A0A077ZAP9_TRITR Loading...

WAPL domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZAP9, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 359 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
1M90.3Very high93.2Very high100 Ų10058.2 Ų58.249%0.49330%0.296SS..  0-58.50-178.1-80.9-146.900110.9Q3 R4 C5 I23 L43M1-Q3 VanDerWaalsContact C-N 3.28Å; M1-Q3 PolarHBondContact O-N 3.08Å; M1-Q3 VanDerWaalsContact O-N 3.16Å; M1-R4 WeakPolarHBondContact O-CB 3.26Å; M1-R4 PolarHBondContact O-N 2.84Å; M1-C5 PolarHBondContact O-N 3.3Å; M1-I23 HydrophobicContact CE-CB 4.46Å; M1-I23 HydrophobicContact CE-CD1 3.59Å; M1-I23 HydrophobicContact CE-CG1 4.37Å; M1-I23 HydrophobicContact CE-CG2 3.55Å; M1-L43 HydrophobicContact CE-CD1 3.66Å; M1-L43 HydrophobicContact CE-CD2 3.59Å; M1-L43 HydrophobicContact CE-CG 4.28Å; M1-L43 HydrophobicContact SD-CD1 3.95Å; M1-L43 HydrophobicContact SD-CD2 3.53Å; M1-L43 VanDerWaalsContact SD-CD2 3.53Å; M1-L43 HydrophobicContact SD-CG 4.29Å
2L91.9Very high93.1Very high19 Ų1960.5 Ų60.510%0.09932%0.315CS..G310 helixtrans-43.7-47.1175.3-90165.3000114.6R4 C5 C39 C42 L43 I46 I89L2-R4 PolarHBondContact O-N 3.44Å; L2-R4 VanDerWaalsContact O-N 3.16Å; L2-C5 WeakPolarHBondContact O-CA 3.44Å; L2-C5 VanDerWaalsContact O-CB 3.24Å; L2-C5 WeakPolarHBondContact O-CB 3.46Å; L2-C5 PolarHBondContact O-N 3.26Å; L2-C39 HydrophobicContact CD1-CB 3.8Å; L2-C42 HydrophobicContact CD1-CB 4.43Å; L2-C42 HydrophobicContact CD2-CB 4.04Å; L2-L43 HydrophobicContact CD2-CB 4.43Å; L2-L43 HydrophobicContact CD2-CD2 3.67Å; L2-L43 HydrophobicContact CD2-CG 3.58Å; L2-L43 HydrophobicContact CG-CD2 4.18Å; L2-L43 HydrophobicContact CG-CG 3.99Å; L2-I46 HydrophobicContact CD2-CD1 4.22Å; L2-I89 HydrophobicContact CB-CD1 4.07Å
3Q94.3Very high93.2Very high93 Ų9362.2 Ų62.244%0.43532%0.318SS..G310 helixtrans-53.7-36.6176.9-170.266.142.800113.4M1 C5 V6 E92M1-Q3 VanDerWaalsContact C-N 3.28Å; M1-Q3 PolarHBondContact O-N 3.08Å; M1-Q3 VanDerWaalsContact O-N 3.16Å; Q3-C5 VanDerWaalsContact C-N 3.32Å; Q3-V6 VanDerWaalsContact O-CB 3.32Å; Q3-V6 WeakPolarHBondContact O-CB 3.47Å; Q3-V6 WeakPolarHBondContact O-CG2 3.43Å; Q3-V6 PolarHBondContact O-N 3.29Å; Q3-E92 PolarHBondContact NE2-OE2 2.95Å
