8171.9-74.4172.3-41.400112.2S293S293-Q296 PolarHBondContact O-N 3.07Å; S293-Q296 WeakPolarHBondContact OG-CB 3.48Å; S293-Q296 WeakPolarHBondContact OG-CG 3.33Å; S293-Q296 PolarHBondContact OG-N 2.97Å; S293-Q296 PolarHBondContact OG-OE1 2.79Å
297R60.8Low68Low118 Ų11897.4 Ų97.445%0.44548%0.478SS..Hα-helixtrans-79.4-32.2-172.2-154.3173.379175.45.8114.6S293 P294 W295S293-R297 WeakPolarHBondContact O-CB 3.3Å; S293-R297 PolarHBondContact O-N 3.42Å; P294-R297 WeakPolarHBondContact O-CB 3.43Å; P294-R297 PolarHBondContact O-N 2.88Å; W295-R297 PolarHBondContact O-N 3.41Å
298N65.9Low69.2Low85 Ų8592.2 Ų92.246%0.45545%0.454SS..Hα-helixtrans-122-32.9-174.1-128.831.3000113.7P294 P302P294-N298 PolarHBondContact O-N 2.87Å; N298-P302 WeakPolarHBondContact O-CD 3.45Å; N298-P302 WeakPolarHBondContact O-CG 3.4Å
299L67.9Low70.7Confident72 Ų7288.4 Ų88.438%0.37744%0.437SS..THydrogen-bonded Turntrans-96.1-31.2-177.2-161.472.8000112.4W295 Y301 P302 L303W295-L299 HydrophobicContact CD2-CD2 4.06Å; W295-L299 HydrophobicContact CE3-CD2 4.04Å; W295-L299 HydrophobicContact CH2-CD2 3.55Å; W295-L299 HydrophobicContact CZ2-CD2 3.54Å; W295-L299 HydrophobicContact CZ3-CD2 3.8Å; W295-L299 WeakPolarHBondContact O-CB 3.33Å; W295-L299 PolarHBondContact O-N 3.39Å; L299-Y301 PolarHBondContact O-N 2.88Å; L299-P302 VanDerWaalsContact O-CD 3.24Å; L299-P302 WeakPolarHBondContact O-CD 3.26Å; L299-P302 WeakPolarHBondContact O-CG 3.46Å; L299-L303 HydrophobicContact CD2-CD1 4.4Å; L299-L303 HydrophobicContact CG-CD1 4.39Å; L299-L303 WeakPolarHBondContact O-CB 3.47Å; L299-L303 PolarHBondContact O-N 3.48Å
300G72.3Confident72.4Confident23 Ų2387.9 Ų87.924%0.23744%0.444CS..Hα-helixtrans-57.7-42.9-177.500000113.9L225 W295 A304L225-G300 VanDerWaalsContact CD2-O 3.31Å; L225-G300 WeakPolarHBondContact CD2-O 3.34Å; W295-G300 PolarHBondContact O-N 3.34Å; G300-A304 WeakPolarHBondContact O-CB 3.49Å; G300-A304 PolarHBondContact O-N 3.36Å
301Y73.5Confident73.9Confident38 Ų3877.9 Ų77.915%0.14941%0.408CS..Hα-helixtrans-65.2-57.7-179.6-179.6-80.3000113.1L225 K227 P228 L299 L303 A304 M305L225-Y301 HydrophobicContact CB-CD2 3.43Å; L225-Y301 VanDerWaalsContact CB-CD2 3.43Å; L225-Y301 HydrophobicContact CB-CE2 4.33Å; L225-Y301 HydrophobicContact CB-CG 4.17Å; L225-Y301 VanDerWaalsContact CD2-N 3.34Å; L225-Y301 VanDerWaalsContact O-CD2 3.3Å; L225-Y301 WeakPolarHBondContact O-CD2 3.39Å; L225-Y301 WeakPolarHBondContact O-CE2 3.37Å; K227-Y301 HydrophobicContact CG-CE2 3.88Å; P228-Y301 VanDerWaalsContact CD-CG 3.46Å; P228-Y301 HydrophobicContact CG-CD1 3.96Å; P228-Y301 HydrophobicContact CG-CG 4.31Å; L299-Y301 PolarHBondContact O-N 2.88Å; Y301-L303 VanDerWaalsContact C-N 3.26Å; Y301-L303 PolarHBondContact O-N 3.27Å; Y301-A304 PolarHBondContact O-N 3.3Å; Y301-M305 WeakPolarHBondContact O-CB 3.48Å; Y301-M305 PolarHBondContact O-N 3.46Å
302P78.3Confident75.6Confident56 Ų5668.6 Ų68.636%0.36437%0.368SS..Hα-helixtrans-63.8-36-178.724.6-34.1000111.3N298 L299 M305 L306N298-P302 WeakPolarHBondContact O-CD 3.45Å; N298-P302 WeakPolarHBondContact O-CG 3.4Å; L299-P302 VanDerWaalsContact O-CD 3.24Å; L299-P302 WeakPolarHBondContact O-CD 3.26Å; L299-P302 WeakPolarHBondContact O-CG 3.46Å; P302-M305 PolarHBondContact O-N 3.21Å; P302-L306 WeakPolarHBondContact O-CB 3.26Å; P302-L306 PolarHBondContact O-N 2.92Å
303L82.9Confident77.3Confident85 Ų8569.1 Ų69.145%0.44537%0.366SS..Hα-helixtrans-69-43.9179.5-167.9141.9000111.9L299 Y301 L306 I307L299-L303 HydrophobicContact CD2-CD1 4.4Å; L299-L303 HydrophobicContact CG-CD1 4.39Å; L299-L303 WeakPolarHBondContact O-CB 3.47Å; L299-L303 PolarHBondContact O-N 3.48Å; Y301-L303 VanDerWaalsContact C-N 3.26Å; Y301-L303 PolarHBondContact O-N 3.27Å; L303-L306 PolarHBondContact O-N 2.92Å; L303-I307 HydrophobicContact CD2-CD1 3.48Å; L303-I307 VanDerWaalsContact CD2-CD1 3.48Å; L303-I307 HydrophobicContact CD2-CG1 4.39Å; L303-I307 HydrophobicContact CG-CD1 4.34Å; L303-I307 WeakPolarHBondContact O-CB 3.4Å; L303-I307 VanDerWaalsContact O-CG1 3.27Å; L303-I307 WeakPolarHBondContact O-CG1 3.34Å; L303-I307 PolarHBondContact O-N 3.46Å
304A83.3Confident78.7Confident31 Ų3170.6 Ų70.626%0.25637%0.368SS..Hα-helixtrans-64-41.417500000112.3T221 L225 G300 Y301 I307 L308T221-A304 HydrophobicContact CG2-CB 4.16Å; L225-A304 HydrophobicContact CD2-CB 4.12Å; G300-A304 WeakPolarHBondContact O-CB 3.49Å; G300-A304 PolarHBondContact O-N 3.36Å; Y301-A304 PolarHBondContact O-N 3.3Å; A304-I307 PolarHBondContact O-N 2.99Å; A304-L308 WeakPolarHBondContact O-CB 3.32Å; A304-L308 PolarHBondContact O-N 3.36Å
305M82.9Confident80.2Confident46 Ų4665.8 Ų65.823%0.22734%0.338CS..Hα-helixtrans-64.7-41176.5-169.574-178.300111.7F218 Y301 P302 L308 L309F218-M305 HydrophobicContact CD1-CE 3.39Å; F218-M305 HydrophobicContact CD1-SD 3.64Å; F218-M305 HydrophobicContact CE1-CE 3.86Å; F218-M305 HydrophobicContact CE1-SD 4.16Å; F218-M305 HydrophobicContact CG-CE 4.39Å; Y301-M305 WeakPolarHBondContact O-CB 3.48Å; Y301-M305 PolarHBondContact O-N 3.46Å; P302-M305 PolarHBondContact O-N 3.21Å; M305-L308 PolarHBondContact O-N 3.15Å; M305-L309 VanDerWaalsContact O-CB 3.31Å; M305-L309 WeakPolarHBondContact O-CB 3.27Å; M305-L309 PolarHBondContact O-N 2.99Å
306L85.3Confident81.9Confident116 Ų11657.7 Ų57.761%0.60731%0.309SS*.Hα-helixtrans-66.3-44176.8-169.2162.3000110.8P302 L303 L308 L309 A310P302-L306 WeakPolarHBondContact O-CB 3.26Å; P302-L306 PolarHBondContact O-N 2.92Å; L303-L306 PolarHBondContact O-N 2.92Å; L306-L308 PolarHBondContact O-N 3.22Å; L306-L309 PolarHBondContact O-N 2.82Å; L306-A310 VanDerWaalsContact O-CB 3.29Å; L306-A310 WeakPolarHBondContact O-CB 3.47Å; L306-A310 PolarHBondContact O-N 3.01Å
307I89.1Confident83.3Confident83 Ų8354.8 Ų54.843%0.42630%0.298SS..Hα-helixtrans-60.2-46.1175.1-71.1171.2000110.7L303 A304 L309 A310 L311L303-I307 HydrophobicContact CD2-CD1 3.48Å; L303-I307 VanDerWaalsContact CD2-CD1 3.48Å; L303-I307 HydrophobicContact CD2-CG1 4.39Å; L303-I307 HydrophobicContact CG-CD1 4.34Å; L303-I307 WeakPolarHBondContact O-CB 3.4Å; L303-I307 VanDerWaalsContact O-CG1 3.27Å; L303-I307 WeakPolarHBondContact O-CG1 3.34Å; L303-I307 PolarHBondContact O-N 3.46Å; A304-I307 PolarHBondContact O-N 2.99Å; I307-L309 VanDerWaalsContact C-N 3.32Å; I307-L309 PolarHBondContact O-N 3.01Å; I307-A310 PolarHBondContact O-N 3.2Å; I307-L311 HydrophobicContact CG2-CD1 3.78Å; I307-L311 HydrophobicContact CG2-CG 4.3Å; I307-L311 WeakPolarHBondContact O-CB 3.36Å; I307-L311 VanDerWaalsContact O-CG 3.3Å; I307-L311 WeakPolarHBondContact O-CG 3.49Å; I307-L311 PolarHBondContact O-N 3.49Å
308L89.4Confident84.6Confident19 Ų1951.1 Ų51.110%0.09929%0.286CS..Hα-helixtrans-62.8-41.3179-147.3104.3000111.4M217 F218 A304 M305 L306 T312 Y364M217-L308 HydrophobicContact CB-CD1 4.18Å; M217-L308 HydrophobicContact CB-CD2 4Å; F218-L308 HydrophobicContact CB-CD2 4.19Å; F218-L308 HydrophobicContact CD1-CB 4.37Å; F218-L308 HydrophobicContact CD1-CD2 3.27Å; F218-L308 HydrophobicContact CD1-CG 4.4Å; F218-L308 HydrophobicContact CD2-CD2 3.56Å; F218-L308 HydrophobicContact CE1-CB 3.89Å; F218-L308 HydrophobicContact CE1-CD2 3.41Å; F218-L308 VanDerWaalsContact CE1-CD2 3.41Å; F218-L308 HydrophobicContact CE1-CG 4.17Å; F218-L308 HydrophobicContact CE2-CD2 3.67Å; F218-L308 HydrophobicContact CG-CD2 3.37Å; F218-L308 HydrophobicContact CZ-CB 4.29Å; F218-L308 HydrophobicContact CZ-CD2 3.61Å; F218-L308 HydrophobicContact CZ-CG 4.3Å; A304-L308 WeakPolarHBondContact O-CB 3.32Å; A304-L308 PolarHBondContact O-N 3.36Å; M305-L308 PolarHBondContact O-N 3.15Å; L306-L308 PolarHBondContact O-N 3.22Å; L308-T312 WeakPolarHBondContact O-CG2 3.46Å; L308-T312 PolarHBondContact O-N 2.87Å; L308-T312 PolarHBondContact O-OG1 3.47Å; L308-Y364 HydrophobicContact CD1-CE2 3.97Å; L308-Y364 HydrophobicContact CG-CE2 4.14Å
309L89.6Confident85.7Confident68 Ų6847 Ų4736%0.35626%0.264SS..Hα-helixtrans-64.6-45.1174.9-176.864.1000112F218 M305 L306 I307 T312 V313 L453 V457F218-L309 HydrophobicContact CE1-CB 4.34Å; F218-L309 HydrophobicContact CZ-CB 4.45Å; F218-L309 HydrophobicContact CZ-CD1 4.43Å; M305-L309 VanDerWaalsContact O-CB 3.31Å; M305-L309 WeakPolarHBondContact O-CB 3.27Å; M305-L309 PolarHBondContact O-N 2.99Å; L306-L309 PolarHBondContact O-N 2.82Å; I307-L309 VanDerWaalsContact C-N 3.32Å; I307-L309 PolarHBondContact O-N 3.01Å; L309-T312 WeakPolarHBondContact CA-OG1 3.49Å; L309-T312 PolarHBondContact O-N 2.89Å; L309-T312 PolarHBondContact O-OG1 3.31Å; L309-V313 HydrophobicContact CD1-CG2 4.16Å; L309-V313 HydrophobicContact CG-CG2 4.44Å; L309-V313 WeakPolarHBondContact O-CB 3.39Å; L309-V313 VanDerWaalsContact O-CG2 3.26Å; L309-V313 WeakPolarHBondContact O-CG2 3.41Å; L309-V313 PolarHBondContact O-N 3.22Å; L309-L453 HydrophobicContact CD1-CD1 3.72Å; L309-V457 HydrophobicContact CD1-CG2 4.38Å
310A90.6Very high86.8Confident45 Ų4546.4 Ų46.437%0.37227%0.265SS..Hα-helixtrans-62.1-46.7178.200000110.9L306 I307 T312 V313 M314L306-A310 VanDerWaalsContact O-CB 3.29Å; L306-A310 WeakPolarHBondContact O-CB 3.47Å; L306-A310 PolarHBondContact O-N 3.01Å; I307-A310 PolarHBondContact O-N 3.2Å; A310-T312 PolarHBondContact O-N 3.42Å; A310-V313 PolarHBondContact O-N 2.9Å; A310-M314 VanDerWaalsContact O-CB 3.31Å; A310-M314 WeakPolarHBondContact O-CB 3.24Å; A310-M314 WeakPolarHBondContact O-CG 3.22Å; A310-M314 PolarHBondContact O-N 2.9Å
311L91.5Very high87.5Confident20 Ų2051.9 Ų51.911%0.10528%0.283CS..Hα-helixtrans-62.6-42.6178.1-70.3172.1000112.3I307 C315 L360 L361 Y364I307-L311 HydrophobicContact CG2-CD1 3.78Å; I307-L311 HydrophobicContact CG2-CG 4.3Å; I307-L311 WeakPolarHBondContact O-CB 3.36Å; I307-L311 VanDerWaalsContact O-CG 3.3Å; I307-L311 WeakPolarHBondContact O-CG 3.49Å; I307-L311 PolarHBondContact O-N 3.49Å; L311-C315 VanDerWaalsContact O-CB 3.3Å; L311-C315 WeakPolarHBondContact O-CB 3.4Å; L311-C315 PolarHBondContact O-N 3.4Å; L311-L360 HydrophobicContact CD2-CD2 3.73Å; L311-L360 HydrophobicContact CD2-CG 3.83Å; L311-L361 HydrophobicContact CD2-CD2 4.08Å; L311-L361 WeakPolarHBondContact O-CD2 3Å; L311-Y364 HydrophobicContact CB-CD1 3.87Å; L311-Y364 HydrophobicContact CB-CD2 4.47Å; L311-Y364 HydrophobicContact CB-CE1 3.85Å; L311-Y364 HydrophobicContact CB-CE2 4.48Å; L311-Y364 HydrophobicContact CB-CG 4.17Å; L311-Y364 HydrophobicContact CD1-CD2 3.87Å; L311-Y364 HydrophobicContact CD1-CE2 4.33Å; L311-Y364 HydrophobicContact CD1-CG 3.95Å
312T91Very high88.1Confident4 Ų451 Ų513%0.02528%0.281CS..Hα-helixtrans-64.7-45.717646.50000112.9L214 F218 L308 L309 A310 C315 V316 Y364L214-T312 HydrophobicContact CB-CG2 4.41Å; L214-T312 HydrophobicContact CD1-CG2 4.09Å; L214-T312 HydrophobicContact CD2-CG2 3.92Å; L214-T312 HydrophobicContact CG-CG2 4.37Å; F218-T312 HydrophobicContact CE2-CG2 3.82Å; F218-T312 HydrophobicContact CZ-CG2 4.08Å; L308-T312 WeakPolarHBondContact O-CG2 3.46Å; L308-T312 PolarHBondContact O-N 2.87Å; L308-T312 PolarHBondContact O-OG1 3.47Å; L309-T312 WeakPolarHBondContact CA-OG1 3.49Å; L309-T312 PolarHBondContact O-N 2.89Å; L309-T312 PolarHBondContact O-OG1 3.31Å; A310-T312 PolarHBondContact O-N 3.42Å; T312-C315 WeakPolarHBondContact O-CB 3.43Å; T312-C315 PolarHBondContact O-N 3.34Å; T312-V316 WeakPolarHBondContact O-CG2 3.06Å; T312-V316 PolarHBondContact O-N 2.94Å; T312-Y364 HydrophobicContact CG2-CE1 4.05Å; T312-Y364 WeakPolarHBondContact CG2-OH 3.43Å
313V91.4Very high88.5Confident57 Ų5749 Ų4935%0.34527%0.267SS..Hα-helixtrans-63.6-44.9178.3171.20000110.5L309 A310 C315 V316 L317 L453L309-V313 HydrophobicContact CD1-CG2 4.16Å; L309-V313 HydrophobicContact CG-CG2 4.44Å; L309-V313 WeakPolarHBondContact O-CB 3.39Å; L309-V313 VanDerWaalsContact O-CG2 3.26Å; L309-V313 WeakPolarHBondContact O-CG2 3.41Å; L309-V313 PolarHBondContact O-N 3.22Å; A310-V313 PolarHBondContact O-N 2.9Å; V313-C315 VanDerWaalsContact C-N 3.31Å; V313-C315 PolarHBondContact O-N 3.44Å; V313-V316 PolarHBondContact O-N 3.49Å; V313-L317 HydrophobicContact CG1-CD1 3.88Å; V313-L317 HydrophobicContact CG1-CG 4.26Å; V313-L317 WeakPolarHBondContact O-CB 3.49Å; V313-L317 VanDerWaalsContact O-CG 3.28Å; V313-L317 WeakPolarHBondContact O-CG 3.44Å; V313-L317 PolarHBondContact O-N 2.77Å; V313-L453 HydrophobicContact CG2-CD2 4.07Å
314M90.1Very high88.7Confident81 Ų8149.3 Ų49.340%0.39927%0.269SS..Hα-helixtrans-61-39.8176.3-71.6-58.6-63.100112.2A310 L317 M318 L361A310-M314 VanDerWaalsContact O-CB 3.31Å; A310-M314 WeakPolarHBondContact O-CB 3.24Å; A310-M314 WeakPolarHBondContact O-CG 3.22Å; A310-M314 PolarHBondContact O-N 2.9Å; M314-L317 PolarHBondContact O-N 3.24Å; M314-M318 WeakPolarHBondContact O-CG 3.32Å; M314-M318 PolarHBondContact O-N 3.43Å; M314-L361 HydrophobicContact CB-CD2 4.47Å
315C90.8Very high88.7Confident2 Ų251.3 Ų51.31%0.01427%0.273CS..Hα-helixtrans-62-49.3175.3-177.90000111.8L311 T312 V313 L317 M318 V319 L361L311-C315 VanDerWaalsContact O-CB 3.3Å; L311-C315 WeakPolarHBondContact O-CB 3.4Å; L311-C315 PolarHBondContact O-N 3.4Å; T312-C315 WeakPolarHBondContact O-CB 3.43Å; T312-C315 PolarHBondContact O-N 3.34Å; V313-C315 VanDerWaalsContact C-N 3.31Å; V313-C315 PolarHBondContact O-N 3.44Å; C315-L317 VanDerWaalsContact C-N 3.35Å; C315-L317 PolarHBondContact O-N 2.88Å; C315-M318 PolarHBondContact O-N 3.33Å; C315-V319 WeakPolarHBondContact O-CG2 3.31Å; C315-V319 PolarHBondContact O-N 3.06Å; C315-L361 HydrophobicContact CB-CD2 4.08Å
316V91.9Very high88.7Confident21 Ų2149.4 Ų49.413%0.12726%0.264CS..Hα-helixtrans-61.4-44177.7173.30000110.9T312 V313 V319 C320T312-V316 WeakPolarHBondContact O-CG2 3.06Å; T312-V316 PolarHBondContact O-N 2.94Å; V313-V316 PolarHBondContact O-N 3.49Å; V316-V319 PolarHBondContact O-N 3.35Å; V316-C320 WeakPolarHBondContact O-CB 3.42Å; V316-C320 PolarHBondContact O-N 2.88Å; V316-C320 PolarHBondContact O-SG 3.47Å
317L90.5Very high88.6Confident80 Ų8048.9 Ų48.942%0.41926%0.261SS..Hα-helixtrans-60.4-47.4177.9-72.7174.5000111.6V313 M314 C315 V319 C320 F321V313-L317 HydrophobicContact CG1-CD1 3.88Å; V313-L317 HydrophobicContact CG1-CG 4.26Å; V313-L317 WeakPolarHBondContact O-CB 3.49Å; V313-L317 VanDerWaalsContact O-CG 3.28Å; V313-L317 WeakPolarHBondContact O-CG 3.44Å; V313-L317 PolarHBondContact O-N 2.77Å; M314-L317 PolarHBondContact O-N 3.24Å; C315-L317 VanDerWaalsContact C-N 3.35Å; C315-L317 PolarHBondContact O-N 2.88Å; L317-V319 VanDerWaalsContact C-N 3.34Å; L317-V319 PolarHBondContact O-N 2.95Å; L317-C320 PolarHBondContact O-N 3.46Å; L317-F321 HydrophobicContact CB-CE2 4.44Å; L317-F321 WeakPolarHBondContact O-CD2 3.3Å; L317-F321 PolarHBondContact O-N 3Å