4R95.5Very high93.3Very high165 Ų16558.4 Ų58.462%0.62330%0.299SS*.G310 helixtrans-75.4-24.1177-57.7-167.985.7-179.27.1112.1M1 L2 V6 D7 F10M1-R4 WeakPolarHBondContact O-CB 3.26Å; M1-R4 PolarHBondContact O-N 2.84Å; L2-R4 PolarHBondContact O-N 3.44Å; L2-R4 VanDerWaalsContact O-N 3.16Å; R4-V6 PolarHBondContact O-N 3.31Å; R4-D7 PolarHBondContact O-N 3.37Å; R4-F10 VanDerWaalsContact C-CD1 3.49Å; R4-F10 HydrophobicContact CB-CD1 3.65Å; R4-F10 HydrophobicContact CB-CE1 3.58Å; R4-F10 HydrophobicContact CB-CG 4.15Å; R4-F10 HydrophobicContact CB-CZ 4.06Å; R4-F10 WeakPolarHBondContact O-CB 3.33Å; R4-F10 VanDerWaalsContact O-CD1 3.27Å; R4-F10 WeakPolarHBondContact O-CD1 3.46Å
5C94.2Very high93.1Very high0 Ų057.3 Ų57.30%029%0.291CS..G310 helixtrans-70.2-8.7175.2-61.30000112.8M1 L2 Q3 D7 R11 L43 I46 F47M1-C5 PolarHBondContact O-N 3.3Å; L2-C5 WeakPolarHBondContact O-CA 3.44Å; L2-C5 VanDerWaalsContact O-CB 3.24Å; L2-C5 WeakPolarHBondContact O-CB 3.46Å; L2-C5 PolarHBondContact O-N 3.26Å; Q3-C5 VanDerWaalsContact C-N 3.32Å; C5-D7 PolarHBondContact O-N 3.46Å; C5-R11 HydrophobicContact CB-CG 4.28Å; C5-R11 WeakPolarHBondContact O-CD 3.27Å; C5-R11 WeakPolarHBondContact O-CG 3.24Å; C5-R11 PolarHBondContact O-NH1 2.98Å; C5-L43 HydrophobicContact CB-CD2 4.47Å; C5-I46 HydrophobicContact CB-CG2 4.43Å; C5-F47 HydrophobicContact CB-CE2 4.22Å
6V93.1Very high92.9Very high3 Ų358.9 Ų58.92%0.01832%0.316CS..G310 helixtrans-58.7-37.2167.91700000110.7Q3 R4 R11 I89 E92 W93 K96Q3-V6 VanDerWaalsContact O-CB 3.32Å; Q3-V6 WeakPolarHBondContact O-CB 3.47Å; Q3-V6 WeakPolarHBondContact O-CG2 3.43Å; Q3-V6 PolarHBondContact O-N 3.29Å; R4-V6 PolarHBondContact O-N 3.31Å; V6-R11 PolarHBondContact O-NH1 3.3Å; V6-I89 HydrophobicContact CG2-CG2 3.93Å; V6-E92 HydrophobicContact CG1-CB 4.27Å; V6-E92 HydrophobicContact CG2-CB 4.49Å; V6-W93 HydrophobicContact CG2-CB 4.26Å; V6-K96 HydrophobicContact CG1-CD 3.71Å; V6-K96 HydrophobicContact CG1-CG 4.36Å
7D93Very high92.8Very high66 Ų6664.8 Ų64.835%0.35333%0.332SS..SBendtrans-78.5125.8178.3-70.6-58.6000113R4 C5 S9 F10 R11 K96R4-D7 PolarHBondContact O-N 3.37Å; C5-D7 PolarHBondContact O-N 3.46Å; D7-S9 PolarHBondContact O-N 2.99Å; D7-F10 HydrophobicContact CB-CB 4.16Å; D7-F10 PolarHBondContact O-N 3.33Å; D7-R11 PolarHBondContact O-N 2.98Å; D7-K96 IonicContact OD1-NZ 2.68Å; D7-K96 PolarHBondContact OD1-NZ 3.19Å; D7-K96 IonicContact OD2-NZ 2.64Å
8S91.8Very high92.6Very high61 Ų6170.6 Ų70.643%0.42735%0.349SS..Hα-helixtrans-62.9-39.7179.7590000112.5F10 R11 V12S8-F10 VanDerWaalsContact C-N 3.29Å; S8-F10 PolarHBondContact O-N 2.92Å; S8-R11 PolarHBondContact O-N 3.22Å; S8-V12 WeakPolarHBondContact O-CG2 3.46Å; S8-V12 PolarHBondContact O-N 3.44Å
9S92.2Very high92.6Very high87 Ų8770.8 Ų70.861%0.60835%0.348SS*.Hα-helixtrans-59.8-39.3177.2570000112.1D7 V12 F13D7-S9 PolarHBondContact O-N 2.99Å; S9-V12 PolarHBondContact O-N 3.49Å; S9-F13 WeakPolarHBondContact O-CB 3.4Å; S9-F13 PolarHBondContact O-N 2.96Å