318M87.9Confident88.3Confident41 Ų4151.7 Ų51.720%0.20228%0.276CS..Hα-helixtrans-58.7-44.5177.2-79.1-172175.900112.1M314 C315 F321 N322 V357 L361 I417M314-M318 WeakPolarHBondContact O-CG 3.32Å; M314-M318 PolarHBondContact O-N 3.43Å; C315-M318 PolarHBondContact O-N 3.33Å; M318-F321 PolarHBondContact O-N 3.29Å; M318-N322 WeakPolarHBondContact O-CB 3.36Å; M318-N322 PolarHBondContact O-N 2.97Å; M318-V357 HydrophobicContact CE-CG1 4.43Å; M318-L361 HydrophobicContact CE-CD1 3.82Å; M318-L361 HydrophobicContact SD-CD1 3.49Å; M318-L361 WeakPolarHBondContact SD-CD1 3.41Å; M318-I417 HydrophobicContact SD-CG2 4.44Å
319V90.1Very high87.5Confident0 Ų054.2 Ų54.20%029%0.289CS..Hα-helixtrans-65.8-41177.9176.30000111.2C315 V316 L317 F321 N322 V323 L415 N442 F445 A446C315-V319 WeakPolarHBondContact O-CG2 3.31Å; C315-V319 PolarHBondContact O-N 3.06Å; V316-V319 PolarHBondContact O-N 3.35Å; L317-V319 VanDerWaalsContact C-N 3.34Å; L317-V319 PolarHBondContact O-N 2.95Å; V319-F321 VanDerWaalsContact C-N 3.34Å; V319-F321 PolarHBondContact O-N 3.34Å; V319-N322 WeakPolarHBondContact O-CB 3.43Å; V319-N322 PolarHBondContact O-N 3.32Å; V319-V323 HydrophobicContact CG1-CG2 4.46Å; V319-V323 WeakPolarHBondContact O-CG2 3.37Å; V319-V323 PolarHBondContact O-N 2.97Å; V319-L415 HydrophobicContact CG1-CD2 4.3Å; V319-L415 HydrophobicContact CG2-CB 4.03Å; V319-L415 HydrophobicContact CG2-CD1 4.39Å; V319-L415 HydrophobicContact CG2-CD2 4.01Å; V319-L415 HydrophobicContact CG2-CG 4.37Å; V319-N442 HydrophobicContact CG1-CB 4.26Å; V319-F445 HydrophobicContact CB-CD1 4.44Å; V319-F445 HydrophobicContact CG1-CD1 4.17Å; V319-F445 HydrophobicContact CG2-CD1 3.88Å; V319-F445 HydrophobicContact CG2-CE1 3.84Å; V319-A446 HydrophobicContact CG1-CB 4.16Å
320C89.4Confident86.2Confident59 Ų5957.9 Ų57.940%0.39931%0.305SS..Hα-helixtrans-62.1-40.7175.2-71.40000112.2V316 L317 V323 L324V316-C320 WeakPolarHBondContact O-CB 3.42Å; V316-C320 PolarHBondContact O-N 2.88Å; V316-C320 PolarHBondContact O-SG 3.47Å; L317-C320 PolarHBondContact O-N 3.46Å; C320-V323 PolarHBondContact O-N 3.06Å; C320-L324 PolarHBondContact O-N 3.41Å
321F87.6Confident84.6Confident138 Ų13861 Ų6161%0.60532%0.319SS*.Hα-helixtrans-63.8-42.1173.3-78.8-64.2000111.7L317 M318 V319 V323 L324 E325L317-F321 HydrophobicContact CB-CE2 4.44Å; L317-F321 WeakPolarHBondContact O-CD2 3.3Å; L317-F321 PolarHBondContact O-N 3Å; M318-F321 PolarHBondContact O-N 3.29Å; V319-F321 VanDerWaalsContact C-N 3.34Å; V319-F321 PolarHBondContact O-N 3.34Å; F321-V323 PolarHBondContact O-N 3Å; F321-L324 WeakPolarHBondContact O-CB 3.37Å; F321-L324 PolarHBondContact O-N 3.31Å; F321-E325 WeakPolarHBondContact O-CB 3.28Å; F321-E325 PolarHBondContact O-N 2.87Å
322N86.3Confident83Confident20 Ų2061.5 Ų61.511%0.10733%0.326CS..Hα-helixtrans-61.7-42.2175.5-176.657.4000112.2M318 V319 L324 E325 L326 T414 L415 G416 N442M318-N322 WeakPolarHBondContact O-CB 3.36Å; M318-N322 PolarHBondContact O-N 2.97Å; V319-N322 WeakPolarHBondContact O-CB 3.43Å; V319-N322 PolarHBondContact O-N 3.32Å; N322-L324 VanDerWaalsContact C-N 3.32Å; N322-L324 PolarHBondContact O-N 2.83Å; N322-E325 PolarHBondContact O-N 3.4Å; N322-L326 WeakPolarHBondContact O-CB 3.44Å; N322-L326 VanDerWaalsContact O-CG 3.3Å; N322-L326 WeakPolarHBondContact O-CG 3.17Å; N322-L326 PolarHBondContact O-N 3.02Å; N322-T414 PolarHBondContact ND2-O 3.41Å; N322-L415 PolarHBondContact ND2-O 2.97Å; N322-G416 VanDerWaalsContact CG-CA 3.49Å; N322-G416 PolarHBondContact ND2-N 3.22Å; N322-N442 PolarHBondContact ND2-OD1 2.93Å
323V87.3Confident81.6Confident12 Ų1262.1 Ų62.17%0.07333%0.329CS..Hα-helixtrans-61.6-40.8174.5169.10000111.5V319 C320 F321 L327 F439 N442 M443V319-V323 HydrophobicContact CG1-CG2 4.46Å; V319-V323 WeakPolarHBondContact O-CG2 3.37Å; V319-V323 PolarHBondContact O-N 2.97Å; C320-V323 PolarHBondContact O-N 3.06Å; F321-V323 PolarHBondContact O-N 3Å; V323-L327 HydrophobicContact CG1-CD1 4.46Å; V323-L327 WeakPolarHBondContact O-CB 3.31Å; V323-L327 PolarHBondContact O-N 3.42Å; V323-L327 VanDerWaalsContact O-N 3.11Å; V323-F439 HydrophobicContact CG1-CD2 4.42Å; V323-F439 HydrophobicContact CG1-CE2 3.86Å; V323-N442 HydrophobicContact CG2-CB 3.48Å; V323-N442 VanDerWaalsContact CG2-CB 3.48Å; V323-M443 HydrophobicContact CG1-CE 3.48Å; V323-M443 VanDerWaalsContact CG1-CE 3.48Å; V323-M443 HydrophobicContact CG1-SD 4.05Å
324L85.9Confident80Confident93 Ų9360.1 Ų60.149%0.48732%0.318SS..Hα-helixtrans-67.1-42176.6-174.967000111.5C320 F321 N322 L327 L328C320-L324 PolarHBondContact O-N 3.41Å; F321-L324 WeakPolarHBondContact O-CB 3.37Å; F321-L324 PolarHBondContact O-N 3.31Å; N322-L324 VanDerWaalsContact C-N 3.32Å; N322-L324 PolarHBondContact O-N 2.83Å; L324-L327 PolarHBondContact O-N 2.95Å; L324-L328 HydrophobicContact CD1-CD1 4.26Å; L324-L328 HydrophobicContact CG-CD1 4.02Å; L324-L328 WeakPolarHBondContact O-CG 3.36Å; L324-L328 PolarHBondContact O-N 2.76Å; L324-L328 VanDerWaalsContact O-N 3.13Å
325E83.8Confident78.4Confident73 Ų7363.4 Ų63.434%0.34133%0.325SS..Hα-helixtrans-61.2-46.6176-169.9169.9-167.400110.8F321 N322 L327 L328 D329 A332 R419F321-E325 WeakPolarHBondContact O-CB 3.28Å; F321-E325 PolarHBondContact O-N 2.87Å; N322-E325 PolarHBondContact O-N 3.4Å; E325-L327 VanDerWaalsContact C-N 3.27Å; E325-L327 PolarHBondContact O-N 3.29Å; E325-L328 PolarHBondContact O-N 2.88Å; E325-L328 VanDerWaalsContact O-N 3.17Å; E325-D329 PolarHBondContact O-N 3.43Å; E325-A332 HydrophobicContact CG-CB 3.91Å; E325-R419 IonicContact OE1-CZ 2.7Å; E325-R419 IonicContact OE1-NH2 3.57Å; E325-R419 PolarHBondContact OE1-NH2 2.94Å; E325-R419 IonicContact OE2-NH2 3.1Å; E325-R419 PolarHBondContact OE2-NH2 3.48Å
326L83.2Confident76.4Confident5 Ų565 Ų653%0.02634%0.343CS..Hα-helixtrans-60.2-33.2174.8-73.8169000113.1N322 M333 F435 V438N322-L326 WeakPolarHBondContact O-CB 3.44Å; N322-L326 VanDerWaalsContact O-CG 3.3Å; N322-L326 WeakPolarHBondContact O-CG 3.17Å; N322-L326 PolarHBondContact O-N 3.02Å; L326-M333 HydrophobicContact CD2-CG 4.48Å; L326-F435 HydrophobicContact CB-CE2 4.22Å; L326-F435 WeakPolarHBondContact O-CE2 3.38Å; L326-V438 HydrophobicContact CD1-CG1 4.06Å
327L83.5Confident74.2Confident106 Ų10670.9 Ų70.956%0.55537%0.371SS*.Hα-helixtrans-74.6-28.4178.5-113.9151.7000113.1V323 L324 E325 F439V323-L327 HydrophobicContact CG1-CD1 4.46Å; V323-L327 WeakPolarHBondContact O-CB 3.31Å; V323-L327 PolarHBondContact O-N 3.42Å; V323-L327 VanDerWaalsContact O-N 3.11Å; L324-L327 PolarHBondContact O-N 2.95Å; E325-L327 VanDerWaalsContact C-N 3.27Å; E325-L327 PolarHBondContact O-N 3.29Å; L327-F439 HydrophobicContact CD1-CE2 3.77Å; L327-F439 HydrophobicContact CD1-CZ 4.29Å; L327-F439 HydrophobicContact CG-CE2 4.21Å
328L82Confident72Confident142 Ų14276 Ų7674%0.74339%0.392SS*.Hα-helixtrans-95.4-29.7-176.4-67.4172.9000112.7L324 E325L324-L328 HydrophobicContact CD1-CD1 4.26Å; L324-L328 HydrophobicContact CG-CD1 4.02Å; L324-L328 WeakPolarHBondContact O-CG 3.36Å; L324-L328 PolarHBondContact O-N 2.76Å; L324-L328 VanDerWaalsContact O-N 3.13Å; E325-L328 PolarHBondContact O-N 2.88Å; E325-L328 VanDerWaalsContact O-N 3.17Å
329D73.3Confident69.9Low71 Ų7179.8 Ų79.838%0.3841%0.413SS..  trans-136.1107.8-174.6-167.8-6.2000111.7E325 T331 A332E325-D329 PolarHBondContact O-N 3.43Å; D329-T331 PolarHBondContact O-N 3.44Å; D329-T331 WeakPolarHBondContact OD1-CB 3.44Å; D329-T331 PolarHBondContact OD1-N 3.3Å; D329-T331 PolarHBondContact OD1-OG1 2.93Å; D329-T331 PolarHBondContact OD2-OG1 3.48Å; D329-A332 HydrophobicContact CB-CB 4.32Å; D329-A332 WeakPolarHBondContact O-CB 3.26Å; D329-A332 PolarHBondContact O-N 2.88Å
330E61.8Low68Low146 Ų14681.4 Ų81.468%0.68242%0.424SS*.G310 helixtrans-67.3-14.3175.6-66.5-160.8175.300112.9A332 M333E330-A332 VanDerWaalsContact C-N 3.34Å; E330-M333 HydrophobicContact CB-CE 4.35Å; E330-M333 WeakPolarHBondContact O-CE 3.41Å
331T58Low66.1Low109 Ų10985.7 Ų85.767%0.66944%0.438SS*.G310 helixtrans-82.1-13.3176.670.70000113.5D329 M333D329-T331 PolarHBondContact O-N 3.44Å; D329-T331 WeakPolarHBondContact OD1-CB 3.44Å; D329-T331 PolarHBondContact OD1-N 3.3Å; D329-T331 PolarHBondContact OD1-OG1 2.93Å; D329-T331 PolarHBondContact OD2-OG1 3.48Å; T331-M333 PolarHBondContact O-N 2.96Å
332A57.7Low64.4Low31 Ų3180.8 Ų80.826%0.25642%0.418SS..G310 helixtrans-76.62.4175.600000113.9E325 D329 E330E325-A332 HydrophobicContact CG-CB 3.91Å; D329-A332 HydrophobicContact CB-CB 4.32Å; D329-A332 WeakPolarHBondContact O-CB 3.26Å; D329-A332 PolarHBondContact O-N 2.88Å; E330-A332 VanDerWaalsContact C-N 3.34Å
333M61.4Low62.7Low18 Ų1881.2 Ų81.29%0.08943%0.427CS..SBendtrans-55.6145172.1-78.9-171.7-90.500110.5L326 E330 T331 R335 F435L326-M333 HydrophobicContact CD2-CG 4.48Å; E330-M333 HydrophobicContact CB-CE 4.35Å; E330-M333 WeakPolarHBondContact O-CE 3.41Å; T331-M333 PolarHBondContact O-N 2.96Å; M333-R335 HydrophobicContact CB-CG 4.14Å; M333-R335 VanDerWaalsContact CE-CZ 3.49Å; M333-R335 PolarHBondContact O-N 3.36Å; M333-F435 HydrophobicContact SD-CB 4.24Å
334P57.7Low60.9Low15 Ų1588.2 Ų88.210%0.09746%0.461CS..  trans-72.151.8178.931.3-36000111.9R413 L432 V438P334-R413 HydrophobicContact CB-CG 3.92Å; P334-R413 PolarHBondContact O-NH2 3.45Å; P334-L432 HydrophobicContact CB-CD2 4.35Å; P334-L432 HydrophobicContact CG-CD2 4.35Å; P334-L432 HydrophobicContact CG-CG 4.27Å; P334-V438 HydrophobicContact CG-CG2 4.44Å
335R55.4Low59.3Low149 Ų14987 Ų8756%0.56246%0.464SS*.PPolyproline II helixtrans-71.7130.9173-68.2-178.7174.2154.5-2.7108.3M333 M337 R413M333-R335 HydrophobicContact CB-CG 4.14Å; M333-R335 VanDerWaalsContact CE-CZ 3.49Å; M333-R335 PolarHBondContact O-N 3.36Å; R335-M337 PolarHBondContact O-N 2.88Å; R335-R413 PolarHBondContact O-NH2 3Å
336G50.2Low57.8Low37 Ų3785.7 Ų85.738%0.38146%0.463SS..PPolyproline II helixtrans-57.6122.4178.900000110.3D421G336-D421 WeakPolarHBondContact CA-OD2 3.31Å
337M46.1Very low56.7Low144 Ų14487.8 Ų87.871%0.70947%0.472SS*.PPolyproline II helixtrans-79.6133.9171.8-126.4-179.5-175.200108.7R335 D339 D421R335-M337 PolarHBondContact O-N 2.88Å; M337-D339 VanDerWaalsContact C-N 3.28Å; M337-D339 PolarHBondContact O-N 3.4Å; M337-D421 PolarHBondContact N-OD2 3.49Å
338E44.1Very low55.4Low187 Ų18783.7 Ų83.787%0.87445%0.452SS*.SBendtrans-71.3-18-174.2-74.9-176.5147.200113.7
339D43.6Very low54.3Low120 Ų12085.4 Ų85.464%0.64246%0.458SS*.  trans-150.3101.9177.1-72.6-54.7000113.2M337 H341M337-D339 VanDerWaalsContact C-N 3.28Å; M337-D339 PolarHBondContact O-N 3.4Å; D339-H341 PolarHBondContact O-N 2.92Å
340P49.4Very low53.7Low35 Ų3590.4 Ų90.423%0.22748%0.477CS..  trans-82.495.2170.532.7-33.6000110L342 D421 L422P340-L342 PolarHBondContact O-N 3.36Å; P340-D421 WeakPolarHBondContact CG-O 3.4Å; P340-L422 HydrophobicContact CB-CD1 3.76Å; P340-L422 HydrophobicContact CG-CD1 3.62Å; P340-L422 HydrophobicContact CG-CG 3.91Å
341H49.3Very low54.4Low149 Ų14984.5 Ų84.569%0.6946%0.455SS*.  trans-66.392.9167.4-69.9-78.4000110.3D339 M344D339-H341 PolarHBondContact O-N 2.92Å; H341-M344 HydrophobicContact CB-CG 4.33Å
342L52.1Low55.4Low34 Ų3482.6 Ų82.618%0.17845%0.446CS..THydrogen-bonded Turntrans-58.1142170.5-84.1129.6000111.2N87 I107 P340 F420 L422N87-L342 HydrophobicContact CB-CD2 4.04Å; I107-L342 HydrophobicContact CD1-CD2 3.97Å; P340-L342 PolarHBondContact O-N 3.36Å; L342-F420 HydrophobicContact CD2-CE2 3.82Å; L342-F420 HydrophobicContact CD2-CZ 4.16Å; L342-F420 HydrophobicContact CG-CE2 4.35Å; L342-L422 HydrophobicContact CD1-CD1 3.57Å; L342-L422 HydrophobicContact CD1-CD2 3.7Å; L342-L422 HydrophobicContact CD1-CG 4.21Å; L342-L422 HydrophobicContact CD2-CD1 4.44Å; L342-L422 HydrophobicContact CG-CD1 3.97Å
343G50.2Low56.5Low29 Ų2987.5 Ų87.530%0.29947%0.468SS..THydrogen-bonded Turntrans8810.4170.900000116.8N87 L91N87-G343 PolarHBondContact OD1-N 3.05Å; L91-G343 WeakPolarHBondContact CD2-O 3.46Å
344M50.6Low57.5Low160 Ų16087 Ų8779%0.78847%0.467SS*.SBendtrans-96.3-28.8177.8-68.6-67-73.400113.9H341H341-M344 HydrophobicContact CB-CG 4.33Å
345A52.6Low58.7Low67 Ų6786.3 Ų86.355%0.55446%0.463SS*.SBendtrans-152.5150.6176.700000111
346S52.1Low60.1Low46 Ų4681.7 Ų81.732%0.32246%0.457SS..  trans-65.1137.9171.1-69.70000110.2E88 S348E88-S346 WeakPolarHBondContact OE1-CA 3.29Å; E88-S346 PolarHBondContact OE2-OG 3.33Å; S346-S348 PolarHBondContact O-N 3.36Å
347F58.6Low61.9Low49 Ų4982.5 Ų82.522%0.21545%0.454CS..SBendtrans-76.7-0.5-176.1-65.8-58.6000114.5N87 E88 Q358 F420N87-F347 HydrophobicContact CB-CD2 4.01Å; N87-F347 HydrophobicContact CB-CE2 3.5Å; N87-F347 VanDerWaalsContact ND2-CD2 3.27Å; N87-F347 WeakPolarHBondContact ND2-CD2 3.19Å; N87-F347 WeakPolarHBondContact ND2-CE2 3.27Å; N87-F347 WeakPolarHBondContact OD1-CE2 3.19Å; E88-F347 PolarHBondContact OE1-N 3.34Å; F347-Q358 PolarHBondContact O-NE2 3.45Å; F347-F420 AromaticContact CD2-CD2 3.99Å; F347-F420 HydrophobicContact CD2-CD2 3.99Å; F347-F420 HydrophobicContact CD2-CE2 4.49Å; F347-F420 HydrophobicContact CE1-CD2 4.18Å; F347-F420 AromaticContact CE2-CD2 3.42Å; F347-F420 HydrophobicContact CE2-CD2 3.42Å; F347-F420 VanDerWaalsContact CE2-CD2 3.42Å; F347-F420 AromaticContact CE2-CE2 3.59Å; F347-F420 HydrophobicContact CE2-CE2 3.59Å; F347-F420 AromaticContact CZ-CD2 3.57Å; F347-F420 HydrophobicContact CZ-CD2 3.57Å; F347-F420 AromaticContact CZ-CE2 3.77Å; F347-F420 HydrophobicContact CZ-CE2 3.77Å
348S57.7Low63.9Low19 Ų1976.2 Ų76.213%0.13342%0.423CS..SBendtrans-122.8140.4174-169.70000110.2S346 F350 G351 G354S346-S348 PolarHBondContact O-N 3.36Å; S348-F350 PolarHBondContact O-N 3.29Å; S348-G351 PolarHBondContact O-N 3.32Å; S348-G354 VanDerWaalsContact CB-C 3.44Å; S348-G354 WeakPolarHBondContact OG-CA 3.31Å
349M57.9Low66.1Low178 Ų17868 Ų6888%0.87739%0.385SS*.THydrogen-bonded Turntrans-54.3-22.3175.3-77.6-167.9-171.400113.1
350F61.1Low68.4Low176 Ų17666.5 Ų66.577%0.77238%0.377SS*.THydrogen-bonded Turntrans-97.514.3178.9-69.8-78.7000114.1S348S348-F350 PolarHBondContact O-N 3.29Å
351G75.6Confident70.4Confident22 Ų2264.9 Ų64.923%0.22737%0.366CS..THydrogen-bonded Turntrans67.9-142.5-179.800000113.1S348 L353 G354 A355S348-G351 PolarHBondContact O-N 3.32Å; G351-L353 VanDerWaalsContact C-N 3.32Å; G351-L353 PolarHBondContact O-N 3.22Å; G351-G354 PolarHBondContact O-N 3.39Å; G351-G354 VanDerWaalsContact O-N 3.13Å; G351-A355 PolarHBondContact O-N 3.19Å; G351-A355 VanDerWaalsContact O-N 3.12Å
352S79.1Confident72.4Confident69 Ų6957.9 Ų57.948%0.48333%0.334SS..Hα-helixtrans-61.2-33.6-176.561.70000114.2A355 A356S352-A355 PolarHBondContact O-N 3.3Å; S352-A356 PolarHBondContact O-N 2.69Å
353L81.5Confident74.4Confident134 Ų13459.2 Ų59.270%0.70234%0.341SS*.Hα-helixtrans-65.9-41.2175.9-71.3176.9000111.5G351 A356 V357G351-L353 VanDerWaalsContact C-N 3.32Å; G351-L353 PolarHBondContact O-N 3.22Å; L353-A356 PolarHBondContact O-N 3.23Å; L353-V357 WeakPolarHBondContact O-CG2 3.33Å; L353-V357 PolarHBondContact O-N 3.4Å
354G82.3Confident76.4Confident7 Ų758.6 Ų58.67%0.07233%0.33CS..Hα-helixtrans-67.1-38.5177.200000112.5S348 G351 V357 Q358S348-G354 VanDerWaalsContact CB-C 3.44Å; S348-G354 WeakPolarHBondContact OG-CA 3.31Å; G351-G354 PolarHBondContact O-N 3.39Å; G351-G354 VanDerWaalsContact O-N 3.13Å; G354-V357 PolarHBondContact O-N 3.42Å; G354-Q358 WeakPolarHBondContact O-CG 3.45Å; G354-Q358 PolarHBondContact O-N 2.7Å
355A82.3Confident78.4Confident2 Ų251.1 Ų51.12%0.01729%0.293CS..Hα-helixtrans-63.6-40.2172.700000112.3I84 E88 G351 S352 V357 Q358 V359I84-A355 HydrophobicContact CG2-CB 3.82Å; E88-A355 HydrophobicContact CG-CB 3.42Å; E88-A355 VanDerWaalsContact CG-CB 3.42Å; G351-A355 PolarHBondContact O-N 3.19Å; G351-A355 VanDerWaalsContact O-N 3.12Å; S352-A355 PolarHBondContact O-N 3.3Å; A355-V357 VanDerWaalsContact C-N 3.35Å; A355-V357 PolarHBondContact O-N 2.98Å; A355-Q358 WeakPolarHBondContact O-CB 3.33Å; A355-Q358 PolarHBondContact O-N 2.79Å; A355-V359 WeakPolarHBondContact O-CG2 3.24Å; A355-V359 PolarHBondContact O-N 3.36Å
356A86.8Confident80.3Confident52 Ų5248.7 Ų48.743%0.4327%0.27SS..Hα-helixtrans-62.5-40.9173.900000112.1S352 L353 V359 L360S352-A356 PolarHBondContact O-N 2.69Å; L353-A356 PolarHBondContact O-N 3.23Å; A356-V359 PolarHBondContact O-N 2.82Å; A356-L360 WeakPolarHBondContact O-CB 3.22Å; A356-L360 PolarHBondContact O-N 3Å
357V87.5Confident82.2Confident53 Ų5350.2 Ų50.232%0.32128%0.277SS..Hα-helixtrans-64.2-41.4174.1172.30000111.4M318 L353 G354 A355 L360 L361M318-V357 HydrophobicContact CE-CG1 4.43Å; L353-V357 WeakPolarHBondContact O-CG2 3.33Å; L353-V357 PolarHBondContact O-N 3.4Å; G354-V357 PolarHBondContact O-N 3.42Å; A355-V357 VanDerWaalsContact C-N 3.35Å; A355-V357 PolarHBondContact O-N 2.98Å; V357-L360 PolarHBondContact O-N 3.03Å; V357-L361 HydrophobicContact CG1-CD1 3.89Å; V357-L361 HydrophobicContact CG1-CG 4.32Å; V357-L361 WeakPolarHBondContact O-CB 3.43Å; V357-L361 VanDerWaalsContact O-CG 3.3Å; V357-L361 WeakPolarHBondContact O-CG 3.27Å; V357-L361 PolarHBondContact O-N 3.42Å
358Q88.6Confident83.8Confident12 Ų1247.9 Ų47.96%0.05627%0.267CS..Hα-helixtrans-59.4-50.4175-75171.9-11.100111.3F347 G354 A355 L360 L361 I362 I417 T418F347-Q358 PolarHBondContact O-NE2 3.45Å; G354-Q358 WeakPolarHBondContact O-CG 3.45Å; G354-Q358 PolarHBondContact O-N 2.7Å; A355-Q358 WeakPolarHBondContact O-CB 3.33Å; A355-Q358 PolarHBondContact O-N 2.79Å; Q358-L360 VanDerWaalsContact C-N 3.29Å; Q358-L360 PolarHBondContact O-N 2.91Å; Q358-L361 WeakPolarHBondContact O-CB 3.49Å; Q358-L361 PolarHBondContact O-N 2.95Å; Q358-L361 VanDerWaalsContact O-N 3.12Å; Q358-I362 VanDerWaalsContact O-CD1 3.3Å; Q358-I362 WeakPolarHBondContact O-CD1 3.11Å; Q358-I362 VanDerWaalsContact O-CG1 3.28Å; Q358-I362 WeakPolarHBondContact O-CG1 3.46Å; Q358-I362 PolarHBondContact O-N 2.92Å; Q358-I417 PolarHBondContact NE2-O 3Å; Q358-T418 HydrophobicContact CB-CG2 4.44Å
359V90.1Very high85.5Confident14 Ų1447 Ų479%0.08526%0.261CS..Hα-helixtrans-57.2-44.8177.3170.50000111.1P81 I84 L85 A355 A356 L361 I362 L363P81-V359 HydrophobicContact CB-CG1 3.94Å; I84-V359 HydrophobicContact CB-CG2 3.89Å; I84-V359 HydrophobicContact CD1-CG2 4.28Å; I84-V359 HydrophobicContact CG2-CG2 3.79Å; L85-V359 HydrophobicContact CD1-CG1 4.47Å; L85-V359 HydrophobicContact CD2-CG2 4.33Å; L85-V359 HydrophobicContact CG-CG2 4.09Å; A355-V359 WeakPolarHBondContact O-CG2 3.24Å; A355-V359 PolarHBondContact O-N 3.36Å; A356-V359 PolarHBondContact O-N 2.82Å; V359-L361 PolarHBondContact O-N 3.48Å; V359-I362 PolarHBondContact O-N 2.94Å; V359-L363 HydrophobicContact CG1-CD1 4.23Å; V359-L363 WeakPolarHBondContact O-CG 3.45Å; V359-L363 PolarHBondContact O-N 2.65Å
360L91.8Very high87.2Confident90 Ų9040 Ų4047%0.47123%0.229SC..Hα-helixtrans-62.6-41.4177.3-175.263.3000111.8L311 A356 V357 Q358 Y364L311-L360 HydrophobicContact CD2-CD2 3.73Å; L311-L360 HydrophobicContact CD2-CG 3.83Å; A356-L360 WeakPolarHBondContact O-CB 3.22Å; A356-L360 PolarHBondContact O-N 3Å; V357-L360 PolarHBondContact O-N 3.03Å; Q358-L360 VanDerWaalsContact C-N 3.29Å; Q358-L360 PolarHBondContact O-N 2.91Å; L360-Y364 WeakPolarHBondContact O-CB 3.43Å; L360-Y364 PolarHBondContact O-N 2.89Å
361L91.3Very high88.7Confident0 Ų033.7 Ų33.70%020%0.204CC..Hα-helixtrans-65.4-41.5176.6-77.2169.5000112.4L311 M314 C315 M318 V357 Q358 V359 Y364 L365 I417L311-L361 HydrophobicContact CD2-CD2 4.08Å; L311-L361 WeakPolarHBondContact O-CD2 3Å; M314-L361 HydrophobicContact CB-CD2 4.47Å; C315-L361 HydrophobicContact CB-CD2 4.08Å; M318-L361 HydrophobicContact CE-CD1 3.82Å; M318-L361 HydrophobicContact SD-CD1 3.49Å; M318-L361 WeakPolarHBondContact SD-CD1 3.41Å; V357-L361 HydrophobicContact CG1-CD1 3.89Å; V357-L361 HydrophobicContact CG1-CG 4.32Å; V357-L361 WeakPolarHBondContact O-CB 3.43Å; V357-L361 VanDerWaalsContact O-CG 3.3Å; V357-L361 WeakPolarHBondContact O-CG 3.27Å; V357-L361 PolarHBondContact O-N 3.42Å; Q358-L361 WeakPolarHBondContact O-CB 3.49Å; Q358-L361 PolarHBondContact O-N 2.95Å; Q358-L361 VanDerWaalsContact O-N 3.12Å; V359-L361 PolarHBondContact O-N 3.48Å; L361-Y364 WeakPolarHBondContact O-CB 3.02Å; L361-Y364 PolarHBondContact O-N 3.42Å; L361-L365 WeakPolarHBondContact O-CB 3.46Å; L361-L365 VanDerWaalsContact O-CG 3.31Å; L361-L365 WeakPolarHBondContact O-CG 3.45Å; L361-L365 PolarHBondContact O-N 3.22Å; L361-I417 HydrophobicContact CB-CG2 4.37Å
362I91.6Very high89.5Confident2 Ų232.6 Ų32.61%0.0119%0.193CC..Hα-helixtrans-63.5-48.5178.2-68152.6000110.8L80 P81 I84 Q358 V359 Y364 L365 M366 L408 I417 T418L80-I362 HydrophobicContact CD2-CD1 3.17Å; L80-I362 HydrophobicContact CD2-CG1 4.11Å; L80-I362 HydrophobicContact CD2-CG2 4.34Å; P81-I362 HydrophobicContact CG-CG2 4.23Å; I84-I362 HydrophobicContact CD1-CD1 3.65Å; Q358-I362 VanDerWaalsContact O-CD1 3.3Å; Q358-I362 WeakPolarHBondContact O-CD1 3.11Å; Q358-I362 VanDerWaalsContact O-CG1 3.28Å; Q358-I362 WeakPolarHBondContact O-CG1 3.46Å; Q358-I362 PolarHBondContact O-N 2.92Å; V359-I362 PolarHBondContact O-N 2.94Å; I362-Y364 VanDerWaalsContact C-N 3.3Å; I362-Y364 PolarHBondContact O-N 3.23Å; I362-L365 PolarHBondContact O-N 2.73Å; I362-M366 PolarHBondContact O-N 3.4Å; I362-L408 HydrophobicContact CG2-CD2 3.9Å; I362-I417 HydrophobicContact CG1-CG2 4.37Å; I362-T418 HydrophobicContact CD1-CG2 3.61Å; I362-T418 HydrophobicContact CG1-CG2 4.39Å
363L92.3Very high90.1Very high63 Ų6329.6 Ų29.633%0.3317%0.171SC..Hα-helixtrans-62.3-41.3176.1-68.9176.8000110.9P81 V359 M366 V367P81-L363 HydrophobicContact CG-CD2 3.96Å; P81-L363 HydrophobicContact CG-CG 4.26Å; V359-L363 HydrophobicContact CG1-CD1 4.23Å; V359-L363 WeakPolarHBondContact O-CG 3.45Å; V359-L363 PolarHBondContact O-N 2.65Å; L363-M366 PolarHBondContact O-N 2.95Å; L363-V367 WeakPolarHBondContact O-CG2 3.34Å; L363-V367 PolarHBondContact O-N 2.92Å
364Y92.9Very high90.6Very high16 Ų1624.5 Ų24.56%0.06314%0.143CC..Hα-helixtrans-60.1-45.8176.3174.6-114.3000112.4L214 M217 L308 L311 T312 L360 L361 I362 V367 S368L214-Y364 HydrophobicContact CD2-CD1 4.45Å; L214-Y364 HydrophobicContact CD2-CE1 3.42Å; L214-Y364 VanDerWaalsContact CD2-CE1 3.42Å; L214-Y364 HydrophobicContact CD2-CE2 4.34Å; L214-Y364 WeakPolarHBondContact CD2-OH 3.39Å; M217-Y364 HydrophobicContact SD-CE2 4.19Å; L308-Y364 HydrophobicContact CD1-CE2 3.97Å; L308-Y364 HydrophobicContact CG-CE2 4.14Å; L311-Y364 HydrophobicContact CB-CD1 3.87Å; L311-Y364 HydrophobicContact CB-CD2 4.47Å; L311-Y364 HydrophobicContact CB-CE1 3.85Å; L311-Y364 HydrophobicContact CB-CE2 4.48Å; L311-Y364 HydrophobicContact CB-CG 4.17Å; L311-Y364 HydrophobicContact CD1-CD2 3.87Å; L311-Y364 HydrophobicContact CD1-CE2 4.33Å; L311-Y364 HydrophobicContact CD1-CG 3.95Å; T312-Y364 HydrophobicContact CG2-CE1 4.05Å; T312-Y364 WeakPolarHBondContact CG2-OH 3.43Å; L360-Y364 WeakPolarHBondContact O-CB 3.43Å; L360-Y364 PolarHBondContact O-N 2.89Å; L361-Y364 WeakPolarHBondContact O-CB 3.02Å; L361-Y364 PolarHBondContact O-N 3.42Å; I362-Y364 VanDerWaalsContact C-N 3.3Å; I362-Y364 PolarHBondContact O-N 3.23Å; Y364-V367 PolarHBondContact O-N 3.25Å; Y364-S368 VanDerWaalsContact O-CB 3.29Å; Y364-S368 WeakPolarHBondContact O-CB 3.47Å; Y364-S368 PolarHBondContact O-N 3.08Å; Y364-S368 PolarHBondContact O-OG 2.9Å
365L92.3Very high90.8Very high3 Ų326.1 Ų26.12%0.01615%0.153CC..Hα-helixtrans-66.4-37.2177.9-74.6173.9000112.4L361 I362 S368 S369 F411 I417 F445L361-L365 WeakPolarHBondContact O-CB 3.46Å; L361-L365 VanDerWaalsContact O-CG 3.31Å; L361-L365 WeakPolarHBondContact O-CG 3.45Å; L361-L365 PolarHBondContact O-N 3.22Å; I362-L365 PolarHBondContact O-N 2.73Å; L365-S368 PolarHBondContact O-N 2.95Å; L365-S369 WeakPolarHBondContact O-CB 3.34Å; L365-S369 PolarHBondContact O-N 3.18Å; L365-S369 PolarHBondContact O-OG 3.3Å; L365-F411 HydrophobicContact CB-CE1 4.27Å; L365-F411 HydrophobicContact CD1-CE1 4.09Å; L365-I417 HydrophobicContact CD1-CD1 3.16Å; L365-F445 HydrophobicContact CD2-CZ 4.17Å
366M93.1Very high91Very high16 Ų1626.7 Ų26.78%0.07916%0.157CC..Hα-helixtrans-64.5-46.8174.1-177.262.9-172.700111.7V77 I362 L363 S368 S369 V370 L404 L408V77-M366 HydrophobicContact CG1-CB 4.38Å; V77-M366 HydrophobicContact CG1-CG 3.75Å; V77-M366 HydrophobicContact CG2-CE 3.46Å; V77-M366 VanDerWaalsContact CG2-CE 3.46Å; V77-M366 HydrophobicContact CG2-CG 4.1Å; V77-M366 HydrophobicContact CG2-SD 3.97Å; I362-M366 PolarHBondContact O-N 3.4Å; L363-M366 PolarHBondContact O-N 2.95Å; M366-S368 VanDerWaalsContact C-N 3.28Å; M366-S368 PolarHBondContact O-N 3.06Å; M366-S369 PolarHBondContact O-N 3.35Å; M366-S369 PolarHBondContact O-OG 2.86Å; M366-V370 HydrophobicContact CE-CG2 3.69Å; M366-V370 VanDerWaalsContact O-CG2 3.26Å; M366-V370 WeakPolarHBondContact O-CG2 3.31Å; M366-V370 PolarHBondContact O-N 3.34Å; M366-V370 HydrophobicContact SD-CG2 4.39Å; M366-L404 HydrophobicContact CE-CD2 3.93Å; M366-L404 HydrophobicContact CE-CG 4.23Å; M366-L404 HydrophobicContact SD-CD2 4.34Å; M366-L404 HydrophobicContact SD-CG 4.38Å; M366-L408 HydrophobicContact CB-CD1 3.85Å; M366-L408 HydrophobicContact CG-CD1 4.36Å; M366-L408 HydrophobicContact SD-CD1 3.83Å
367V92.7Very high90.8Very high77 Ų7730 Ų3047%0.46717%0.174SC..Hα-helixtrans-64.5-40.4178179.20000110.1M217 L363 Y364 V370 V371M217-V367 HydrophobicContact CE-CB 4.22Å; M217-V367 HydrophobicContact CE-CG1 3.45Å; M217-V367 VanDerWaalsContact CE-CG1 3.45Å; L363-V367 WeakPolarHBondContact O-CG2 3.34Å; L363-V367 PolarHBondContact O-N 2.92Å; Y364-V367 PolarHBondContact O-N 3.25Å; V367-V370 PolarHBondContact O-N 2.98Å; V367-V371 HydrophobicContact CG1-CG2 4.33Å; V367-V371 WeakPolarHBondContact O-CB 3.44Å; V367-V371 VanDerWaalsContact O-CG2 3.24Å; V367-V371 WeakPolarHBondContact O-CG2 3.4Å; V367-V371 PolarHBondContact O-N 3.25Å
368S92.2Very high90.5Very high0 Ų034.4 Ų34.40%020%0.195CC..Hα-helixtrans-61.8-44.9176.4-57.50000111.6G213 L214 M217 Y364 L365 M366 V370 V371 G372G213-S368 VanDerWaalsContact CA-O 3.3Å; G213-S368 WeakPolarHBondContact CA-O 2.98Å; L214-S368 WeakPolarHBondContact CD2-OG 3.45Å; M217-S368 PolarHBondContact SD-OG 3.18Å; Y364-S368 VanDerWaalsContact O-CB 3.29Å; Y364-S368 WeakPolarHBondContact O-CB 3.47Å; Y364-S368 PolarHBondContact O-N 3.08Å; Y364-S368 PolarHBondContact O-OG 2.9Å; L365-S368 PolarHBondContact O-N 2.95Å; M366-S368 VanDerWaalsContact C-N 3.28Å; M366-S368 PolarHBondContact O-N 3.06Å; S368-V370 PolarHBondContact O-N 3.36Å; S368-V371 PolarHBondContact O-N 3.26Å; S368-G372 PolarHBondContact O-N 3.4Å
369S93.4Very high90.3Very high0 Ų036.6 Ų36.60%021%0.205CC..Hα-helixtrans-63.9-42.1178.566.80000112.2L206 L365 M366 G372 F373L206-S369 VanDerWaalsContact CD2-CB 3.46Å; L365-S369 WeakPolarHBondContact O-CB 3.34Å; L365-S369 PolarHBondContact O-N 3.18Å; L365-S369 PolarHBondContact O-OG 3.3Å; M366-S369 PolarHBondContact O-N 3.35Å; M366-S369 PolarHBondContact O-OG 2.86Å; S369-G372 PolarHBondContact O-N 2.9Å; S369-F373 WeakPolarHBondContact O-CB 3.45Å; S369-F373 PolarHBondContact O-N 3.48Å
370V93.2Very high90Very high33 Ų3339.4 Ų39.420%0.222%0.224CC..Hα-helixtrans-62.6-47.4175.9173.70000111M366 V367 S368 G372 F373 Y374 L401 L404M366-V370 HydrophobicContact CE-CG2 3.69Å; M366-V370 VanDerWaalsContact O-CG2 3.26Å; M366-V370 WeakPolarHBondContact O-CG2 3.31Å; M366-V370 PolarHBondContact O-N 3.34Å; M366-V370 HydrophobicContact SD-CG2 4.39Å; V367-V370 PolarHBondContact O-N 2.98Å; S368-V370 PolarHBondContact O-N 3.36Å; V370-G372 VanDerWaalsContact C-N 3.27Å; V370-G372 PolarHBondContact O-N 3.06Å; V370-F373 PolarHBondContact O-N 3.15Å; V370-Y374 HydrophobicContact CG1-CD2 3.74Å; V370-Y374 HydrophobicContact CG1-CE2 3.63Å; V370-Y374 VanDerWaalsContact O-CD2 3.23Å; V370-Y374 WeakPolarHBondContact O-CD2 3.46Å; V370-Y374 PolarHBondContact O-N 3.06Å; V370-Y374 VanDerWaalsContact O-N 3.11Å; V370-L401 HydrophobicContact CG1-CD2 4.33Å; V370-L401 HydrophobicContact CG2-CD2 4.1Å; V370-L404 HydrophobicContact CB-CD2 4.38Å; V370-L404 HydrophobicContact CG2-CD2 3.51Å
371V92.3Very high89.6Confident42 Ų4238 Ų3826%0.25523%0.232SC..Hα-helixtrans-61-39.7176.7170.40000110.9R216 M217 V367 S368 S375R216-V371 HydrophobicContact CB-CG1 4.14Å; M217-V371 HydrophobicContact CG-CB 4.34Å; M217-V371 HydrophobicContact CG-CG1 4.04Å; M217-V371 HydrophobicContact CG-CG2 4.39Å; V367-V371 HydrophobicContact CG1-CG2 4.33Å; V367-V371 WeakPolarHBondContact O-CB 3.44Å; V367-V371 VanDerWaalsContact O-CG2 3.24Å; V367-V371 WeakPolarHBondContact O-CG2 3.4Å; V367-V371 PolarHBondContact O-N 3.25Å; S368-V371 PolarHBondContact O-N 3.26Å; V371-S375 WeakPolarHBondContact O-CB 3.33Å; V371-S375 PolarHBondContact O-N 3.22Å; V371-S375 PolarHBondContact O-OG 3.15Å
372G91.7Very high89.3Confident0 Ų039.9 Ų39.90%024%0.241CC..Hα-helixtrans-66.2-43.3176.500000113.2C209 G213 S368 S369 V370 S375 S376C209-G372 WeakPolarHBondContact O-CA 3.14Å; G213-G372 VanDerWaalsContact CA-CA 3.48Å; S368-G372 PolarHBondContact O-N 3.4Å; S369-G372 PolarHBondContact O-N 2.9Å; V370-G372 VanDerWaalsContact C-N 3.27Å; V370-G372 PolarHBondContact O-N 3.06Å; G372-S375 PolarHBondContact O-N 3.37Å; G372-S376 PolarHBondContact O-N 2.83Å