10F95Very high92.6Very high41 Ų4167.5 Ų67.518%0.1833%0.332CS..Hα-helixtrans-68.4-41.5176.8-173.6-107.4000111.8R4 D7 S8 F13 L14R4-F10 VanDerWaalsContact C-CD1 3.49Å; R4-F10 HydrophobicContact CB-CD1 3.65Å; R4-F10 HydrophobicContact CB-CE1 3.58Å; R4-F10 HydrophobicContact CB-CG 4.15Å; R4-F10 HydrophobicContact CB-CZ 4.06Å; R4-F10 WeakPolarHBondContact O-CB 3.33Å; R4-F10 VanDerWaalsContact O-CD1 3.27Å; R4-F10 WeakPolarHBondContact O-CD1 3.46Å; D7-F10 HydrophobicContact CB-CB 4.16Å; D7-F10 PolarHBondContact O-N 3.33Å; S8-F10 VanDerWaalsContact C-N 3.29Å; S8-F10 PolarHBondContact O-N 2.92Å; F10-F13 WeakPolarHBondContact O-CB 3.29Å; F10-F13 PolarHBondContact O-N 3.19Å; F10-L14 HydrophobicContact CD1-CD1 3.93Å; F10-L14 HydrophobicContact CD1-CG 4.41Å; F10-L14 HydrophobicContact CE1-CD1 3.46Å; F10-L14 VanDerWaalsContact CE1-CD1 3.46Å; F10-L14 HydrophobicContact CE1-CG 4.07Å; F10-L14 HydrophobicContact CZ-CD1 3.97Å; F10-L14 HydrophobicContact CZ-CD2 4.28Å; F10-L14 HydrophobicContact CZ-CG 4.19Å; F10-L14 WeakPolarHBondContact O-CG 3.46Å; F10-L14 PolarHBondContact O-N 2.95Å
11R94.3Very high92.5Very high5 Ų565.7 Ų65.72%0.01932%0.324CS..Hα-helixtrans-62.8-42.5174.4-63.1-164.8-59.1-85.47.7112.1C5 V6 D7 S8 F13 L14 K15 F47 D50C5-R11 HydrophobicContact CB-CG 4.28Å; C5-R11 WeakPolarHBondContact O-CD 3.27Å; C5-R11 WeakPolarHBondContact O-CG 3.24Å; C5-R11 PolarHBondContact O-NH1 2.98Å; V6-R11 PolarHBondContact O-NH1 3.3Å; D7-R11 PolarHBondContact O-N 2.98Å; S8-R11 PolarHBondContact O-N 3.22Å; R11-F13 VanDerWaalsContact C-N 3.34Å; R11-L14 PolarHBondContact O-N 3.4Å; R11-K15 WeakPolarHBondContact O-CG 3.38Å; R11-K15 PolarHBondContact O-N 3.43Å; R11-F47 HydrophobicContact CB-CE1 3.93Å; R11-F47 HydrophobicContact CB-CZ 4.04Å; R11-F47 HydrophobicContact CG-CE1 4.2Å; R11-F47 HydrophobicContact CG-CE2 4.23Å; R11-F47 HydrophobicContact CG-CZ 3.86Å; R11-D50 IonicContact CZ-OD1 3.5Å; R11-D50 VanDerWaalsContact CZ-OD1 3.23Å; R11-D50 VanDerWaalsContact NE-CG 3.31Å; R11-D50 IonicContact NE-OD1 2.9Å; R11-D50 PolarHBondContact NE-OD1 3.44Å; R11-D50 IonicContact NE-OD2 3.93Å; R11-D50 PolarHBondContact NE-OD2 3.04Å; R11-D50 IonicContact NH2-OD1 3.06Å; R11-D50 PolarHBondContact NH2-OD1 3.4Å
12V91.9Very high92.6Very high86 Ų8667.5 Ų67.552%0.52133%0.329SS..Hα-helixtrans-60.7-44.8175.2170.90000110.6S8 S9 L14 K15 A16S8-V12 WeakPolarHBondContact O-CG2 3.46Å; S8-V12 PolarHBondContact O-N 3.44Å; S9-V12 PolarHBondContact O-N 3.49Å; V12-L14 PolarHBondContact O-N 3.2Å; V12-K15 PolarHBondContact O-N 3.39Å; V12-A16 VanDerWaalsContact O-CB 3.26Å; V12-A16 WeakPolarHBondContact O-CB 3.35Å; V12-A16 PolarHBondContact O-N 2.93Å