373F92.5Very high89.1Confident6 Ų643.9 Ų43.93%0.02626%0.262CS..Hα-helixtrans-57.3-55.7177.2178.4-102.7000110.8L205 S369 V370 S375 S376 F379 L382L205-F373 HydrophobicContact CD1-CD2 4.22Å; L205-F373 HydrophobicContact CD1-CE2 4.02Å; L205-F373 HydrophobicContact CD2-CD2 3.86Å; L205-F373 HydrophobicContact CD2-CE2 4.38Å; L205-F373 HydrophobicContact CG-CD2 4.43Å; S369-F373 WeakPolarHBondContact O-CB 3.45Å; S369-F373 PolarHBondContact O-N 3.48Å; V370-F373 PolarHBondContact O-N 3.15Å; F373-S375 VanDerWaalsContact C-N 3.29Å; F373-S375 PolarHBondContact O-N 2.86Å; F373-S376 WeakPolarHBondContact O-CB 3.24Å; F373-S376 PolarHBondContact O-N 3.34Å; F373-S376 VanDerWaalsContact O-N 3.16Å; F373-S376 PolarHBondContact O-OG 3.33Å; F373-F379 HydrophobicContact CD1-CB 4.36Å; F373-F379 HydrophobicContact CD2-CB 4.29Å; F373-F379 AromaticContact CD2-CD2 3.55Å; F373-F379 HydrophobicContact CD2-CD2 3.55Å; F373-F379 HydrophobicContact CD2-CE2 4.03Å; F373-F379 AromaticContact CD2-CG 3.96Å; F373-F379 HydrophobicContact CD2-CG 3.96Å; F373-F379 HydrophobicContact CE1-CB 3.97Å; F373-F379 HydrophobicContact CE1-CG 4.21Å; F373-F379 HydrophobicContact CE2-CB 3.91Å; F373-F379 AromaticContact CE2-CD1 3.72Å; F373-F379 HydrophobicContact CE2-CD1 3.72Å; F373-F379 AromaticContact CE2-CD2 3.21Å; F373-F379 HydrophobicContact CE2-CD2 3.21Å; F373-F379 AromaticContact CE2-CE1 3.98Å; F373-F379 HydrophobicContact CE2-CE1 3.98Å; F373-F379 AromaticContact CE2-CE2 3.53Å; F373-F379 HydrophobicContact CE2-CE2 3.53Å; F373-F379 AromaticContact CE2-CG 3.32Å; F373-F379 HydrophobicContact CE2-CG 3.32Å; F373-F379 AromaticContact CE2-CZ 3.9Å; F373-F379 HydrophobicContact CE2-CZ 3.9Å; F373-F379 HydrophobicContact CG-CD2 4.47Å; F373-F379 HydrophobicContact CZ-CB 3.73Å; F373-F379 AromaticContact CZ-CD1 3.62Å; F373-F379 HydrophobicContact CZ-CD1 3.62Å; F373-F379 AromaticContact CZ-CD2 3.89Å; F373-F379 HydrophobicContact CZ-CD2 3.89Å; F373-F379 HydrophobicContact CZ-CE1 4.16Å; F373-F379 HydrophobicContact CZ-CE2 4.41Å; F373-F379 AromaticContact CZ-CG 3.46Å; F373-F379 HydrophobicContact CZ-CG 3.46Å; F373-F379 VanDerWaalsContact CZ-CG 3.46Å; F373-L382 HydrophobicContact CE1-CD1 4.45Å; F373-L382 HydrophobicContact CZ-CD1 4.27Å
374Y91Very high88.8Confident26 Ų2642.7 Ų42.710%0.10226%0.259CS..Hα-helixtrans-70-22.1-179.7-71-63.7000114.5V370 L382 L383 N397 L401V370-Y374 HydrophobicContact CG1-CD2 3.74Å; V370-Y374 HydrophobicContact CG1-CE2 3.63Å; V370-Y374 VanDerWaalsContact O-CD2 3.23Å; V370-Y374 WeakPolarHBondContact O-CD2 3.46Å; V370-Y374 PolarHBondContact O-N 3.06Å; V370-Y374 VanDerWaalsContact O-N 3.11Å; Y374-L382 HydrophobicContact CE1-CB 4.4Å; Y374-L383 HydrophobicContact CD1-CB 4.41Å; Y374-L383 HydrophobicContact CD1-CD1 4.26Å; Y374-L383 HydrophobicContact CG-CD1 4.1Å; Y374-N397 WeakPolarHBondContact CE1-OD1 3.25Å; Y374-N397 PolarHBondContact OH-OD1 3.1Å; Y374-L401 HydrophobicContact CE2-CD2 4.44Å
375S87.5Confident88.5Confident41 Ų4149.9 Ų49.929%0.28729%0.286SS..Hα-helixtrans-83.3-15.4175.5-62.20000112.9F212 V371 G372 F373F212-S375 VanDerWaalsContact CE1-CB 3.49Å; F212-S375 WeakPolarHBondContact CE1-O 3.49Å; V371-S375 WeakPolarHBondContact O-CB 3.33Å; V371-S375 PolarHBondContact O-N 3.22Å; V371-S375 PolarHBondContact O-OG 3.15Å; G372-S375 PolarHBondContact O-N 3.37Å; F373-S375 VanDerWaalsContact C-N 3.29Å; F373-S375 PolarHBondContact O-N 2.86Å
376S86.9Confident88.1Confident15 Ų1553.6 Ų53.611%0.10531%0.309CS..SBendtrans-69146.9-176.974.70000111.1G372 F373 L378 F379 C380G372-S376 PolarHBondContact O-N 2.83Å; F373-S376 WeakPolarHBondContact O-CB 3.24Å; F373-S376 PolarHBondContact O-N 3.34Å; F373-S376 VanDerWaalsContact O-N 3.16Å; F373-S376 PolarHBondContact O-OG 3.33Å; S376-L378 PolarHBondContact O-N 3.5Å; S376-F379 PolarHBondContact O-N 3.09Å; S376-F379 WeakPolarHBondContact OG-CD2 3.15Å; S376-F379 PolarHBondContact OG-N 2.89Å; S376-C380 WeakPolarHBondContact O-CB 3.3Å; S376-C380 PolarHBondContact O-N 3.43Å
377P82.1Confident87.6Confident122 Ų12259.3 Ų59.379%0.79233%0.333SS*.THydrogen-bonded Turntrans-63.3-25.5-179.325.8-34.2000112.9
378L81.1Confident87.2Confident145 Ų14559.1 Ų59.176%0.75933%0.329SS*.THydrogen-bonded Turntrans-73.6-37.7-179.8-61.4175.2000112.4S376S376-L378 PolarHBondContact O-N 3.5Å
379F84.4Confident86.9Confident57 Ų5759.2 Ų59.225%0.2533%0.33CS..THydrogen-bonded Turntrans-115.76.9-171.9-55-69000113.9L205 F373 S376 G381 L382L205-F379 HydrophobicContact CD1-CE2 4.21Å; L205-F379 HydrophobicContact CD1-CZ 4.38Å; F373-F379 HydrophobicContact CD1-CB 4.36Å; F373-F379 HydrophobicContact CD2-CB 4.29Å; F373-F379 AromaticContact CD2-CD2 3.55Å; F373-F379 HydrophobicContact CD2-CD2 3.55Å; F373-F379 HydrophobicContact CD2-CE2 4.03Å; F373-F379 AromaticContact CD2-CG 3.96Å; F373-F379 HydrophobicContact CD2-CG 3.96Å; F373-F379 HydrophobicContact CE1-CB 3.97Å; F373-F379 HydrophobicContact CE1-CG 4.21Å; F373-F379 HydrophobicContact CE2-CB 3.91Å; F373-F379 AromaticContact CE2-CD1 3.72Å; F373-F379 HydrophobicContact CE2-CD1 3.72Å; F373-F379 AromaticContact CE2-CD2 3.21Å; F373-F379 HydrophobicContact CE2-CD2 3.21Å; F373-F379 AromaticContact CE2-CE1 3.98Å; F373-F379 HydrophobicContact CE2-CE1 3.98Å; F373-F379 AromaticContact CE2-CE2 3.53Å; F373-F379 HydrophobicContact CE2-CE2 3.53Å; F373-F379 AromaticContact CE2-CG 3.32Å; F373-F379 HydrophobicContact CE2-CG 3.32Å; F373-F379 AromaticContact CE2-CZ 3.9Å; F373-F379 HydrophobicContact CE2-CZ 3.9Å; F373-F379 HydrophobicContact CG-CD2 4.47Å; F373-F379 HydrophobicContact CZ-CB 3.73Å; F373-F379 AromaticContact CZ-CD1 3.62Å; F373-F379 HydrophobicContact CZ-CD1 3.62Å; F373-F379 AromaticContact CZ-CD2 3.89Å; F373-F379 HydrophobicContact CZ-CD2 3.89Å; F373-F379 HydrophobicContact CZ-CE1 4.16Å; F373-F379 HydrophobicContact CZ-CE2 4.41Å; F373-F379 AromaticContact CZ-CG 3.46Å; F373-F379 HydrophobicContact CZ-CG 3.46Å; F373-F379 VanDerWaalsContact CZ-CG 3.46Å; S376-F379 PolarHBondContact O-N 3.09Å; S376-F379 WeakPolarHBondContact OG-CD2 3.15Å; S376-F379 PolarHBondContact OG-N 2.89Å; F379-G381 PolarHBondContact O-N 3.37Å; F379-G381 VanDerWaalsContact O-N 3.14Å; F379-L382 HydrophobicContact CB-CD1 4.35Å; F379-L382 HydrophobicContact CD1-CD1 3.88Å; F379-L382 WeakPolarHBondContact O-CB 3.28Å; F379-L382 PolarHBondContact O-N 3.32Å
380C83.3Confident86.7Confident73 Ų7361.8 Ų61.849%0.49334%0.343SS..G310 helixtrans-58.6-27.6177.1-173.20000113.1S376 L382 L383S376-C380 WeakPolarHBondContact O-CB 3.3Å; S376-C380 PolarHBondContact O-N 3.43Å; C380-L382 PolarHBondContact O-N 2.86Å; C380-L383 WeakPolarHBondContact O-CB 3.41Å; C380-L383 PolarHBondContact O-N 3.12Å
381G83.4Confident86.4Confident62 Ų6260.8 Ų60.864%0.63934%0.337SS*.G310 helixtrans-70.5-17.3176.300000114.4F379F379-G381 PolarHBondContact O-N 3.37Å; F379-G381 VanDerWaalsContact O-N 3.14Å
382L86.3Confident86.3Confident38 Ų3862 Ų6220%0.19935%0.345CS..G310 helixtrans-88.4-7178.9-65.7175.8000113F373 Y374 F379 C380 P384 A396 N397F373-L382 HydrophobicContact CE1-CD1 4.45Å; F373-L382 HydrophobicContact CZ-CD1 4.27Å; Y374-L382 HydrophobicContact CE1-CB 4.4Å; F379-L382 HydrophobicContact CB-CD1 4.35Å; F379-L382 HydrophobicContact CD1-CD1 3.88Å; F379-L382 WeakPolarHBondContact O-CB 3.28Å; F379-L382 PolarHBondContact O-N 3.32Å; C380-L382 PolarHBondContact O-N 2.86Å; L382-P384 WeakPolarHBondContact O-CD 3.37Å; L382-P384 VanDerWaalsContact O-N 3.11Å; L382-A396 HydrophobicContact CD2-CB 3.55Å; L382-N397 WeakPolarHBondContact CB-OD1 3.35Å; L382-N397 PolarHBondContact O-ND2 3.33Å; L382-N397 PolarHBondContact O-OD1 2.95Å
383L87.6Confident86.2Confident86 Ų8664.7 Ų64.745%0.4536%0.357SS..  trans-56117.1-177.4-179.173000111.2Y374 C380 R385Y374-L383 HydrophobicContact CD1-CB 4.41Å; Y374-L383 HydrophobicContact CD1-CD1 4.26Å; Y374-L383 HydrophobicContact CG-CD1 4.1Å; C380-L383 WeakPolarHBondContact O-CB 3.41Å; C380-L383 PolarHBondContact O-N 3.12Å; L383-R385 PolarHBondContact O-N 3.48Å
384P85.9Confident86.2Confident39 Ų3964.7 Ų64.725%0.25336%0.358SS..  trans-66.7130.2-17825.5-33.7000111.2F41 L382 T389F41-P384 HydrophobicContact CD1-CB 3.97Å; F41-P384 HydrophobicContact CE1-CB 4.41Å; F41-P384 HydrophobicContact CG-CB 4.29Å; L382-P384 WeakPolarHBondContact O-CD 3.37Å; L382-P384 VanDerWaalsContact O-N 3.11Å; P384-T389 VanDerWaalsContact CA-CG2 3.49Å; P384-T389 HydrophobicContact CB-CG2 3.81Å
385R86.3Confident86.3Confident166 Ų16663.9 Ų63.963%0.62636%0.355SS*.  trans-108134.8174.7-67.4-174.7-179.2-177.51.7110.2L383 K387 D388 T389L383-R385 PolarHBondContact O-N 3.48Å; R385-K387 PolarHBondContact O-N 3.36Å; R385-K387 VanDerWaalsContact O-N 3.14Å; R385-D388 HydrophobicContact CB-CB 4.2Å; R385-D388 PolarHBondContact O-N 3.45Å; R385-D388 VanDerWaalsContact O-N 3.11Å; R385-T389 VanDerWaalsContact N-CG2 3.29Å; R385-T389 WeakPolarHBondContact O-CG2 3.45Å
386V84.2Confident86.6Confident82 Ų8263.6 Ų63.650%0.49736%0.355SS..THydrogen-bonded Turntrans-57.5121.4-178.31800000109.8F41 D388F41-V386 HydrophobicContact CD1-CG2 4.13Å; F41-V386 HydrophobicContact CE1-CG2 3.79Å; V386-D388 PolarHBondContact O-N 3.06Å
387K82.6Confident86.9Confident135 Ų13563.5 Ų63.559%0.58735%0.353SS*.THydrogen-bonded Turntrans61.318.2180-59.4177.4179.1-1770116F41 K43 R385F41-K387 WeakPolarHBondContact O-CA 3.31Å; F41-K387 PolarHBondContact O-N 2.95Å; K43-K387 WeakPolarHBondContact CA-O 3.49Å; R385-K387 PolarHBondContact O-N 3.36Å; R385-K387 VanDerWaalsContact O-N 3.14Å
388D83.6Confident87.5Confident73 Ų7357.8 Ų57.839%0.3932%0.316SS..  trans-141.129.2-179.7-164.734.7000112.4F41 K43 R385 V386F41-D388 PolarHBondContact O-N 2.89Å; K43-D388 WeakPolarHBondContact CE-OD1 3.43Å; K43-D388 IonicContact NZ-OD1 3.4Å; K43-D388 PolarHBondContact NZ-OD1 2.9Å; R385-D388 HydrophobicContact CB-CB 4.2Å; R385-D388 PolarHBondContact O-N 3.45Å; R385-D388 VanDerWaalsContact O-N 3.11Å; V386-D388 PolarHBondContact O-N 3.06Å
389T85.1Confident88.1Confident2 Ų252.9 Ų52.91%0.01229%0.292CS..BIsolated β-bridgetrans-97.7124.3169.358.90000111.3F41 K43 P384 R385F41-T389 VanDerWaalsContact C-OG1 3.3Å; F41-T389 PolarHBondContact O-OG1 3.49Å; K43-T389 WeakPolarHBondContact CB-O 3.3Å; K43-T389 PolarHBondContact N-O 3.17Å; P384-T389 VanDerWaalsContact CA-CG2 3.49Å; P384-T389 HydrophobicContact CB-CG2 3.81Å; R385-T389 VanDerWaalsContact N-CG2 3.29Å; R385-T389 WeakPolarHBondContact O-CG2 3.45Å
390N89.1Confident88.5Confident54 Ų5451 Ų5129%0.28929%0.286SS..  trans-71.5156.9172.3-61.8-4000110.4T392 Q393 I394N390-T392 VanDerWaalsContact C-N 3.33Å; N390-T392 PolarHBondContact O-N 3.2Å; N390-Q393 HydrophobicContact CB-CG 4.46Å; N390-Q393 WeakPolarHBondContact O-CB 3.42Å; N390-Q393 PolarHBondContact O-N 3.22Å; N390-Q393 VanDerWaalsContact O-N 3.13Å; N390-I394 PolarHBondContact O-N 2.77Å; N390-I394 VanDerWaalsContact O-N 3.08Å
391L87.6Confident89Confident13 Ų1349.2 Ų49.27%0.06827%0.271CS..Hα-helixtrans-59.7-39.1-178.6-172.162.7000113.5N59 A62 T133 Q393 I394 I395N59-L391 HydrophobicContact CB-CD2 4.36Å; N59-L391 WeakPolarHBondContact OD1-CD2 3.41Å; A62-L391 HydrophobicContact CB-CD1 4.44Å; A62-L391 HydrophobicContact CB-CD2 3.94Å; T133-L391 HydrophobicContact CG2-CD2 3.43Å; T133-L391 VanDerWaalsContact CG2-CD2 3.43Å; T133-L391 HydrophobicContact CG2-CG 4.33Å; L391-Q393 VanDerWaalsContact C-N 3.31Å; L391-Q393 PolarHBondContact O-N 3.34Å; L391-I394 WeakPolarHBondContact O-CB 3.48Å; L391-I394 PolarHBondContact O-N 3.36Å; L391-I394 VanDerWaalsContact O-N 3.1Å; L391-I395 HydrophobicContact CG-CD1 4.39Å; L391-I395 WeakPolarHBondContact O-CG1 3.13Å; L391-I395 PolarHBondContact O-N 3.22Å
392T89.4Confident89.4Confident68 Ų6846.3 Ų46.342%0.41724%0.241SC..Hα-helixtrans-63-36.1176.553.40000112.8N390 I395 A396N390-T392 VanDerWaalsContact C-N 3.33Å; N390-T392 PolarHBondContact O-N 3.2Å; T392-I395 PolarHBondContact O-N 3.43Å; T392-A396 WeakPolarHBondContact O-CB 3.3Å; T392-A396 PolarHBondContact O-N 3.45Å
393Q91.3Very high89.7Confident56 Ų5645.7 Ų45.726%0.26224%0.238SC..Hα-helixtrans-68.8-35.9173.4-67176.6-22.100111.6N390 L391 A396 N397N390-Q393 HydrophobicContact CB-CG 4.46Å; N390-Q393 WeakPolarHBondContact O-CB 3.42Å; N390-Q393 PolarHBondContact O-N 3.22Å; N390-Q393 VanDerWaalsContact O-N 3.13Å; L391-Q393 VanDerWaalsContact C-N 3.31Å; L391-Q393 PolarHBondContact O-N 3.34Å; Q393-A396 PolarHBondContact O-N 2.95Å; Q393-N397 VanDerWaalsContact O-CB 3.31Å; Q393-N397 WeakPolarHBondContact O-CB 3.48Å; Q393-N397 VanDerWaalsContact O-CG 3.25Å; Q393-N397 PolarHBondContact O-N 3.15Å; Q393-N397 PolarHBondContact O-ND2 3.27Å; Q393-N397 VanDerWaalsContact O-ND2 3.11Å
394I92.3Very high89.9Confident6 Ų641.7 Ų41.73%0.03122%0.217CC..Hα-helixtrans-61.7-48.7173.8-68.7172.4000110.1L38 K42 C66 N390 L391 A396 N397 C398L38-I394 HydrophobicContact CD2-CG1 4.45Å; L38-I394 HydrophobicContact CD2-CG2 3.41Å; L38-I394 VanDerWaalsContact CD2-CG2 3.41Å; K42-I394 HydrophobicContact CB-CD1 4.21Å; K42-I394 HydrophobicContact CG-CD1 4.4Å; C66-I394 HydrophobicContact CB-CG2 3.99Å; N390-I394 PolarHBondContact O-N 2.77Å; N390-I394 VanDerWaalsContact O-N 3.08Å; L391-I394 WeakPolarHBondContact O-CB 3.48Å; L391-I394 PolarHBondContact O-N 3.36Å; L391-I394 VanDerWaalsContact O-N 3.1Å; I394-A396 PolarHBondContact O-N 3.39Å; I394-N397 PolarHBondContact O-N 3.29Å; I394-C398 PolarHBondContact O-N 2.92Å; I394-C398 PolarHBondContact O-SG 2.7Å
395I92.8Very high90.1Very high9 Ų939.8 Ų39.85%0.04621%0.205CC..Hα-helixtrans-57.5-49.9177.9-62.9161.6000110.2M126 V129 T133 L391 T392 N397 C398 V399M126-I395 HydrophobicContact SD-CG2 4.46Å; V129-I395 HydrophobicContact CG1-CD1 3.61Å; V129-I395 HydrophobicContact CG1-CG1 3.75Å; T133-I395 HydrophobicContact CG2-CD1 4.47Å; L391-I395 HydrophobicContact CG-CD1 4.39Å; L391-I395 WeakPolarHBondContact O-CG1 3.13Å; L391-I395 PolarHBondContact O-N 3.22Å; T392-I395 PolarHBondContact O-N 3.43Å; I395-N397 VanDerWaalsContact C-N 3.32Å; I395-N397 PolarHBondContact O-N 3.1Å; I395-C398 PolarHBondContact O-N 3Å; I395-V399 HydrophobicContact CG2-CG2 4.48Å; I395-V399 WeakPolarHBondContact O-CG2 3.45Å; I395-V399 PolarHBondContact O-N 3.41Å
396A92.6Very high90.2Very high35 Ų3532.4 Ų32.429%0.28918%0.179SC..Hα-helixtrans-61.7-37.5179.100000113.1L382 T392 Q393 I394 S400L382-A396 HydrophobicContact CD2-CB 3.55Å; T392-A396 WeakPolarHBondContact O-CB 3.3Å; T392-A396 PolarHBondContact O-N 3.45Å; Q393-A396 PolarHBondContact O-N 2.95Å; I394-A396 PolarHBondContact O-N 3.39Å; A396-S400 WeakPolarHBondContact O-CB 3.49Å; A396-S400 PolarHBondContact O-N 3.35Å; A396-S400 PolarHBondContact O-OG 2.92Å
397N94Very high90.3Very high12 Ų1228.5 Ų28.56%0.06416%0.155CC..Hα-helixtrans-66.9-42.3174.4-79.3-31.3000112.4Y374 L382 Q393 I394 I395 S400 L401Y374-N397 WeakPolarHBondContact CE1-OD1 3.25Å; Y374-N397 PolarHBondContact OH-OD1 3.1Å; L382-N397 WeakPolarHBondContact CB-OD1 3.35Å; L382-N397 PolarHBondContact O-ND2 3.33Å; L382-N397 PolarHBondContact O-OD1 2.95Å; Q393-N397 VanDerWaalsContact O-CB 3.31Å; Q393-N397 WeakPolarHBondContact O-CB 3.48Å; Q393-N397 VanDerWaalsContact O-CG 3.25Å; Q393-N397 PolarHBondContact O-N 3.15Å; Q393-N397 PolarHBondContact O-ND2 3.27Å; Q393-N397 VanDerWaalsContact O-ND2 3.11Å; I394-N397 PolarHBondContact O-N 3.29Å; I395-N397 VanDerWaalsContact C-N 3.32Å; I395-N397 PolarHBondContact O-N 3.1Å; N397-S400 WeakPolarHBondContact CA-OG 3.39Å; N397-S400 PolarHBondContact O-N 2.65Å; N397-S400 PolarHBondContact O-OG 3.4Å; N397-L401 WeakPolarHBondContact O-CB 3.08Å; N397-L401 VanDerWaalsContact O-CG 3.25Å; N397-L401 WeakPolarHBondContact O-CG 3.38Å; N397-L401 PolarHBondContact O-N 3.02Å
398C94.1Very high90.5Very high3 Ų322.2 Ų22.22%0.0213%0.128CC..Hα-helixtrans-66.5-39.8177.3-63.70000111.3M126 I394 I395 L402M126-C398 HydrophobicContact CE-CB 3.28Å; I394-C398 PolarHBondContact O-N 2.92Å; I394-C398 PolarHBondContact O-SG 2.7Å; I395-C398 PolarHBondContact O-N 3Å; C398-L402 VanDerWaalsContact O-CB 3.25Å; C398-L402 WeakPolarHBondContact O-CB 3.29Å; C398-L402 PolarHBondContact O-N 3.3Å
399V93.6Very high90.5Very high41 Ų4119 Ų1925%0.24811%0.111CC..Hα-helixtrans-62.6-49.8175.5171.30000110.9M126 I395 L402 I403M126-V399 HydrophobicContact CB-CG2 3.58Å; M126-V399 HydrophobicContact CE-CG2 3.98Å; M126-V399 HydrophobicContact CG-CG2 3.56Å; M126-V399 HydrophobicContact SD-CG2 3.97Å; I395-V399 HydrophobicContact CG2-CG2 4.48Å; I395-V399 WeakPolarHBondContact O-CG2 3.45Å; I395-V399 PolarHBondContact O-N 3.41Å; V399-L402 PolarHBondContact O-N 2.83Å; V399-I403 HydrophobicContact CG1-CD1 3.82Å; V399-I403 WeakPolarHBondContact O-CG1 3.45Å; V399-I403 PolarHBondContact O-N 3.43Å
400S92.8Very high90.3Very high18 Ų1819 Ų1913%0.12611%0.111CC..Hα-helixtrans-63.9-43-178.651.10000112.8A396 N397 L402 I403 L404A396-S400 WeakPolarHBondContact O-CB 3.49Å; A396-S400 PolarHBondContact O-N 3.35Å; A396-S400 PolarHBondContact O-OG 2.92Å; N397-S400 WeakPolarHBondContact CA-OG 3.39Å; N397-S400 PolarHBondContact O-N 2.65Å; N397-S400 PolarHBondContact O-OG 3.4Å; S400-L402 VanDerWaalsContact C-N 3.32Å; S400-L402 PolarHBondContact O-N 3.4Å; S400-I403 PolarHBondContact O-N 3.11Å; S400-L404 WeakPolarHBondContact O-CB 3.27Å; S400-L404 PolarHBondContact O-N 2.87Å
401L93.8Very high90.2Very high35 Ų3516.5 Ų16.518%0.18310%0.097CC..Hα-helixtrans-64.7-35.3175.7-71.1175.2000112.5L70 V370 Y374 N397 L404 S405L70-L401 HydrophobicContact CD1-CD1 3.81Å; V370-L401 HydrophobicContact CG1-CD2 4.33Å; V370-L401 HydrophobicContact CG2-CD2 4.1Å; Y374-L401 HydrophobicContact CE2-CD2 4.44Å; N397-L401 WeakPolarHBondContact O-CB 3.08Å; N397-L401 VanDerWaalsContact O-CG 3.25Å; N397-L401 WeakPolarHBondContact O-CG 3.38Å; N397-L401 PolarHBondContact O-N 3.02Å; L401-L404 PolarHBondContact O-N 3.26Å; L401-S405 WeakPolarHBondContact O-CB 3.42Å; L401-S405 PolarHBondContact O-N 3.4Å; L401-S405 PolarHBondContact O-OG 3.49Å; L401-S405 VanDerWaalsContact O-OG 3.12Å
402L93.4Very high90.2Very high1 Ų116.1 Ų16.11%0.00510%0.096CC..Hα-helixtrans-69.3-40.3176.5-175.266.1000112.4V72 A73 L122 C398 V399 S400 L404 S405 S406V72-L402 HydrophobicContact CG1-CD1 4.14Å; A73-L402 HydrophobicContact CB-CB 4.14Å; A73-L402 HydrophobicContact CB-CD1 3.86Å; L122-L402 HydrophobicContact CB-CD2 4.03Å; C398-L402 VanDerWaalsContact O-CB 3.25Å; C398-L402 WeakPolarHBondContact O-CB 3.29Å; C398-L402 PolarHBondContact O-N 3.3Å; V399-L402 PolarHBondContact O-N 2.83Å; S400-L402 VanDerWaalsContact C-N 3.32Å; S400-L402 PolarHBondContact O-N 3.4Å; L402-L404 VanDerWaalsContact C-N 3.35Å; L402-S405 WeakPolarHBondContact CA-OG 3.42Å; L402-S405 PolarHBondContact O-N 3Å; L402-S405 PolarHBondContact O-OG 2.87Å; L402-S405 VanDerWaalsContact O-OG 3.08Å; L402-S406 WeakPolarHBondContact O-CB 3.39Å; L402-S406 PolarHBondContact O-N 3.46Å; L402-S406 PolarHBondContact O-OG 3.3Å
403I91.4Very high89.9Confident25 Ų2514.1 Ų14.113%0.1288%0.08CC..Hα-helixtrans-63.1-44.8173.4-68.4166.6000109.9L122 F201 V399 S400 S405 S406 A407L122-I403 HydrophobicContact CD1-CG1 3.85Å; F201-I403 HydrophobicContact CD1-CG2 4.24Å; V399-I403 HydrophobicContact CG1-CD1 3.82Å; V399-I403 WeakPolarHBondContact O-CG1 3.45Å; V399-I403 PolarHBondContact O-N 3.43Å; S400-I403 PolarHBondContact O-N 3.11Å; I403-S405 PolarHBondContact O-N 3.43Å; I403-S406 PolarHBondContact O-OG 3.46Å; I403-S406 VanDerWaalsContact O-OG 3.07Å; I403-A407 WeakPolarHBondContact O-CB 3.34Å; I403-A407 PolarHBondContact O-N 2.96Å
404L91.6Very high89.5Confident2 Ų211.5 Ų11.51%0.017%0.068CC..Hα-helixtrans-64.3-41.1179.6-163.473000112.2L205 L206 M366 V370 S400 L401 L402 L408L205-L404 HydrophobicContact CD2-CD1 3.44Å; L205-L404 VanDerWaalsContact CD2-CD1 3.44Å; L206-L404 HydrophobicContact CD2-CD1 3.28Å; L206-L404 HydrophobicContact CD2-CG 3.82Å; L206-L404 HydrophobicContact CG-CD1 3.72Å; M366-L404 HydrophobicContact CE-CD2 3.93Å; M366-L404 HydrophobicContact CE-CG 4.23Å; M366-L404 HydrophobicContact SD-CD2 4.34Å; M366-L404 HydrophobicContact SD-CG 4.38Å; V370-L404 HydrophobicContact CB-CD2 4.38Å; V370-L404 HydrophobicContact CG2-CD2 3.51Å; S400-L404 WeakPolarHBondContact O-CB 3.27Å; S400-L404 PolarHBondContact O-N 2.87Å; L401-L404 PolarHBondContact O-N 3.26Å; L402-L404 VanDerWaalsContact C-N 3.35Å; L404-L408 PolarHBondContact O-N 3.33Å
405S91.4Very high89.1Confident0 Ų011.2 Ų11.20%07%0.067CC..Hα-helixtrans-73.8-38.5-178.964.90000113.2A73 V77 L401 L402 I403 A407 L408 P409A73-S405 WeakPolarHBondContact CA-OG 3.39Å; A73-S405 VanDerWaalsContact O-CB 3.26Å; A73-S405 WeakPolarHBondContact O-CB 3.43Å; A73-S405 PolarHBondContact O-OG 2.92Å; V77-S405 VanDerWaalsContact CG2-CB 3.48Å; L401-S405 WeakPolarHBondContact O-CB 3.42Å; L401-S405 PolarHBondContact O-N 3.4Å; L401-S405 PolarHBondContact O-OG 3.49Å; L401-S405 VanDerWaalsContact O-OG 3.12Å; L402-S405 WeakPolarHBondContact CA-OG 3.42Å; L402-S405 PolarHBondContact O-N 3Å; L402-S405 PolarHBondContact O-OG 2.87Å; L402-S405 VanDerWaalsContact O-OG 3.08Å; I403-S405 PolarHBondContact O-N 3.43Å; S405-A407 VanDerWaalsContact C-N 3.3Å; S405-A407 PolarHBondContact O-N 3.26Å; S405-L408 WeakPolarHBondContact O-CB 3.48Å; S405-L408 PolarHBondContact O-N 3.48Å; S405-P409 WeakPolarHBondContact O-CD 3.36Å
406S86.8Confident88.5Confident11 Ų1112 Ų128%0.0778%0.077CC..Hα-helixtrans-68.4-28.5177.154.80000113L402 I403 P409L402-S406 WeakPolarHBondContact O-CB 3.39Å; L402-S406 PolarHBondContact O-N 3.46Å; L402-S406 PolarHBondContact O-OG 3.3Å; I403-S406 PolarHBondContact O-OG 3.46Å; I403-S406 VanDerWaalsContact O-OG 3.07Å; S406-P409 WeakPolarHBondContact O-CD 3.47Å
407A87.5Confident88Confident0 Ų010.4 Ų10.40%06%0.064CC..Hα-helixtrans-81.1-16.417500000113.8G202 V203 L206 I403 S405 V410 F411G202-A407 VanDerWaalsContact C-CB 3.45Å; V203-A407 HydrophobicContact CG2-CB 3.92Å; L206-A407 HydrophobicContact CD1-CB 3.58Å; I403-A407 WeakPolarHBondContact O-CB 3.34Å; I403-A407 PolarHBondContact O-N 2.96Å; S405-A407 VanDerWaalsContact C-N 3.3Å; S405-A407 PolarHBondContact O-N 3.26Å; A407-V410 PolarHBondContact O-N 3.02Å; A407-F411 VanDerWaalsContact O-CB 3.26Å; A407-F411 WeakPolarHBondContact O-CB 3.32Å; A407-F411 PolarHBondContact O-N 3.21Å
408L87.1Confident87.1Confident3 Ų310 Ų102%0.0166%0.062CC..Hα-helixtrans-58.6-44-176-173.689.9000113.6V77 I362 M366 L404 S405 F411 S412V77-L408 HydrophobicContact CG1-CD2 4.44Å; I362-L408 HydrophobicContact CG2-CD2 3.9Å; M366-L408 HydrophobicContact CB-CD1 3.85Å; M366-L408 HydrophobicContact CG-CD1 4.36Å; M366-L408 HydrophobicContact SD-CD1 3.83Å; L404-L408 PolarHBondContact O-N 3.33Å; S405-L408 WeakPolarHBondContact O-CB 3.48Å; S405-L408 PolarHBondContact O-N 3.48Å; L408-F411 WeakPolarHBondContact O-CB 3.45Å; L408-F411 PolarHBondContact O-N 3.27Å; L408-S412 WeakPolarHBondContact O-CB 3.18Å; L408-S412 PolarHBondContact O-N 3.4Å
409P83.5Confident85.9Confident5 Ų517 Ų173%0.0329%0.088CC..Hα-helixtrans-61.9-44.7177.7-28.240000113.5L80 W111 S405 S406 F411 S412 R413 L423L80-P409 HydrophobicContact CD1-CB 3.92Å; L80-P409 HydrophobicContact CD1-CG 4.32Å; W111-P409 HydrophobicContact CH2-CB 3.62Å; W111-P409 HydrophobicContact CH2-CG 3.51Å; W111-P409 HydrophobicContact CZ3-CB 3.84Å; W111-P409 HydrophobicContact CZ3-CG 3.68Å; S405-P409 WeakPolarHBondContact O-CD 3.36Å; S406-P409 WeakPolarHBondContact O-CD 3.47Å; P409-F411 VanDerWaalsContact C-N 3.32Å; P409-S412 PolarHBondContact O-N 3.31Å; P409-R413 WeakPolarHBondContact O-CB 3.36Å; P409-R413 PolarHBondContact O-N 3.28Å; P409-L423 HydrophobicContact CB-CD2 3.95Å
410V81.4Confident84.4Confident3 Ų315.4 Ų15.42%0.0188%0.078CC..Hα-helixtrans-65.3-40.7177.8-176.60000109.9V203 A407 R413 T414 L423 W431 L432V203-V410 HydrophobicContact CG2-CB 3.99Å; V203-V410 HydrophobicContact CG2-CG1 3.88Å; A407-V410 PolarHBondContact O-N 3.02Å; V410-R413 PolarHBondContact O-N 2.97Å; V410-T414 HydrophobicContact CG1-CG2 4.25Å; V410-T414 WeakPolarHBondContact O-CB 3.34Å; V410-T414 VanDerWaalsContact O-CG2 3.23Å; V410-T414 WeakPolarHBondContact O-CG2 3.39Å; V410-T414 PolarHBondContact O-N 3.24Å; V410-T414 PolarHBondContact O-OG1 3.14Å; V410-L423 HydrophobicContact CG2-CD2 4.29Å; V410-W431 HydrophobicContact CG1-CH2 4.27Å; V410-W431 HydrophobicContact CG1-CZ2 3.9Å; V410-L432 HydrophobicContact CG1-CD1 3.82Å
411F87.1Confident82.7Confident1 Ų115.3 Ų15.30%0.0048%0.076CC..Hα-helixtrans-61-49.1174.4176.2-116.5000113.2L206 T210 L365 A407 L408 P409 R413 T414 L415 Y441 F445L206-F411 HydrophobicContact CB-CD1 4.47Å; L206-F411 HydrophobicContact CB-CD2 4.02Å; L206-F411 HydrophobicContact CB-CE2 4.22Å; L206-F411 HydrophobicContact CB-CG 4.11Å; L206-F411 HydrophobicContact CD1-CB 3.56Å; L206-F411 HydrophobicContact CD1-CD1 4.15Å; L206-F411 HydrophobicContact CD1-CD2 4.49Å; L206-F411 HydrophobicContact CD1-CG 3.83Å; L206-F411 HydrophobicContact CG-CG 4.49Å; T210-F411 HydrophobicContact CG2-CE1 3.98Å; T210-F411 HydrophobicContact CG2-CZ 3.81Å; L365-F411 HydrophobicContact CB-CE1 4.27Å; L365-F411 HydrophobicContact CD1-CE1 4.09Å; A407-F411 VanDerWaalsContact O-CB 3.26Å; A407-F411 WeakPolarHBondContact O-CB 3.32Å; A407-F411 PolarHBondContact O-N 3.21Å; L408-F411 WeakPolarHBondContact O-CB 3.45Å; L408-F411 PolarHBondContact O-N 3.27Å; P409-F411 VanDerWaalsContact C-N 3.32Å; F411-R413 VanDerWaalsContact C-N 3.31Å; F411-R413 PolarHBondContact O-N 2.87Å; F411-T414 WeakPolarHBondContact CA-OG1 3.44Å; F411-T414 PolarHBondContact O-N 3.27Å; F411-T414 PolarHBondContact O-OG1 3.39Å; F411-L415 HydrophobicContact CD1-CD1 4.38Å; F411-L415 HydrophobicContact CD2-CD1 4.04Å; F411-L415 HydrophobicContact CD2-CG 4.22Å; F411-L415 HydrophobicContact CE1-CD1 3.79Å; F411-L415 HydrophobicContact CE2-CD1 3.43Å; F411-L415 VanDerWaalsContact CE2-CD1 3.43Å; F411-L415 HydrophobicContact CE2-CD2 4.46Å; F411-L415 HydrophobicContact CE2-CG 3.94Å; F411-L415 HydrophobicContact CZ-CD1 3.29Å; F411-L415 HydrophobicContact CZ-CG 4.29Å; F411-L415 WeakPolarHBondContact O-CB 3.39Å; F411-L415 WeakPolarHBondContact O-CG 3.47Å; F411-L415 PolarHBondContact O-N 2.91Å; F411-L415 VanDerWaalsContact O-N 3.07Å; F411-Y441 HydrophobicContact CD2-CE1 4.04Å; F411-Y441 AromaticContact CD2-CZ 3.92Å; F411-Y441 WeakPolarHBondContact CD2-OH 3.33Å; F411-Y441 HydrophobicContact CE2-CE1 4.14Å; F411-Y441 WeakPolarHBondContact CE2-OH 3.45Å; F411-F445 HydrophobicContact CE2-CD2 4.18Å; F411-F445 HydrophobicContact CE2-CE2 4.14Å; F411-F445 HydrophobicContact CZ-CD2 4.16Å; F411-F445 AromaticContact CZ-CE2 3.65Å; F411-F445 HydrophobicContact CZ-CE2 3.65Å; F411-F445 HydrophobicContact CZ-CZ 4.24Å
412S86.9Confident80.7Confident4 Ų413.8 Ų13.83%0.0287%0.068CC..Hα-helixtrans-61.6-39.5178.8-176.50000112.3L408 P409 G416 I417 T418L408-S412 WeakPolarHBondContact O-CB 3.18Å; L408-S412 PolarHBondContact O-N 3.4Å; P409-S412 PolarHBondContact O-N 3.31Å; S412-G416 PolarHBondContact O-N 2.91Å; S412-I417 PolarHBondContact O-N 3.43Å; S412-I417 VanDerWaalsContact O-N 3.08Å; S412-T418 PolarHBondContact OG-OG1 3.13Å
413R81.8Confident78.8Confident26 Ų2614.2 Ų14.210%0.0987%0.07CC..Hα-helixtrans-70.8-46.7177.5-178177.3177.892.8-7.1112.2P334 R335 P409 V410 F411 L415 G416 D421 L423P334-R413 HydrophobicContact CB-CG 3.92Å; P334-R413 PolarHBondContact O-NH2 3.45Å; R335-R413 PolarHBondContact O-NH2 3Å; P409-R413 WeakPolarHBondContact O-CB 3.36Å; P409-R413 PolarHBondContact O-N 3.28Å; V410-R413 PolarHBondContact O-N 2.97Å; F411-R413 VanDerWaalsContact C-N 3.31Å; F411-R413 PolarHBondContact O-N 2.87Å; R413-L415 PolarHBondContact O-N 3.5Å; R413-G416 PolarHBondContact O-N 3.48Å; R413-D421 IonicContact CZ-OD1 3.38Å; R413-D421 VanDerWaalsContact CZ-OD1 3.27Å; R413-D421 IonicContact CZ-OD2 2.68Å; R413-D421 IonicContact NH1-OD1 3.34Å; R413-D421 PolarHBondContact NH1-OD1 3.13Å; R413-D421 VanDerWaalsContact NH1-OD1 3.1Å; R413-D421 IonicContact NH1-OD2 3.69Å; R413-D421 PolarHBondContact NH1-OD2 3.44Å; R413-D421 IonicContact NH2-OD1 3.6Å; R413-D421 PolarHBondContact NH2-OD1 2.89Å; R413-D421 IonicContact NH2-OD2 2.7Å; R413-D421 PolarHBondContact NH2-OD2 2.92Å; R413-L423 HydrophobicContact CB-CD1 4.39Å
414T83.1Confident77Confident1 Ų115.5 Ų15.51%0.0069%0.089CC..Hα-helixtrans-61.9-34.3179.448.30000112.1N322 V410 F411 G416 W431 L432 N442N322-T414 PolarHBondContact ND2-O 3.41Å; V410-T414 HydrophobicContact CG1-CG2 4.25Å; V410-T414 WeakPolarHBondContact O-CB 3.34Å; V410-T414 VanDerWaalsContact O-CG2 3.23Å; V410-T414 WeakPolarHBondContact O-CG2 3.39Å; V410-T414 PolarHBondContact O-N 3.24Å; V410-T414 PolarHBondContact O-OG1 3.14Å; F411-T414 WeakPolarHBondContact CA-OG1 3.44Å; F411-T414 PolarHBondContact O-N 3.27Å; F411-T414 PolarHBondContact O-OG1 3.39Å; T414-G416 VanDerWaalsContact C-N 3.28Å; T414-G416 PolarHBondContact O-N 3.33Å; T414-W431 HydrophobicContact CG2-CH2 4.16Å; T414-L432 HydrophobicContact CG2-CD1 3.88Å; T414-L432 HydrophobicContact CG2-CG 4.33Å; T414-N442 PolarHBondContact O-ND2 2.95Å; T414-N442 PolarHBondContact O-OD1 3.36Å