13F94.1Very high92.7Very high82 Ų8268.6 Ų68.636%0.3633%0.334SS..Hα-helixtrans-57.3-46.8175.2169.3-94.7000112.4S9 F10 R11 K15 R17 F19S9-F13 WeakPolarHBondContact O-CB 3.4Å; S9-F13 PolarHBondContact O-N 2.96Å; F10-F13 WeakPolarHBondContact O-CB 3.29Å; F10-F13 PolarHBondContact O-N 3.19Å; R11-F13 VanDerWaalsContact C-N 3.34Å; F13-K15 PolarHBondContact O-N 3.47Å; F13-R17 PolarHBondContact O-N 3.4Å; F13-F19 AromaticContact CE1-CD2 3.94Å; F13-F19 HydrophobicContact CE1-CD2 3.94Å; F13-F19 HydrophobicContact CE1-CE2 4.05Å; F13-F19 HydrophobicContact CZ-CD2 4.26Å; F13-F19 AromaticContact CZ-CE2 3.92Å; F13-F19 HydrophobicContact CZ-CE2 3.92Å
14L94.3Very high92.7Very high10 Ų1064.2 Ų64.25%0.05231%0.314CS..Hα-helixtrans-63.5-41.1179.2-72.5178.6000112.4F10 R11 V12 R18 F19 I20 I23 F47F10-L14 HydrophobicContact CD1-CD1 3.93Å; F10-L14 HydrophobicContact CD1-CG 4.41Å; F10-L14 HydrophobicContact CE1-CD1 3.46Å; F10-L14 VanDerWaalsContact CE1-CD1 3.46Å; F10-L14 HydrophobicContact CE1-CG 4.07Å; F10-L14 HydrophobicContact CZ-CD1 3.97Å; F10-L14 HydrophobicContact CZ-CD2 4.28Å; F10-L14 HydrophobicContact CZ-CG 4.19Å; F10-L14 WeakPolarHBondContact O-CG 3.46Å; F10-L14 PolarHBondContact O-N 2.95Å; R11-L14 PolarHBondContact O-N 3.4Å; V12-L14 PolarHBondContact O-N 3.2Å; L14-R18 PolarHBondContact O-N 3.47Å; L14-F19 HydrophobicContact CD2-CB 3.71Å; L14-F19 HydrophobicContact CD2-CD2 4.4Å; L14-F19 PolarHBondContact O-N 2.86Å; L14-I20 HydrophobicContact CB-CB 4.43Å; L14-I20 PolarHBondContact O-N 3.16Å; L14-I23 HydrophobicContact CD1-CD1 4.37Å; L14-I23 HydrophobicContact CD2-CD1 4.07Å; L14-F47 HydrophobicContact CB-CE1 4.45Å; L14-F47 HydrophobicContact CB-CZ 4.39Å; L14-F47 HydrophobicContact CD1-CZ 3.91Å
15K90.7Very high92.6Very high42 Ų4261.1 Ų61.118%0.18331%0.31CS..Hα-helixtrans-68-49.9176.8-73.3-175.6-64.3-162.30112R11 V12 F13 R17 R18 I20 F47 D50 L52R11-K15 WeakPolarHBondContact O-CG 3.38Å; R11-K15 PolarHBondContact O-N 3.43Å; V12-K15 PolarHBondContact O-N 3.39Å; F13-K15 PolarHBondContact O-N 3.47Å; K15-R17 PolarHBondContact O-N 3.2Å; K15-R18 PolarHBondContact O-N 3.02Å; K15-I20 HydrophobicContact CG-CG2 4.27Å; K15-F47 HydrophobicContact CD-CD1 4.06Å; K15-F47 HydrophobicContact CD-CE1 4.36Å; K15-F47 HydrophobicContact CG-CD1 4.04Å; K15-F47 HydrophobicContact CG-CE1 3.96Å; K15-D50 VanDerWaalsContact NZ-CB 3.3Å; K15-D50 IonicContact NZ-OD2 3.64Å; K15-D50 PolarHBondContact NZ-OD2 3.35Å; K15-L52 PolarHBondContact NZ-O 3.15Å