415L84.6Confident74.9Confident0 Ų020 Ų200%011%0.114CC..THydrogen-bonded Turntrans-74.8-10.1173.4-71.4-173.2000114.9V319 N322 F411 R413 I417 Y441 N442 F445V319-L415 HydrophobicContact CG1-CD2 4.3Å; V319-L415 HydrophobicContact CG2-CB 4.03Å; V319-L415 HydrophobicContact CG2-CD1 4.39Å; V319-L415 HydrophobicContact CG2-CD2 4.01Å; V319-L415 HydrophobicContact CG2-CG 4.37Å; N322-L415 PolarHBondContact ND2-O 2.97Å; F411-L415 HydrophobicContact CD1-CD1 4.38Å; F411-L415 HydrophobicContact CD2-CD1 4.04Å; F411-L415 HydrophobicContact CD2-CG 4.22Å; F411-L415 HydrophobicContact CE1-CD1 3.79Å; F411-L415 HydrophobicContact CE2-CD1 3.43Å; F411-L415 VanDerWaalsContact CE2-CD1 3.43Å; F411-L415 HydrophobicContact CE2-CD2 4.46Å; F411-L415 HydrophobicContact CE2-CG 3.94Å; F411-L415 HydrophobicContact CZ-CD1 3.29Å; F411-L415 HydrophobicContact CZ-CG 4.29Å; F411-L415 WeakPolarHBondContact O-CB 3.39Å; F411-L415 WeakPolarHBondContact O-CG 3.47Å; F411-L415 PolarHBondContact O-N 2.91Å; F411-L415 VanDerWaalsContact O-N 3.07Å; R413-L415 PolarHBondContact O-N 3.5Å; L415-I417 VanDerWaalsContact C-N 3.29Å; L415-I417 HydrophobicContact CB-CD1 4.03Å; L415-I417 HydrophobicContact CB-CG1 3.95Å; L415-I417 HydrophobicContact CD1-CD1 3.98Å; L415-I417 PolarHBondContact O-N 3.44Å; L415-Y441 HydrophobicContact CD2-CD1 4.25Å; L415-Y441 HydrophobicContact CD2-CE1 3.92Å; L415-Y441 HydrophobicContact CG-CE1 4.36Å; L415-N442 WeakPolarHBondContact CA-OD1 3.41Å; L415-F445 HydrophobicContact CD1-CD1 4.02Å; L415-F445 HydrophobicContact CD1-CD2 4.23Å; L415-F445 HydrophobicContact CD1-CE1 3.76Å; L415-F445 HydrophobicContact CD1-CE2 3.98Å; L415-F445 HydrophobicContact CD1-CG 4.24Å; L415-F445 HydrophobicContact CD1-CZ 3.72Å; L415-F445 HydrophobicContact CD2-CB 3.83Å; L415-F445 HydrophobicContact CD2-CD1 3.58Å; L415-F445 HydrophobicContact CD2-CD2 4.23Å; L415-F445 HydrophobicContact CD2-CE1 4.17Å; L415-F445 HydrophobicContact CD2-CG 3.6Å; L415-F445 HydrophobicContact CG-CD1 4.48Å
416G80.1Confident72.9Confident26 Ų2621 Ų2127%0.26812%0.118SC..THydrogen-bonded Turntrans71.918.2-17700000114.7N322 S412 R413 T414 T418N322-G416 VanDerWaalsContact CG-CA 3.49Å; N322-G416 PolarHBondContact ND2-N 3.22Å; S412-G416 PolarHBondContact O-N 2.91Å; R413-G416 PolarHBondContact O-N 3.48Å; T414-G416 VanDerWaalsContact C-N 3.28Å; T414-G416 PolarHBondContact O-N 3.33Å; G416-T418 VanDerWaalsContact C-N 3.32Å
417I82.1Confident71.1Confident2 Ų221.4 Ų21.41%0.0112%0.124CC..SBendtrans-70.9-34.8178.1-61.1174.7000110.3M318 Q358 L361 I362 L365 S412 L415M318-I417 HydrophobicContact SD-CG2 4.44Å; Q358-I417 PolarHBondContact NE2-O 3Å; L361-I417 HydrophobicContact CB-CG2 4.37Å; I362-I417 HydrophobicContact CG1-CG2 4.37Å; L365-I417 HydrophobicContact CD1-CD1 3.16Å; S412-I417 PolarHBondContact O-N 3.43Å; S412-I417 VanDerWaalsContact O-N 3.08Å; L415-I417 VanDerWaalsContact C-N 3.29Å; L415-I417 HydrophobicContact CB-CD1 4.03Å; L415-I417 HydrophobicContact CB-CG1 3.95Å; L415-I417 HydrophobicContact CD1-CD1 3.98Å; L415-I417 PolarHBondContact O-N 3.44Å
418T76.3Confident69.3Low4 Ų430.4 Ų30.43%0.02516%0.158CC..  trans-132.8131.3180540000111.7L80 I84 Q358 I362 S412 G416 F420L80-T418 HydrophobicContact CD2-CG2 4.19Å; I84-T418 HydrophobicContact CD1-CG2 3.76Å; Q358-T418 HydrophobicContact CB-CG2 4.44Å; I362-T418 HydrophobicContact CD1-CG2 3.61Å; I362-T418 HydrophobicContact CG1-CG2 4.39Å; S412-T418 PolarHBondContact OG-OG1 3.13Å; G416-T418 VanDerWaalsContact C-N 3.32Å; T418-F420 VanDerWaalsContact C-N 3.27Å
419R67.7Low68Low150 Ų15031.2 Ų31.257%0.56616%0.161SC*.  trans-84.2-2.1171-63.8-173.5176.1-160.5-7.6113.5E325 D421E325-R419 IonicContact OE1-CZ 2.7Å; E325-R419 IonicContact OE1-NH2 3.57Å; E325-R419 PolarHBondContact OE1-NH2 2.94Å; E325-R419 IonicContact OE2-NH2 3.1Å; E325-R419 PolarHBondContact OE2-NH2 3.48Å; R419-D421 PolarHBondContact O-N 3.46Å
420F61.6Low66.8Low7 Ų737.1 Ų37.13%0.03119%0.192CC..  trans-63122.1-177.1-168.4-112.2000111S83 L342 F347 T418 L422S83-F420 VanDerWaalsContact CB-CZ 3.46Å; L342-F420 HydrophobicContact CD2-CE2 3.82Å; L342-F420 HydrophobicContact CD2-CZ 4.16Å; L342-F420 HydrophobicContact CG-CE2 4.35Å; F347-F420 AromaticContact CD2-CD2 3.99Å; F347-F420 HydrophobicContact CD2-CD2 3.99Å; F347-F420 HydrophobicContact CD2-CE2 4.49Å; F347-F420 HydrophobicContact CE1-CD2 4.18Å; F347-F420 AromaticContact CE2-CD2 3.42Å; F347-F420 HydrophobicContact CE2-CD2 3.42Å; F347-F420 VanDerWaalsContact CE2-CD2 3.42Å; F347-F420 AromaticContact CE2-CE2 3.59Å; F347-F420 HydrophobicContact CE2-CE2 3.59Å; F347-F420 AromaticContact CZ-CD2 3.57Å; F347-F420 HydrophobicContact CZ-CD2 3.57Å; F347-F420 AromaticContact CZ-CE2 3.77Å; F347-F420 HydrophobicContact CZ-CE2 3.77Å; T418-F420 VanDerWaalsContact C-N 3.27Å; F420-L422 HydrophobicContact CD1-CB 4.18Å; F420-L422 HydrophobicContact CD1-CD1 4.44Å; F420-L422 HydrophobicContact CD2-CD1 4.07Å; F420-L422 HydrophobicContact CE1-CB 3.49Å; F420-L422 VanDerWaalsContact CE1-CB 3.49Å; F420-L422 HydrophobicContact CE1-CD1 3.73Å; F420-L422 HydrophobicContact CE1-CD2 4.39Å; F420-L422 HydrophobicContact CE1-CG 4Å; F420-L422 HydrophobicContact CE2-CD1 3.27Å; F420-L422 HydrophobicContact CE2-CG 4.36Å; F420-L422 HydrophobicContact CZ-CB 3.78Å; F420-L422 HydrophobicContact CZ-CD1 3.08Å; F420-L422 HydrophobicContact CZ-CD2 3.95Å; F420-L422 HydrophobicContact CZ-CG 3.72Å
421D56.8Low66.1Low15 Ų1538.6 Ų38.68%0.0820%0.197CC..  trans-121.148.6-174.1-156.17.4000112.8G336 M337 P340 R413 R419 L423G336-D421 WeakPolarHBondContact CA-OD2 3.31Å; M337-D421 PolarHBondContact N-OD2 3.49Å; P340-D421 WeakPolarHBondContact CG-O 3.4Å; R413-D421 IonicContact CZ-OD1 3.38Å; R413-D421 VanDerWaalsContact CZ-OD1 3.27Å; R413-D421 IonicContact CZ-OD2 2.68Å; R413-D421 IonicContact NH1-OD1 3.34Å; R413-D421 PolarHBondContact NH1-OD1 3.13Å; R413-D421 VanDerWaalsContact NH1-OD1 3.1Å; R413-D421 IonicContact NH1-OD2 3.69Å; R413-D421 PolarHBondContact NH1-OD2 3.44Å; R413-D421 IonicContact NH2-OD1 3.6Å; R413-D421 PolarHBondContact NH2-OD1 2.89Å; R413-D421 IonicContact NH2-OD2 2.7Å; R413-D421 PolarHBondContact NH2-OD2 2.92Å; R419-D421 PolarHBondContact O-N 3.46Å; D421-L423 PolarHBondContact O-N 3.21Å
422L52.6Low65.1Low4 Ų438.8 Ų38.82%0.02120%0.198CC..THydrogen-bonded Turntrans-8314.9166.3-94.584.1000112.9I107 H108 P340 L342 F420 G424I107-L422 HydrophobicContact CB-CD2 4.1Å; I107-L422 HydrophobicContact CG2-CD2 3.6Å; H108-L422 WeakPolarHBondContact CE1-CG 3.35Å; H108-L422 WeakPolarHBondContact NE2-CD2 3.24Å; P340-L422 HydrophobicContact CB-CD1 3.76Å; P340-L422 HydrophobicContact CG-CD1 3.62Å; P340-L422 HydrophobicContact CG-CG 3.91Å; L342-L422 HydrophobicContact CD1-CD1 3.57Å; L342-L422 HydrophobicContact CD1-CD2 3.7Å; L342-L422 HydrophobicContact CD1-CG 4.21Å; L342-L422 HydrophobicContact CD2-CD1 4.44Å; L342-L422 HydrophobicContact CG-CD1 3.97Å; F420-L422 HydrophobicContact CD1-CB 4.18Å; F420-L422 HydrophobicContact CD1-CD1 4.44Å; F420-L422 HydrophobicContact CD2-CD1 4.07Å; F420-L422 HydrophobicContact CE1-CB 3.49Å; F420-L422 VanDerWaalsContact CE1-CB 3.49Å; F420-L422 HydrophobicContact CE1-CD1 3.73Å; F420-L422 HydrophobicContact CE1-CD2 4.39Å; F420-L422 HydrophobicContact CE1-CG 4Å; F420-L422 HydrophobicContact CE2-CD1 3.27Å; F420-L422 HydrophobicContact CE2-CG 4.36Å; F420-L422 HydrophobicContact CZ-CB 3.78Å; F420-L422 HydrophobicContact CZ-CD1 3.08Å; F420-L422 HydrophobicContact CZ-CD2 3.95Å; F420-L422 HydrophobicContact CZ-CG 3.72Å; L422-G424 PolarHBondContact O-N 2.94Å
423L53.1Low64.2Low9 Ų940.4 Ų40.45%0.04722%0.216CC..THydrogen-bonded Turntrans-71.2-6.1-177.8-90.8138.5000112.4P409 V410 R413 D421 D425 F426P409-L423 HydrophobicContact CB-CD2 3.95Å; V410-L423 HydrophobicContact CG2-CD2 4.29Å; R413-L423 HydrophobicContact CB-CD1 4.39Å; D421-L423 PolarHBondContact O-N 3.21Å; L423-D425 PolarHBondContact O-N 2.94Å; L423-F426 HydrophobicContact CB-CB 3.93Å; L423-F426 HydrophobicContact CD2-CB 3.32Å; L423-F426 HydrophobicContact CD2-CD1 3.94Å; L423-F426 HydrophobicContact CD2-CD2 4.17Å; L423-F426 HydrophobicContact CD2-CG 3.61Å; L423-F426 HydrophobicContact CG-CB 4.22Å; L423-F426 WeakPolarHBondContact O-CA 3.29Å; L423-F426 WeakPolarHBondContact O-CB 3.44Å; L423-F426 WeakPolarHBondContact O-CD2 3.31Å; L423-F426 WeakPolarHBondContact O-CG 3.43Å; L423-F426 PolarHBondContact O-N 2.78Å
424G53.2Low64.1Low52 Ų5242.5 Ų42.554%0.53623%0.229SC..G310 helixtrans43.1-128.817200000113.2L422 F426 G427L422-G424 PolarHBondContact O-N 2.94Å; G424-F426 PolarHBondContact O-N 3.09Å; G424-G427 PolarHBondContact O-N 2.98Å
425D48.3Very low64Low98 Ų9844.9 Ų44.952%0.52424%0.24SC..G310 helixtrans-58.1-14.7176.6-77.7-42000115.8L423 G427 R428L423-D425 PolarHBondContact O-N 2.94Å; D425-G427 PolarHBondContact O-N 3.36Å; D425-R428 WeakPolarHBondContact O-CB 3.46Å; D425-R428 PolarHBondContact O-N 2.93Å; D425-R428 WeakPolarHBondContact OD1-CD 3.28Å; D425-R428 IonicContact OD1-CZ 3.37Å; D425-R428 IonicContact OD1-NE 3.54Å; D425-R428 IonicContact OD1-NH1 3.75Å; D425-R428 PolarHBondContact OD1-NH1 3.2Å
426F49.4Very low64Low19 Ų1953.2 Ų53.28%0.08327%0.272CS..G310 helixtrans-67.7-16.5171.5-61.6-107.9000112.4W111 F115 Y195 L423 G424 R428 Y429W111-F426 HydrophobicContact CE3-CE2 4.17Å; W111-F426 HydrophobicContact CE3-CZ 4.4Å; F115-F426 HydrophobicContact CB-CE2 4.16Å; F115-F426 HydrophobicContact CB-CZ 4.03Å; F115-F426 AromaticContact CD2-CE1 3.83Å; F115-F426 HydrophobicContact CD2-CE1 3.83Å; F115-F426 AromaticContact CD2-CE2 3.78Å; F115-F426 HydrophobicContact CD2-CE2 3.78Å; F115-F426 AromaticContact CD2-CZ 3.38Å; F115-F426 HydrophobicContact CD2-CZ 3.38Å; F115-F426 HydrophobicContact CE2-CE1 4.25Å; F115-F426 HydrophobicContact CE2-CE2 4.47Å; F115-F426 HydrophobicContact CE2-CZ 4.16Å; F115-F426 HydrophobicContact CG-CE2 4.18Å; F115-F426 HydrophobicContact CG-CZ 4.07Å; Y195-F426 HydrophobicContact CE1-CD1 4.35Å; Y195-F426 HydrophobicContact CE1-CE1 4.43Å; Y195-F426 VanDerWaalsContact OH-CE1 3.25Å; Y195-F426 WeakPolarHBondContact OH-CE1 3.41Å; L423-F426 HydrophobicContact CB-CB 3.93Å; L423-F426 HydrophobicContact CD2-CB 3.32Å; L423-F426 HydrophobicContact CD2-CD1 3.94Å; L423-F426 HydrophobicContact CD2-CD2 4.17Å; L423-F426 HydrophobicContact CD2-CG 3.61Å; L423-F426 HydrophobicContact CG-CB 4.22Å; L423-F426 WeakPolarHBondContact O-CA 3.29Å; L423-F426 WeakPolarHBondContact O-CB 3.44Å; L423-F426 WeakPolarHBondContact O-CD2 3.31Å; L423-F426 WeakPolarHBondContact O-CG 3.43Å; L423-F426 PolarHBondContact O-N 2.78Å; G424-F426 PolarHBondContact O-N 3.09Å; F426-R428 VanDerWaalsContact C-N 3.31Å; F426-Y429 HydrophobicContact CB-CE2 3.96Å; F426-Y429 HydrophobicContact CD1-CE2 4.38Å; F426-Y429 WeakPolarHBondContact O-CD2 3.46Å; F426-Y429 WeakPolarHBondContact O-CE2 3.46Å
427G48.3Very low64.2Low20 Ų2054.6 Ų54.621%0.20628%0.275CS..G310 helixtrans-78.6-10.9172.900000114.2G424 D425 Y429G424-G427 PolarHBondContact O-N 2.98Å; D425-G427 PolarHBondContact O-N 3.36Å; G427-Y429 VanDerWaalsContact C-N 3.25Å; G427-Y429 PolarHBondContact O-N 3.5Å
428R50.3Low64.3Low190 Ų19054.7 Ų54.772%0.71728%0.276SS*.G310 helixtrans-82.98.5-179.5-71.5-179165.8164.4-10.5114D425 F426 N430D425-R428 WeakPolarHBondContact O-CB 3.46Å; D425-R428 PolarHBondContact O-N 2.93Å; D425-R428 WeakPolarHBondContact OD1-CD 3.28Å; D425-R428 IonicContact OD1-CZ 3.37Å; D425-R428 IonicContact OD1-NE 3.54Å; D425-R428 IonicContact OD1-NH1 3.75Å; D425-R428 PolarHBondContact OD1-NH1 3.2Å; F426-R428 VanDerWaalsContact C-N 3.31Å; R428-N430 PolarHBondContact O-N 3.2Å
429Y59.4Low64.9Low20 Ų2057 Ų578%0.07829%0.286CS..  trans-72.5114.3174.2-59.6-52000110.4Y195 S196 F426 G427 W431 L432Y195-Y429 AromaticContact CD1-CE1 3.83Å; Y195-Y429 HydrophobicContact CD1-CE1 3.83Å; Y195-Y429 AromaticContact CD1-CZ 3.59Å; Y195-Y429 WeakPolarHBondContact CD1-OH 3.12Å; Y195-Y429 HydrophobicContact CE1-CE1 4.33Å; Y195-Y429 HydrophobicContact CE1-CE2 4.36Å; Y195-Y429 AromaticContact CE1-CZ 3.62Å; Y195-Y429 WeakPolarHBondContact CE1-OH 3.27Å; S196-Y429 WeakPolarHBondContact OG-CD1 3.44Å; F426-Y429 HydrophobicContact CB-CE2 3.96Å; F426-Y429 HydrophobicContact CD1-CE2 4.38Å; F426-Y429 WeakPolarHBondContact O-CD2 3.46Å; F426-Y429 WeakPolarHBondContact O-CE2 3.46Å; G427-Y429 VanDerWaalsContact C-N 3.25Å; G427-Y429 PolarHBondContact O-N 3.5Å; Y429-W431 PolarHBondContact O-N 3.25Å; Y429-L432 PolarHBondContact O-N 2.8Å
430N58.1Low66Low129 Ų12954.9 Ų54.969%0.6929%0.285SS*.THydrogen-bonded Turntrans-51-27.7178.4-71.6-16.7000113.8R428R428-N430 PolarHBondContact O-N 3.2Å
431W66.5Low67.3Low33 Ų3355.2 Ų55.213%0.12529%0.286CS..THydrogen-bonded Turntrans-76.1-27.4178.977.8-92000114.1L200 V203 V410 T414 Y429 G433 N434 V437L200-W431 HydrophobicContact CD1-CD2 4.42Å; L200-W431 HydrophobicContact CD1-CG 4.37Å; V203-W431 HydrophobicContact CG1-CH2 4.04Å; V203-W431 HydrophobicContact CG2-CZ2 4.49Å; V410-W431 HydrophobicContact CG1-CH2 4.27Å; V410-W431 HydrophobicContact CG1-CZ2 3.9Å; T414-W431 HydrophobicContact CG2-CH2 4.16Å; Y429-W431 PolarHBondContact O-N 3.25Å; W431-G433 PolarHBondContact O-N 3.37Å; W431-N434 PolarHBondContact O-N 3.45Å; W431-V437 HydrophobicContact CE3-CG1 3.69Å; W431-V437 HydrophobicContact CZ3-CG1 4.11Å
432L66.1Low68.9Low5 Ų554.5 Ų54.53%0.02628%0.283CS..THydrogen-bonded Turntrans-70.3-21.7177-12276000112.2P334 V410 T414 Y429 N434P334-L432 HydrophobicContact CB-CD2 4.35Å; P334-L432 HydrophobicContact CG-CD2 4.35Å; P334-L432 HydrophobicContact CG-CG 4.27Å; V410-L432 HydrophobicContact CG1-CD1 3.82Å; T414-L432 HydrophobicContact CG2-CD1 3.88Å; T414-L432 HydrophobicContact CG2-CG 4.33Å; Y429-L432 PolarHBondContact O-N 2.8Å; L432-N434 VanDerWaalsContact C-N 3.33Å
433G67.8Low70.8Confident39 Ų3958.3 Ų58.340%0.40230%0.301SS..THydrogen-bonded Turntrans-81.6-7174.300000114.4W431W431-G433 PolarHBondContact O-N 3.37Å
434N80.1Confident72.7Confident70 Ų7061.8 Ų61.837%0.37432%0.319SS..  trans-92.5109.2179.4-172.1-11.8000111.1W431 L432 Y436 V437 V438W431-N434 PolarHBondContact O-N 3.45Å; L432-N434 VanDerWaalsContact C-N 3.33Å; N434-Y436 VanDerWaalsContact C-N 3.3Å; N434-Y436 PolarHBondContact O-N 2.98Å; N434-Y436 PolarHBondContact OD1-N 2.6Å; N434-Y436 VanDerWaalsContact OD1-N 3.12Å; N434-V437 HydrophobicContact CB-CB 4.34Å; N434-V437 HydrophobicContact CB-CG2 4.03Å; N434-V437 PolarHBondContact O-N 3.49Å; N434-V438 PolarHBondContact O-N 3.39Å