16A90.1Very high92.6Very high83 Ų8364.6 Ų64.669%0.68634%0.338SS*.Hα-helixtrans-58.6-34.7-176.500000112.6V12V12-A16 VanDerWaalsContact O-CB 3.26Å; V12-A16 WeakPolarHBondContact O-CB 3.35Å; V12-A16 PolarHBondContact O-N 2.93Å
17R91.3Very high92.7Very high158 Ų15865.9 Ų65.960%0.59635%0.345SS*.THydrogen-bonded Turntrans-95.25.9178.4-66.3-170.6172.2-175.1-0.7114.3F13 K15 F19F13-R17 PolarHBondContact O-N 3.4Å; K15-R17 PolarHBondContact O-N 3.2Å; R17-F19 HydrophobicContact CB-CD2 3.58Å; R17-F19 HydrophobicContact CB-CE2 3.68Å; R17-F19 HydrophobicContact CB-CG 4.22Å; R17-F19 HydrophobicContact CB-CZ 4.37Å; R17-F19 HydrophobicContact CG-CD2 4.5Å; R17-F19 HydrophobicContact CG-CE2 4.26Å; R17-F19 PolarHBondContact O-N 3.11Å; R17-F19 VanDerWaalsContact O-N 3.08Å
18R88.8Confident92.8Very high169 Ų16966.5 Ų66.564%0.63835%0.351SS*.THydrogen-bonded Turntrans51.129.4-174.3-60.7-166179.2-164.20.3113.8L14 K15 I20L14-R18 PolarHBondContact O-N 3.47Å; K15-R18 PolarHBondContact O-N 3.02Å; R18-I20 VanDerWaalsContact C-N 3.27Å
19F93.1Very high92.9Very high75 Ų7567.3 Ų67.333%0.32935%0.35SS..Hα-helixtrans-71.9-29.2172.7-74.3-46.2000111F13 L14 R17 D21 K22 I23F13-F19 AromaticContact CE1-CD2 3.94Å; F13-F19 HydrophobicContact CE1-CD2 3.94Å; F13-F19 HydrophobicContact CE1-CE2 4.05Å; F13-F19 HydrophobicContact CZ-CD2 4.26Å; F13-F19 AromaticContact CZ-CE2 3.92Å; F13-F19 HydrophobicContact CZ-CE2 3.92Å; L14-F19 HydrophobicContact CD2-CB 3.71Å; L14-F19 HydrophobicContact CD2-CD2 4.4Å; L14-F19 PolarHBondContact O-N 2.86Å; R17-F19 HydrophobicContact CB-CD2 3.58Å; R17-F19 HydrophobicContact CB-CE2 3.68Å; R17-F19 HydrophobicContact CB-CG 4.22Å; R17-F19 HydrophobicContact CB-CZ 4.37Å; R17-F19 HydrophobicContact CG-CD2 4.5Å; R17-F19 HydrophobicContact CG-CE2 4.26Å; R17-F19 PolarHBondContact O-N 3.11Å; R17-F19 VanDerWaalsContact O-N 3.08Å; F19-D21 VanDerWaalsContact C-N 3.27Å; F19-D21 PolarHBondContact O-N 3.38Å; F19-K22 HydrophobicContact CD1-CD 4.35Å; F19-K22 PolarHBondContact O-N 2.91Å; F19-I23 VanDerWaalsContact O-CG1 3.24Å; F19-I23 WeakPolarHBondContact O-CG1 3.48Å; F19-I23 PolarHBondContact O-N 3.48Å