435F82.3Confident74.6Confident50 Ų5059.3 Ų59.322%0.21929%0.294CS..Hα-helixtrans-48.6-47.8177.6175.8-99.5000113.1L326 M333 V437 V438 F439L326-F435 HydrophobicContact CB-CE2 4.22Å; L326-F435 WeakPolarHBondContact O-CE2 3.38Å; M333-F435 HydrophobicContact SD-CB 4.24Å; F435-V437 VanDerWaalsContact C-N 3.31Å; F435-V437 PolarHBondContact O-N 3.43Å; F435-V438 PolarHBondContact O-N 2.98Å; F435-F439 HydrophobicContact CE1-CB 4.28Å; F435-F439 HydrophobicContact CE1-CG 4.43Å; F435-F439 HydrophobicContact CZ-CB 4.29Å; F435-F439 HydrophobicContact CZ-CD2 4.14Å; F435-F439 HydrophobicContact CZ-CG 4.34Å; F435-F439 WeakPolarHBondContact O-CB 3.21Å; F435-F439 PolarHBondContact O-N 3.34Å
436Y84.9Confident76.7Confident176 Ų17655.1 Ų55.169%0.6927%0.273SS*.Hα-helixtrans-63.8-37.1-175.1-66.6-80.4000112.7N434 L440N434-Y436 VanDerWaalsContact C-N 3.3Å; N434-Y436 PolarHBondContact O-N 2.98Å; N434-Y436 PolarHBondContact OD1-N 2.6Å; N434-Y436 VanDerWaalsContact OD1-N 3.12Å; Y436-L440 WeakPolarHBondContact O-CB 3.42Å; Y436-L440 PolarHBondContact O-N 3.12Å
437V84.1Confident78.7Confident55 Ų5556.2 Ų56.233%0.33329%0.29SS..Hα-helixtrans-69.9-47.6-179.9179.20000109.9W431 N434 F435 L440 Y441W431-V437 HydrophobicContact CE3-CG1 3.69Å; W431-V437 HydrophobicContact CZ3-CG1 4.11Å; N434-V437 HydrophobicContact CB-CB 4.34Å; N434-V437 HydrophobicContact CB-CG2 4.03Å; N434-V437 PolarHBondContact O-N 3.49Å; F435-V437 VanDerWaalsContact C-N 3.31Å; F435-V437 PolarHBondContact O-N 3.43Å; V437-L440 PolarHBondContact O-N 3.13Å; V437-Y441 VanDerWaalsContact O-CB 3.24Å; V437-Y441 WeakPolarHBondContact O-CB 3.4Å; V437-Y441 PolarHBondContact O-N 3.32Å
438V84.4Confident80.8Confident3 Ų358.7 Ų58.72%0.01830%0.298CS..Hα-helixtrans-64.5-42.9178.8178.50000110.8L326 P334 N434 F435 Y441 N442L326-V438 HydrophobicContact CD1-CG1 4.06Å; P334-V438 HydrophobicContact CG-CG2 4.44Å; N434-V438 PolarHBondContact O-N 3.39Å; F435-V438 PolarHBondContact O-N 2.98Å; V438-Y441 WeakPolarHBondContact O-CB 3.37Å; V438-Y441 PolarHBondContact O-N 3.41Å; V438-N442 PolarHBondContact O-N 3.42Å; V438-N442 PolarHBondContact O-ND2 3.23Å
439F88.1Confident82.7Confident54 Ų5449.8 Ų49.824%0.23726%0.264CS..Hα-helixtrans-62.9-49.5177.6179.9-97.1000112.1V323 L327 F435 Y441 N442 M443V323-F439 HydrophobicContact CG1-CD2 4.42Å; V323-F439 HydrophobicContact CG1-CE2 3.86Å; L327-F439 HydrophobicContact CD1-CE2 3.77Å; L327-F439 HydrophobicContact CD1-CZ 4.29Å; L327-F439 HydrophobicContact CG-CE2 4.21Å; F435-F439 HydrophobicContact CE1-CB 4.28Å; F435-F439 HydrophobicContact CE1-CG 4.43Å; F435-F439 HydrophobicContact CZ-CB 4.29Å; F435-F439 HydrophobicContact CZ-CD2 4.14Å; F435-F439 HydrophobicContact CZ-CG 4.34Å; F435-F439 WeakPolarHBondContact O-CB 3.21Å; F435-F439 PolarHBondContact O-N 3.34Å; F439-Y441 VanDerWaalsContact C-N 3.29Å; F439-Y441 PolarHBondContact O-N 2.89Å; F439-N442 PolarHBondContact O-N 3.45Å; F439-M443 HydrophobicContact CD1-CG 4.3Å; F439-M443 HydrophobicContact CE1-CE 4.27Å; F439-M443 HydrophobicContact CE1-CG 3.87Å; F439-M443 HydrophobicContact CE2-CE 3.83Å; F439-M443 HydrophobicContact CE2-CG 4.29Å; F439-M443 HydrophobicContact CZ-CE 3.43Å; F439-M443 VanDerWaalsContact CZ-CE 3.43Å; F439-M443 HydrophobicContact CZ-CG 3.87Å; F439-M443 WeakPolarHBondContact O-CB 3.35Å; F439-M443 PolarHBondContact O-N 2.64Å
440L89.6Confident84.1Confident105 Ų10551.4 Ų51.455%0.5528%0.278SS..Hα-helixtrans-60.1-42177.7-179.566.4000111.2Y436 V437 M443 L444Y436-L440 WeakPolarHBondContact O-CB 3.42Å; Y436-L440 PolarHBondContact O-N 3.12Å; V437-L440 PolarHBondContact O-N 3.13Å; L440-M443 PolarHBondContact O-N 2.75Å; L440-L444 HydrophobicContact CD1-CD1 4.2Å; L440-L444 HydrophobicContact CD1-CG 4.25Å; L440-L444 HydrophobicContact CD2-CD1 4.49Å; L440-L444 HydrophobicContact CG-CD1 3.91Å; L440-L444 HydrophobicContact CG-CG 4.37Å; L440-L444 WeakPolarHBondContact O-CB 3.3Å; L440-L444 VanDerWaalsContact O-CG 3.28Å; L440-L444 WeakPolarHBondContact O-CG 3.37Å; L440-L444 PolarHBondContact O-N 2.97Å
441Y89.9Confident85.7Confident14 Ų1448.1 Ų48.16%0.05527%0.269CS..Hα-helixtrans-58.1-50.7177.4-173.7-89.5000111.9V203 L207 F411 L415 V437 V438 F439 L444 F445V203-Y441 HydrophobicContact CG1-CD2 4.35Å; V203-Y441 HydrophobicContact CG1-CE1 4.36Å; V203-Y441 HydrophobicContact CG1-CE2 3.45Å; V203-Y441 VanDerWaalsContact CG1-CE2 3.45Å; V203-Y441 VanDerWaalsContact CG1-CZ 3.47Å; V203-Y441 WeakPolarHBondContact CG1-OH 3.3Å; V203-Y441 PolarHBondContact O-OH 3.07Å; L207-Y441 HydrophobicContact CB-CE2 3.65Å; L207-Y441 WeakPolarHBondContact CB-OH 3.01Å; L207-Y441 HydrophobicContact CD1-CD2 4.32Å; L207-Y441 HydrophobicContact CD1-CE1 4.19Å; L207-Y441 HydrophobicContact CD1-CE2 3.93Å; L207-Y441 HydrophobicContact CD2-CD2 3.84Å; L207-Y441 HydrophobicContact CD2-CE2 3.69Å; L207-Y441 HydrophobicContact CG-CD2 4.48Å; L207-Y441 HydrophobicContact CG-CE2 3.95Å; F411-Y441 HydrophobicContact CD2-CE1 4.04Å; F411-Y441 AromaticContact CD2-CZ 3.92Å; F411-Y441 WeakPolarHBondContact CD2-OH 3.33Å; F411-Y441 HydrophobicContact CE2-CE1 4.14Å; F411-Y441 WeakPolarHBondContact CE2-OH 3.45Å; L415-Y441 HydrophobicContact CD2-CD1 4.25Å; L415-Y441 HydrophobicContact CD2-CE1 3.92Å; L415-Y441 HydrophobicContact CG-CE1 4.36Å; V437-Y441 VanDerWaalsContact O-CB 3.24Å; V437-Y441 WeakPolarHBondContact O-CB 3.4Å; V437-Y441 PolarHBondContact O-N 3.32Å; V438-Y441 WeakPolarHBondContact O-CB 3.37Å; V438-Y441 PolarHBondContact O-N 3.41Å; F439-Y441 VanDerWaalsContact C-N 3.29Å; F439-Y441 PolarHBondContact O-N 2.89Å; Y441-L444 PolarHBondContact O-N 3.26Å; Y441-F445 WeakPolarHBondContact O-CB 3.21Å; Y441-F445 PolarHBondContact O-N 3.43Å
442N90.9Very high86.6Confident0 Ų047.5 Ų47.50%027%0.27CS..Hα-helixtrans-63.7-42.4178.9-81.3-82.2000112.3V319 N322 V323 T414 L415 V438 F439 F445 A446V319-N442 HydrophobicContact CG1-CB 4.26Å; N322-N442 PolarHBondContact ND2-OD1 2.93Å; V323-N442 HydrophobicContact CG2-CB 3.48Å; V323-N442 VanDerWaalsContact CG2-CB 3.48Å; T414-N442 PolarHBondContact O-ND2 2.95Å; T414-N442 PolarHBondContact O-OD1 3.36Å; L415-N442 WeakPolarHBondContact CA-OD1 3.41Å; V438-N442 PolarHBondContact O-N 3.42Å; V438-N442 PolarHBondContact O-ND2 3.23Å; F439-N442 PolarHBondContact O-N 3.45Å; N442-F445 PolarHBondContact O-N 2.93Å; N442-A446 WeakPolarHBondContact O-CB 3.44Å; N442-A446 PolarHBondContact O-N 3.03Å
443M91.1Very high87.6Confident84 Ų8448.8 Ų48.841%0.41428%0.277SS..Hα-helixtrans-64-42.1177-79.3-61.9-162.900112.5V323 F439 L440 G447V323-M443 HydrophobicContact CG1-CE 3.48Å; V323-M443 VanDerWaalsContact CG1-CE 3.48Å; V323-M443 HydrophobicContact CG1-SD 4.05Å; F439-M443 HydrophobicContact CD1-CG 4.3Å; F439-M443 HydrophobicContact CE1-CE 4.27Å; F439-M443 HydrophobicContact CE1-CG 3.87Å; F439-M443 HydrophobicContact CE2-CE 3.83Å; F439-M443 HydrophobicContact CE2-CG 4.29Å; F439-M443 HydrophobicContact CZ-CE 3.43Å; F439-M443 VanDerWaalsContact CZ-CE 3.43Å; F439-M443 HydrophobicContact CZ-CG 3.87Å; F439-M443 WeakPolarHBondContact O-CB 3.35Å; F439-M443 PolarHBondContact O-N 2.64Å; L440-M443 PolarHBondContact O-N 2.75Å; M443-G447 PolarHBondContact O-N 3.31Å
444L93Very high88.4Confident82 Ų8249.3 Ų49.343%0.42928%0.278SS..Hα-helixtrans-63.1-44.7174.9-76.5170.8000111.1L207 L440 Y441 G447 L448L207-L444 HydrophobicContact CD1-CB 4.45Å; L207-L444 HydrophobicContact CD2-CB 4.32Å; L207-L444 HydrophobicContact CD2-CD1 4.41Å; L440-L444 HydrophobicContact CD1-CD1 4.2Å; L440-L444 HydrophobicContact CD1-CG 4.25Å; L440-L444 HydrophobicContact CD2-CD1 4.49Å; L440-L444 HydrophobicContact CG-CD1 3.91Å; L440-L444 HydrophobicContact CG-CG 4.37Å; L440-L444 WeakPolarHBondContact O-CB 3.3Å; L440-L444 VanDerWaalsContact O-CG 3.28Å; L440-L444 WeakPolarHBondContact O-CG 3.37Å; L440-L444 PolarHBondContact O-N 2.97Å; Y441-L444 PolarHBondContact O-N 3.26Å; L444-G447 PolarHBondContact O-N 2.85Å; L444-L448 WeakPolarHBondContact O-CB 3.35Å; L444-L448 VanDerWaalsContact O-CG 3.22Å; L444-L448 WeakPolarHBondContact O-CG 3.38Å; L444-L448 PolarHBondContact O-N 2.82Å
445F93.4Very high88.6Confident0 Ų053.6 Ų53.60%029%0.293CS..Hα-helixtrans-61.5-50.7177.7-178.3-96000111.5L207 T210 V319 L365 F411 L415 Y441 N442 G447 L448 T449L207-F445 HydrophobicContact CD1-CB 3.51Å; L207-F445 HydrophobicContact CD1-CD2 4.03Å; L207-F445 HydrophobicContact CD1-CG 4.27Å; T210-F445 VanDerWaalsContact OG1-CE2 3.31Å; T210-F445 WeakPolarHBondContact OG1-CE2 3.4Å; V319-F445 HydrophobicContact CB-CD1 4.44Å; V319-F445 HydrophobicContact CG1-CD1 4.17Å; V319-F445 HydrophobicContact CG2-CD1 3.88Å; V319-F445 HydrophobicContact CG2-CE1 3.84Å; L365-F445 HydrophobicContact CD2-CZ 4.17Å; F411-F445 HydrophobicContact CE2-CD2 4.18Å; F411-F445 HydrophobicContact CE2-CE2 4.14Å; F411-F445 HydrophobicContact CZ-CD2 4.16Å; F411-F445 AromaticContact CZ-CE2 3.65Å; F411-F445 HydrophobicContact CZ-CE2 3.65Å; F411-F445 HydrophobicContact CZ-CZ 4.24Å; L415-F445 HydrophobicContact CD1-CD1 4.02Å; L415-F445 HydrophobicContact CD1-CD2 4.23Å; L415-F445 HydrophobicContact CD1-CE1 3.76Å; L415-F445 HydrophobicContact CD1-CE2 3.98Å; L415-F445 HydrophobicContact CD1-CG 4.24Å; L415-F445 HydrophobicContact CD1-CZ 3.72Å; L415-F445 HydrophobicContact CD2-CB 3.83Å; L415-F445 HydrophobicContact CD2-CD1 3.58Å; L415-F445 HydrophobicContact CD2-CD2 4.23Å; L415-F445 HydrophobicContact CD2-CE1 4.17Å; L415-F445 HydrophobicContact CD2-CG 3.6Å; L415-F445 HydrophobicContact CG-CD1 4.48Å; Y441-F445 WeakPolarHBondContact O-CB 3.21Å; Y441-F445 PolarHBondContact O-N 3.43Å; N442-F445 PolarHBondContact O-N 2.93Å; F445-G447 PolarHBondContact O-N 3.43Å; F445-L448 PolarHBondContact O-N 2.95Å; F445-T449 HydrophobicContact CD1-CG2 4.12Å; F445-T449 HydrophobicContact CD2-CG2 4.17Å; F445-T449 HydrophobicContact CE1-CG2 3.75Å; F445-T449 HydrophobicContact CE2-CG2 3.79Å; F445-T449 HydrophobicContact CG-CG2 4.34Å; F445-T449 HydrophobicContact CZ-CG2 3.59Å; F445-T449 WeakPolarHBondContact O-CB 3.24Å; F445-T449 VanDerWaalsContact O-CG2 3.29Å; F445-T449 WeakPolarHBondContact O-CG2 3.34Å; F445-T449 PolarHBondContact O-N 2.99Å; F445-T449 PolarHBondContact O-OG1 3.34Å
446A92.4Very high88.4Confident10 Ų1052.2 Ų52.28%0.08329%0.289CS..Hα-helixtrans-59.4-46.1178.100000111.2V319 N442 T449 S450V319-A446 HydrophobicContact CG1-CB 4.16Å; N442-A446 WeakPolarHBondContact O-CB 3.44Å; N442-A446 PolarHBondContact O-N 3.03Å; A446-T449 WeakPolarHBondContact CA-OG1 3.26Å; A446-T449 PolarHBondContact O-N 2.72Å; A446-T449 PolarHBondContact O-OG1 3.33Å; A446-S450 VanDerWaalsContact O-CB 3.23Å; A446-S450 WeakPolarHBondContact O-CB 3.34Å; A446-S450 PolarHBondContact O-N 3.06Å; A446-S450 PolarHBondContact O-OG 3.33Å
447G92.1Very high87.9Confident42 Ų4246.7 Ų46.743%0.43327%0.273SS..Hα-helixtrans-60.9-48.4177.900000113.1M443 L444 F445 A451M443-G447 PolarHBondContact O-N 3.31Å; L444-G447 PolarHBondContact O-N 2.85Å; F445-G447 PolarHBondContact O-N 3.43Å; G447-A451 VanDerWaalsContact O-CB 3.22Å; G447-A451 WeakPolarHBondContact O-CB 3.15Å; G447-A451 PolarHBondContact O-N 3.42Å
448L92.1Very high87.6Confident72 Ų7248.4 Ų48.438%0.37728%0.284SS..Hα-helixtrans-65.9-43179.6-70.3173.5000112.1L208 P211 L444 F445 S452L208-L448 HydrophobicContact CD2-CD1 4.27Å; P211-L448 HydrophobicContact CB-CB 3.9Å; P211-L448 HydrophobicContact CG-CB 3.82Å; P211-L448 HydrophobicContact CG-CD1 4.25Å; L444-L448 WeakPolarHBondContact O-CB 3.35Å; L444-L448 VanDerWaalsContact O-CG 3.22Å; L444-L448 WeakPolarHBondContact O-CG 3.38Å; L444-L448 PolarHBondContact O-N 2.82Å; F445-L448 PolarHBondContact O-N 2.95Å; L448-S452 VanDerWaalsContact O-CB 3.32Å; L448-S452 WeakPolarHBondContact O-CB 3.28Å; L448-S452 PolarHBondContact O-N 3.42Å
449T90.4Very high86.9Confident3 Ų355.7 Ų55.72%0.01831%0.311CS..Hα-helixtrans-67.2-46178.7520000111.4P211 L214 F445 A446 A451 S452 L453P211-T449 HydrophobicContact CB-CG2 3.9Å; L214-T449 HydrophobicContact CD1-CG2 3.89Å; F445-T449 HydrophobicContact CD1-CG2 4.12Å; F445-T449 HydrophobicContact CD2-CG2 4.17Å; F445-T449 HydrophobicContact CE1-CG2 3.75Å; F445-T449 HydrophobicContact CE2-CG2 3.79Å; F445-T449 HydrophobicContact CG-CG2 4.34Å; F445-T449 HydrophobicContact CZ-CG2 3.59Å; F445-T449 WeakPolarHBondContact O-CB 3.24Å; F445-T449 VanDerWaalsContact O-CG2 3.29Å; F445-T449 WeakPolarHBondContact O-CG2 3.34Å; F445-T449 PolarHBondContact O-N 2.99Å; F445-T449 PolarHBondContact O-OG1 3.34Å; A446-T449 WeakPolarHBondContact CA-OG1 3.26Å; A446-T449 PolarHBondContact O-N 2.72Å; A446-T449 PolarHBondContact O-OG1 3.33Å; T449-A451 PolarHBondContact O-N 2.92Å; T449-S452 PolarHBondContact O-N 3.19Å; T449-S452 PolarHBondContact O-OG 3.27Å; T449-L453 WeakPolarHBondContact O-CB 3.14Å; T449-L453 PolarHBondContact O-N 3.41Å
450S89.8Confident86Confident53 Ų5354.8 Ų54.837%0.37131%0.314SS..Hα-helixtrans-60.7-43.4174.3-65.60000112.3A446 S452 L453 A454A446-S450 VanDerWaalsContact O-CB 3.23Å; A446-S450 WeakPolarHBondContact O-CB 3.34Å; A446-S450 PolarHBondContact O-N 3.06Å; A446-S450 PolarHBondContact O-OG 3.33Å; S450-S452 VanDerWaalsContact C-N 3.34Å; S450-S452 PolarHBondContact O-N 2.88Å; S450-L453 PolarHBondContact O-N 2.91Å; S450-A454 WeakPolarHBondContact O-CB 3.43Å; S450-A454 PolarHBondContact O-N 2.92Å
451A89.7Confident84.8Confident61 Ų6153.6 Ų53.650%0.50431%0.31SS..Hα-helixtrans-63.5-40.5176.100000111.9G447 T449 L453 K455G447-A451 VanDerWaalsContact O-CB 3.22Å; G447-A451 WeakPolarHBondContact O-CB 3.15Å; G447-A451 PolarHBondContact O-N 3.42Å; T449-A451 PolarHBondContact O-N 2.92Å; A451-L453 VanDerWaalsContact C-N 3.33Å; A451-L453 PolarHBondContact O-N 3.34Å; A451-K455 WeakPolarHBondContact O-CB 3.4Å; A451-K455 PolarHBondContact O-N 3.15Å
452S86.4Confident83.7Confident20 Ų2060.9 Ų60.914%0.1434%0.338CS..Hα-helixtrans-63.9-39176.381.70000112.1L448 T449 S450 T456L448-S452 VanDerWaalsContact O-CB 3.32Å; L448-S452 WeakPolarHBondContact O-CB 3.28Å; L448-S452 PolarHBondContact O-N 3.42Å; T449-S452 PolarHBondContact O-N 3.19Å; T449-S452 PolarHBondContact O-OG 3.27Å; S450-S452 VanDerWaalsContact C-N 3.34Å; S450-S452 PolarHBondContact O-N 2.88Å; S452-T456 WeakPolarHBondContact O-CB 3.28Å; S452-T456 PolarHBondContact O-N 2.86Å; S452-T456 VanDerWaalsContact O-N 3.11Å; S452-T456 PolarHBondContact O-OG1 2.91Å
453L86.1Confident82.6Confident31 Ų3164.9 Ų64.916%0.16235%0.353CS..Hα-helixtrans-69.2-49.1177.9-175.466.8000110.6F218 L309 V313 T449 S450 A451 K455 T456 V457F218-L453 HydrophobicContact CE2-CD1 4.04Å; F218-L453 HydrophobicContact CZ-CD1 4.04Å; L309-L453 HydrophobicContact CD1-CD1 3.72Å; V313-L453 HydrophobicContact CG2-CD2 4.07Å; T449-L453 WeakPolarHBondContact O-CB 3.14Å; T449-L453 PolarHBondContact O-N 3.41Å; S450-L453 PolarHBondContact O-N 2.91Å; A451-L453 VanDerWaalsContact C-N 3.33Å; A451-L453 PolarHBondContact O-N 3.34Å; L453-K455 VanDerWaalsContact C-N 3.35Å; L453-K455 PolarHBondContact O-N 2.84Å; L453-T456 PolarHBondContact O-N 3.01Å; L453-T456 VanDerWaalsContact O-N 3.12Å; L453-V457 HydrophobicContact CD1-CG2 4Å; L453-V457 HydrophobicContact CG-CG2 4.2Å; L453-V457 WeakPolarHBondContact O-CB 3.36Å; L453-V457 WeakPolarHBondContact O-CG2 3.35Å; L453-V457 PolarHBondContact O-N 3.02Å
454A85.8Confident81.4Confident51 Ų5165.4 Ų65.442%0.42135%0.354SS..Hα-helixtrans-55.6-49.9176.700000110.8S450 T456 V457 T458S450-A454 WeakPolarHBondContact O-CB 3.43Å; S450-A454 PolarHBondContact O-N 2.92Å; A454-T456 VanDerWaalsContact C-N 3.29Å; A454-T456 PolarHBondContact O-N 3.38Å; A454-V457 PolarHBondContact O-N 2.96Å; A454-T458 WeakPolarHBondContact O-CB 3.45Å; A454-T458 PolarHBondContact O-N 2.92Å; A454-T458 PolarHBondContact O-OG1 3.47Å
455K83.9Confident80Confident159 Ų15965.8 Ų65.869%0.69136%0.356SS*.Hα-helixtrans-56.5-43.2177-174.8178.5-179.9178.80112.4A451 L453 W459A451-K455 WeakPolarHBondContact O-CB 3.4Å; A451-K455 PolarHBondContact O-N 3.15Å; L453-K455 VanDerWaalsContact C-N 3.35Å; L453-K455 PolarHBondContact O-N 2.84Å; K455-W459 WeakPolarHBondContact O-CB 3.24Å; K455-W459 PolarHBondContact O-N 2.83Å
456T78.6Confident78.8Confident22 Ų2268.5 Ų68.514%0.13537%0.37CS..Hα-helixtrans-70.4-48.1-177.3-55.90000111.7S215 F218 S452 L453 A454 A460S215-T456 PolarHBondContact OG-OG1 2.84Å; F218-T456 HydrophobicContact CB-CG2 3.49Å; F218-T456 VanDerWaalsContact CB-CG2 3.49Å; F218-T456 HydrophobicContact CD1-CG2 4.33Å; F218-T456 HydrophobicContact CD2-CG2 3.97Å; F218-T456 HydrophobicContact CG-CG2 3.71Å; S452-T456 WeakPolarHBondContact O-CB 3.28Å; S452-T456 PolarHBondContact O-N 2.86Å; S452-T456 VanDerWaalsContact O-N 3.11Å; S452-T456 PolarHBondContact O-OG1 2.91Å; L453-T456 PolarHBondContact O-N 3.01Å; L453-T456 VanDerWaalsContact O-N 3.12Å; A454-T456 VanDerWaalsContact C-N 3.29Å; A454-T456 PolarHBondContact O-N 3.38Å; T456-A460 WeakPolarHBondContact O-CB 3.48Å; T456-A460 PolarHBondContact O-N 3.08Å
457V75Confident77.3Confident59 Ų5971.7 Ų71.736%0.35838%0.38SS..Hα-helixtrans-67.1-48.4179.5174.20000110.5L309 L453 A454 W459 A460 V461L309-V457 HydrophobicContact CD1-CG2 4.38Å; L453-V457 HydrophobicContact CD1-CG2 4Å; L453-V457 HydrophobicContact CG-CG2 4.2Å; L453-V457 WeakPolarHBondContact O-CB 3.36Å; L453-V457 WeakPolarHBondContact O-CG2 3.35Å; L453-V457 PolarHBondContact O-N 3.02Å; A454-V457 PolarHBondContact O-N 2.96Å; V457-W459 VanDerWaalsContact C-N 3.3Å; V457-W459 PolarHBondContact O-N 3.33Å; V457-A460 PolarHBondContact O-N 3.25Å; V457-V461 HydrophobicContact CG1-CG2 4.15Å; V457-V461 WeakPolarHBondContact O-CB 3.32Å; V457-V461 VanDerWaalsContact O-CG2 3.29Å; V457-V461 WeakPolarHBondContact O-CG2 3.3Å; V457-V461 PolarHBondContact O-N 3.14Å
458T76Confident75.9Confident91 Ų9173.9 Ų73.956%0.55839%0.394SS*.Hα-helixtrans-60.4-40178.1-56.40000111.4A454 R462A454-T458 WeakPolarHBondContact O-CB 3.45Å; A454-T458 PolarHBondContact O-N 2.92Å; A454-T458 PolarHBondContact O-OG1 3.47Å; T458-R462 WeakPolarHBondContact O-CB 3.14Å; T458-R462 PolarHBondContact O-N 3.2Å
459W71.1Confident74.7Confident156 Ų15677.7 Ų77.759%0.59141%0.408SS*.Hα-helixtrans-68-41.3176.3-170.881000112.5K455 V457 R463K455-W459 WeakPolarHBondContact O-CB 3.24Å; K455-W459 PolarHBondContact O-N 2.83Å; V457-W459 VanDerWaalsContact C-N 3.3Å; V457-W459 PolarHBondContact O-N 3.33Å; W459-R463 VanDerWaalsContact O-CB 3.28Å; W459-R463 WeakPolarHBondContact O-CB 3.36Å; W459-R463 PolarHBondContact O-N 3.5Å
460A67.8Low73.2Confident36 Ų3679.1 Ų79.130%0.29842%0.424SS..Hα-helixtrans-62.9-48.3176.100000111.8T456 V457 R463 E464T456-A460 WeakPolarHBondContact O-CB 3.48Å; T456-A460 PolarHBondContact O-N 3.08Å; V457-A460 PolarHBondContact O-N 3.25Å; A460-R463 PolarHBondContact O-N 3.47Å; A460-E464 PolarHBondContact O-N 3.03Å
461V66.4Low71.5Confident79 Ų7980.5 Ų80.548%0.47943%0.426SS..Hα-helixtrans-63.8-45.8178.1172.60000111V457 R463 E464 L465V457-V461 HydrophobicContact CG1-CG2 4.15Å; V457-V461 WeakPolarHBondContact O-CB 3.32Å; V457-V461 VanDerWaalsContact O-CG2 3.29Å; V457-V461 WeakPolarHBondContact O-CG2 3.3Å; V457-V461 PolarHBondContact O-N 3.14Å; V461-R463 VanDerWaalsContact C-N 3.29Å; V461-R463 PolarHBondContact O-N 3.38Å; V461-E464 PolarHBondContact O-N 2.93Å; V461-L465 HydrophobicContact CG1-CD1 3.75Å; V461-L465 HydrophobicContact CG1-CG 4.5Å; V461-L465 WeakPolarHBondContact O-CB 3.32Å; V461-L465 WeakPolarHBondContact O-CG 3.12Å; V461-L465 PolarHBondContact O-N 3.04Å
462R65.6Low70Confident168 Ų16882.4 Ų82.463%0.63443%0.428SS*.Hα-helixtrans-58.3-42175.8-178.6177.5178.3-175.80.2111.6T458 L465 I466T458-R462 WeakPolarHBondContact O-CB 3.14Å; T458-R462 PolarHBondContact O-N 3.2Å; R462-L465 PolarHBondContact O-N 2.93Å; R462-I466 HydrophobicContact CG-CD1 3.84Å; R462-I466 WeakPolarHBondContact O-CD1 3.48Å; R462-I466 WeakPolarHBondContact O-CG1 3.01Å; R462-I466 PolarHBondContact O-N 3.35Å
463R66.9Low68.2Low83 Ų8391.8 Ų91.831%0.31346%0.46SS..Hα-helixtrans-66.6-43.1179.7-176.5178-179.6176.83.3112.3K227 W459 A460 V461 I466 R467K227-R463 VanDerWaalsContact NZ-NH1 3.18Å; W459-R463 VanDerWaalsContact O-CB 3.28Å; W459-R463 WeakPolarHBondContact O-CB 3.36Å; W459-R463 PolarHBondContact O-N 3.5Å; A460-R463 PolarHBondContact O-N 3.47Å; V461-R463 VanDerWaalsContact C-N 3.29Å; V461-R463 PolarHBondContact O-N 3.38Å; R463-I466 PolarHBondContact O-N 3.47Å; R463-R467 WeakPolarHBondContact O-CG 3.36Å; R463-R467 PolarHBondContact O-N 3.25Å; R463-R467 VanDerWaalsContact O-N 3.13Å
464E66.9Low66.2Low96 Ų9695.4 Ų95.445%0.44948%0.479SS..Hα-helixtrans-72.3-32.1177.6-63.2-54.9156.300111.9A460 V461 R467 A468A460-E464 PolarHBondContact O-N 3.03Å; V461-E464 PolarHBondContact O-N 2.93Å; E464-R467 PolarHBondContact O-N 3.31Å; E464-R467 IonicContact OE1-NH1 3.29Å; E464-R467 PolarHBondContact OE1-NH1 3.47Å; E464-R467 WeakPolarHBondContact OE2-CD 3.48Å; E464-R467 IonicContact OE2-NH1 2.75Å; E464-A468 VanDerWaalsContact O-CB 3.27Å; E464-A468 WeakPolarHBondContact O-CB 3.43Å; E464-A468 PolarHBondContact O-N 3.06Å
465L64.3Low64.1Low89 Ų8999 Ų9947%0.46650%0.498SS..Hα-helixtrans-61.4-49.2169.2-83.7160.5000111.8V461 R462 R467 A468 F469V461-L465 HydrophobicContact CG1-CD1 3.75Å; V461-L465 HydrophobicContact CG1-CG 4.5Å; V461-L465 WeakPolarHBondContact O-CB 3.32Å; V461-L465 WeakPolarHBondContact O-CG 3.12Å; V461-L465 PolarHBondContact O-N 3.04Å; R462-L465 PolarHBondContact O-N 2.93Å; L465-R467 PolarHBondContact O-N 3.23Å; L465-A468 PolarHBondContact O-N 3.44Å; L465-F469 HydrophobicContact CD2-CD2 4.28Å; L465-F469 HydrophobicContact CD2-CE2 3.76Å; L465-F469 WeakPolarHBondContact O-CB 3.41Å; L465-F469 WeakPolarHBondContact O-CD2 3.26Å; L465-F469 PolarHBondContact O-N 3.02Å
466I67.7Low62Low58 Ų5896.4 Ų96.430%0.29749%0.491SS..Hα-helixtrans-58.3-38.9178.5-70.1164.6000111.3R462 R463 G470 L471 D472R462-I466 HydrophobicContact CG-CD1 3.84Å; R462-I466 WeakPolarHBondContact O-CD1 3.48Å; R462-I466 WeakPolarHBondContact O-CG1 3.01Å; R462-I466 PolarHBondContact O-N 3.35Å; R463-I466 PolarHBondContact O-N 3.47Å; I466-G470 PolarHBondContact O-N 3.23Å; I466-L471 HydrophobicContact CG2-CB 4.09Å; I466-L471 PolarHBondContact O-N 3.47Å; I466-D472 WeakPolarHBondContact CG2-OD1 3.47Å
467R61.5Low59.9Low77 Ų77100.9 Ų100.929%0.29152%0.52SS..Hα-helixtrans-68.2-45.6174.8-78.1168.9171.8-164.5-14.9113.1R463 E464 L465 F469 G470 D472R463-R467 WeakPolarHBondContact O-CG 3.36Å; R463-R467 PolarHBondContact O-N 3.25Å; R463-R467 VanDerWaalsContact O-N 3.13Å; E464-R467 PolarHBondContact O-N 3.31Å; E464-R467 IonicContact OE1-NH1 3.29Å; E464-R467 PolarHBondContact OE1-NH1 3.47Å; E464-R467 WeakPolarHBondContact OE2-CD 3.48Å; E464-R467 IonicContact OE2-NH1 2.75Å; L465-R467 PolarHBondContact O-N 3.23Å; R467-F469 VanDerWaalsContact C-N 3.29Å; R467-F469 PolarHBondContact O-N 3.32Å; R467-G470 PolarHBondContact O-N 3.39Å; R467-D472 WeakPolarHBondContact CG-OD2 3.43Å; R467-D472 IonicContact NE-OD2 2.73Å
468A61.1Low57.9Low87 Ų87104.4 Ų104.472%0.71954%0.542SS*.Hα-helixtrans-63.9-35.8178.900000111.9E464 L465 G470E464-A468 VanDerWaalsContact O-CB 3.27Å; E464-A468 WeakPolarHBondContact O-CB 3.43Å; E464-A468 PolarHBondContact O-N 3.06Å; L465-A468 PolarHBondContact O-N 3.44Å; A468-G470 PolarHBondContact O-N 3.22Å
469F68.1Low55.6Low152 Ų152103.9 Ų103.967%0.66754%0.542SS*.THydrogen-bonded Turntrans-77.4-1.3173.7-80-71.3000113.8L465 R467 L471L465-F469 HydrophobicContact CD2-CD2 4.28Å; L465-F469 HydrophobicContact CD2-CE2 3.76Å; L465-F469 WeakPolarHBondContact O-CB 3.41Å; L465-F469 WeakPolarHBondContact O-CD2 3.26Å; L465-F469 PolarHBondContact O-N 3.02Å; R467-F469 VanDerWaalsContact C-N 3.29Å; R467-F469 PolarHBondContact O-N 3.32Å; F469-L471 HydrophobicContact CB-CD1 3.64Å; F469-L471 PolarHBondContact O-N 3.08Å; F469-L471 VanDerWaalsContact O-N 3.15Å
470G57.7Low53.7Low34 Ų34102.3 Ų102.335%0.35155%0.551SS.*THydrogen-bonded Turntrans6712.3177.100000114.7I466 R467 A468 D472 R473I466-G470 PolarHBondContact O-N 3.23Å; R467-G470 PolarHBondContact O-N 3.39Å; A468-G470 PolarHBondContact O-N 3.22Å; G470-D472 PolarHBondContact O-N 3.46Å; G470-R473 PolarHBondContact O-N 3.42Å
471L54.8Low52.1Low81 Ų81104.6 Ų104.642%0.42457%0.565SS.*G310 helixtrans-64.8-20.8179.1-94.690.4000112.7I466 F469 R473 L474I466-L471 HydrophobicContact CG2-CB 4.09Å; I466-L471 PolarHBondContact O-N 3.47Å; F469-L471 HydrophobicContact CB-CD1 3.64Å; F469-L471 PolarHBondContact O-N 3.08Å; F469-L471 VanDerWaalsContact O-N 3.15Å; L471-R473 PolarHBondContact O-N 3.12Å; L471-L474 HydrophobicContact CG-CD1 4.15Å; L471-L474 PolarHBondContact O-N 3.49Å
472D57.6Low50.6Low102 Ų102107.4 Ų107.455%0.54558%0.583SS.*G310 helixtrans-64.6-16.5172.3-78.9-4.4000112.8I466 R467 G470I466-D472 WeakPolarHBondContact CG2-OD1 3.47Å; R467-D472 WeakPolarHBondContact CG-OD2 3.43Å; R467-D472 IonicContact NE-OD2 2.73Å; G470-D472 PolarHBondContact O-N 3.46Å
473R50.4Low49Very low216 Ų216104.4 Ų104.482%0.81558%0.578SS**G310 helixtrans-95.6-5.8178.2-65.6-166.3179.5-171.31.3114.1G470 L471G470-R473 PolarHBondContact O-N 3.42Å; L471-R473 PolarHBondContact O-N 3.12Å
474L43.1Very low47.5Very low108 Ų108105.1 Ų105.157%0.56559%0.594SS**SBendtrans-80.8130.7174.2-76159000108.8L471 I476L471-L474 HydrophobicContact CG-CD1 4.15Å; L471-L474 PolarHBondContact O-N 3.49Å; L474-I476 HydrophobicContact CB-CD1 4.48Å; L474-I476 HydrophobicContact CB-CG1 3.97Å; L474-I476 PolarHBondContact O-N 2.98Å
475P42.3Very low45.9Very low125 Ų125109.2 Ų109.281%0.81261%0.61SS**  trans-71.575.7169.930.9-32.3000108P477P475-P477 WeakPolarHBondContact O-CD 3.4Å
476I39.3Very low44.4Very low105 Ų105114.2 Ų114.254%0.53863%0.628SS.*  trans-75.1120.6170.3-55.4172.4000105.3L474 V478L474-I476 HydrophobicContact CB-CD1 4.48Å; L474-I476 HydrophobicContact CB-CG1 3.97Å; L474-I476 PolarHBondContact O-N 2.98Å; I476-V478 PolarHBondContact O-N 2.73Å
477P34.3Very low42.7Very low116 Ų116117.5 Ų117.575%0.75365%0.646SS**  trans-61.4105.7169.325.9-30.9000106.5P475 S479P475-P477 WeakPolarHBondContact O-CD 3.4Å; P477-S479 PolarHBondContact O-N 3.28Å
478V32.9Very low41.3Very low134 Ų134119.8 Ų119.881%0.81266%0.663SS**  trans-61.2109.5174.6-179.30000106.3I476I476-V478 PolarHBondContact O-N 2.73Å
479S27.3Very low40.1Very low80 Ų80122.9 Ų122.956%0.55967%0.667SS**  trans-59.6134.9168.562.60000108.1P477 S481P477-S479 PolarHBondContact O-N 3.28Å; S479-S481 PolarHBondContact O-N 3.5Å; S479-S481 PolarHBondContact OG-OG 3.21Å
480P31.6Very low38.5Very low122 Ų122119.8 Ų119.879%0.79267%0.67SS**SBendtrans-75.777.9-177.831.8-33.3000109.1
481S34.7Very low37.2Very low84 Ų84122.6 Ų122.659%0.58768%0.684SS**  trans-143.460.6175.163.90000109.7S479S479-S481 PolarHBondContact O-N 3.5Å; S479-S481 PolarHBondContact OG-OG 3.21Å
482T35.3Very low36Very low139 Ų139122 Ų12285%0.85370%0.697SS**  trans166.571.7142.538.90000107.9P484T482-P484 WeakPolarHBondContact O-CD 3.49Å
483I32Very low34.6Very low105 Ų105125.4 Ų125.454%0.53871%0.714SS.*  trans-74.3120.5159-62.6169.6000105.3F485I483-F485 PolarHBondContact O-N 2.88Å
484P34.2Very low33.6Very low97 Ų97120.6 Ų120.663%0.6371%0.714SS**  trans-60.8125.5169.624.5-30.1000107.8T482 K486 L487T482-P484 WeakPolarHBondContact O-CD 3.49Å; P484-K486 PolarHBondContact O-N 2.99Å; P484-L487 PolarHBondContact O-N 3.44Å
485F32.9Very low33.1Very low182 Ų182124.5 Ų124.580%0.79873%0.726SS**THydrogen-bonded Turntrans-531.6-174.2-136.9-96000116I483I483-F485 PolarHBondContact O-N 2.88Å
486K34.4Very low32.6Very low194 Ų194126.2 Ų126.284%0.84373%0.727SS**THydrogen-bonded Turntrans-88.8-10.8179-92.1-173.8171.7-177.90115.4P484P484-K486 PolarHBondContact O-N 2.99Å
487L30.5Very low32.1Very low127 Ų127133.6 Ų133.667%0.66576%0.759SS**SBendtrans-103.9-11-179.3-120.8130.7000114.3P484P484-L487 PolarHBondContact O-N 3.44Å
488L32.8Very low32Very low125 Ų125134.5 Ų134.565%0.65476%0.759SS**SBendtrans-85.9-12.3177.4-121.3145.8000113.3
489L35Very low32Very low152 Ų152134.5 Ų134.580%0.79676%0.756SS**SBendtrans-95.4-8.5177.6-110.3153.9000113.5
490A34.3Very low32.3Very low88 Ų88137.5 Ų137.573%0.72777%0.767SS**SBendtrans-105.4-0.4-17500000114.2
491S30.9Very low32.3Very low93 Ų93138.4 Ų138.465%0.6577%0.766SS**SBendtrans-129.889.5179.860.70000111.5
492G29.5Very low32.1Very low68 Ų68141.8 Ų141.870%0.70178%0.777SS**  trans108.3101.4152.600000116.1
493L28.9Very low31.9Very low174 Ų174142 Ų14291%0.91177%0.772SS**  178.789.9105.2-92.1158.9000110
494S29.8Very low31.9Very low115 Ų115144.6 Ų144.680%0.80479%0.789SS**SBendtrans-99.8122.6149.359.60000107.9
495K31.6Very low31.8Very low190 Ų190148.3 Ų148.383%0.82680%0.801SS**  trans65.2114.7165.9-69.7178.3170.31780118
496I33Very low31.7Very low160 Ų160145.5 Ų145.582%0.82180%0.801SS**  178.2105.998.9-77.4149.9000106.9
497Q29.2Very low31.4Very low260 Ų260141.1 Ų141.1100%1.21580%0.797SS**  175.90111-162.2159.5-2500109.7

Retrieved 497 of 497 residues in 254.2 ms (Link to these results)

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