20I92.7Very high92.9Very high4 Ų463.1 Ų63.12%0.02132%0.321CS..Hα-helixtrans-60.2-39176.6-166.658.8000111.9L14 K15 R18 K22 I23 F24 F47 L54L14-I20 HydrophobicContact CB-CB 4.43Å; L14-I20 PolarHBondContact O-N 3.16Å; K15-I20 HydrophobicContact CG-CG2 4.27Å; R18-I20 VanDerWaalsContact C-N 3.27Å; I20-K22 VanDerWaalsContact C-N 3.35Å; I20-K22 PolarHBondContact O-N 3.43Å; I20-I23 WeakPolarHBondContact O-CB 3.33Å; I20-I23 PolarHBondContact O-N 3.04Å; I20-F24 HydrophobicContact CD1-CD2 4.16Å; I20-F24 HydrophobicContact CD1-CE2 3.67Å; I20-F24 HydrophobicContact CD1-CZ 4.2Å; I20-F24 HydrophobicContact CG1-CD2 3.88Å; I20-F24 HydrophobicContact CG1-CE2 3.51Å; I20-F24 HydrophobicContact CG1-CZ 4.47Å; I20-F24 WeakPolarHBondContact O-CD2 3.21Å; I20-F24 PolarHBondContact O-N 3.36Å; I20-F47 HydrophobicContact CB-CE1 4.4Å; I20-F47 HydrophobicContact CD1-CD1 4.23Å; I20-F47 HydrophobicContact CD1-CD2 4.17Å; I20-F47 HydrophobicContact CD1-CE1 3.89Å; I20-F47 HydrophobicContact CD1-CE2 3.8Å; I20-F47 HydrophobicContact CD1-CG 4.36Å; I20-F47 HydrophobicContact CD1-CZ 3.65Å; I20-F47 HydrophobicContact CG1-CD1 4.04Å; I20-F47 HydrophobicContact CG1-CE1 3.91Å; I20-F47 HydrophobicContact CG1-CG 4.45Å; I20-F47 HydrophobicContact CG1-CZ 4.22Å; I20-L54 HydrophobicContact CG1-CD1 3.81Å; I20-L54 HydrophobicContact CG2-CD1 4.06Å
21D90Very high92.6Very high31 Ų3162.3 Ų62.317%0.16632%0.32CS..Hα-helixtrans-61.4-44.1176.6-53.2-7.1000111.1F19 I23 F24 L25F19-D21 VanDerWaalsContact C-N 3.27Å; F19-D21 PolarHBondContact O-N 3.38Å; D21-I23 VanDerWaalsContact C-N 3.32Å; D21-I23 PolarHBondContact O-N 2.64Å; D21-F24 PolarHBondContact O-N 3.41Å; D21-L25 WeakPolarHBondContact O-CB 3.28Å; D21-L25 PolarHBondContact O-N 3.21Å
22K92.5Very high92.4Very high137 Ų13766.7 Ų66.760%0.59635%0.352SS*.Hα-helixtrans-66-35.9177.3-62.5-173.8-178-177.10112.3F19 I20 L25 A26F19-K22 HydrophobicContact CD1-CD 4.35Å; F19-K22 PolarHBondContact O-N 2.91Å; I20-K22 VanDerWaalsContact C-N 3.35Å; I20-K22 PolarHBondContact O-N 3.43Å; K22-L25 PolarHBondContact O-N 3.26Å; K22-A26 WeakPolarHBondContact O-CB 3.39Å; K22-A26 PolarHBondContact O-N 3.2Å
23I94.7Very high92.3Very high42 Ų4267.5 Ų67.522%0.21535%0.35CS..Hα-helixtrans-65.4-48.6176.9-71165.7000109.7M1 L14 F19 I20 D21 L25 A26 L27 L43M1-I23 HydrophobicContact CE-CB 4.46Å; M1-I23 HydrophobicContact CE-CD1 3.59Å; M1-I23 HydrophobicContact CE-CG1 4.37Å; M1-I23 HydrophobicContact CE-CG2 3.55Å; L14-I23 HydrophobicContact CD1-CD1 4.37Å; L14-I23 HydrophobicContact CD2-CD1 4.07Å; F19-I23 VanDerWaalsContact O-CG1 3.24Å; F19-I23 WeakPolarHBondContact O-CG1 3.48Å; F19-I23 PolarHBondContact O-N 3.48Å; I20-I23 WeakPolarHBondContact O-CB 3.33Å; I20-I23 PolarHBondContact O-N 3.04Å; D21-I23 VanDerWaalsContact C-N 3.32Å; D21-I23 PolarHBondContact O-N 2.64Å; I23-L25 VanDerWaalsContact C-N 3.3Å; I23-L25 PolarHBondContact O-N 3.42Å; I23-A26 PolarHBondContact O-N 3.19Å; I23-A26 VanDerWaalsContact O-N 3.11Å; I23-L27 HydrophobicContact CG2-CD1 3.87Å; I23-L27 VanDerWaalsContact O-CG 3.29Å; I23-L27 WeakPolarHBondContact O-CG 3.32Å; I23-L27 PolarHBondContact O-N 2.73Å; I23-L43 HydrophobicContact CG2-CD1 4.49Å
24F94.5Very high92Very high1 Ų165.1 Ų65.10%0.00434%0.341CS..Hα-helixtrans-64.3-36.6176.9-75.2-56.2000112.4I20 D21 A26 L27 L43 F44 L54 T60 L63I20-F24 HydrophobicContact CD1-CD2 4.16Å; I20-F24 HydrophobicContact CD1-CE2 3.67Å; I20-F24 HydrophobicContact CD1-CZ 4.2Å; I20-F24 HydrophobicContact CG1-CD2 3.88Å; I20-F24 HydrophobicContact CG1-CE2 3.51Å; I20-F24 HydrophobicContact CG1-CZ 4.47Å; I20-F24 WeakPolarHBondContact O-CD2 3.21Å; I20-F24 PolarHBondContact O-N 3.36Å; D21-F24 PolarHBondContact O-N 3.41Å; F24-A26 PolarHBondContact O-N 2.86Å; F24-L27 PolarHBondContact O-N 3.16Å; F24-L43 HydrophobicContact CE1-CB 4.16Å; F24-L43 HydrophobicContact CZ-CB 4.21Å; F24-F44 HydrophobicContact CD1-CD2 4.26Å; F24-F44 HydrophobicContact CD1-CE1 4.41Å; F24-F44 AromaticContact CD1-CE2 3.64Å; F24-F44 HydrophobicContact CD1-CE2 3.64Å; F24-F44 AromaticContact CD1-CZ 3.73Å; F24-F44 HydrophobicContact CD1-CZ 3.73Å; F24-F44 HydrophobicContact CE1-CD1 4.14Å; F24-F44 AromaticContact CE1-CD2 3.54Å; F24-F44 HydrophobicContact CE1-CD2 3.54Å; F24-F44 HydrophobicContact CE1-CE1 4.03Å; F24-F44 AromaticContact CE1-CE2 3.39Å; F24-F44 HydrophobicContact CE1-CE2 3.39Å; F24-F44 AromaticContact CE1-CG 3.91Å; F24-F44 HydrophobicContact CE1-CG 3.91Å; F24-F44 AromaticContact CE1-CZ 3.65Å; F24-F44 HydrophobicContact CE1-CZ 3.65Å; F24-F44 HydrophobicContact CE2-CD1 4.49Å; F24-F44 HydrophobicContact CE2-CE1 4.26Å; F24-F44 HydrophobicContact CE2-CZ 4.49Å; F24-F44 HydrophobicContact CG-CZ 4.22Å; F24-F44 AromaticContact CZ-CD1 3.88Å; F24-F44 HydrophobicContact CZ-CD1 3.88Å; F24-F44 HydrophobicContact CZ-CD2 4.08Å; F24-F44 AromaticContact CZ-CE1 3.94Å; F24-F44 HydrophobicContact CZ-CE1 3.94Å; F24-F44 HydrophobicContact CZ-CE2 4.12Å; F24-F44 AromaticContact CZ-CG 3.96Å; F24-F44 HydrophobicContact CZ-CG 3.96Å; F24-F44 HydrophobicContact CZ-CZ 4.05Å; F24-L54 HydrophobicContact CD2-CD1 4.36Å; F24-L54 HydrophobicContact CD2-CD2 4.28Å; F24-L54 HydrophobicContact CE2-CD1 3.75Å; F24-L54 HydrophobicContact CE2-CD2 3.53Å; F24-L54 HydrophobicContact CE2-CG 4.3Å; F24-L54 HydrophobicContact CZ-CD2 4.05Å; F24-T60 HydrophobicContact CB-CG2 4.26Å; F24-T60 HydrophobicContact CD2-CG2 3.86Å; F24-T60 HydrophobicContact CE2-CG2 4.41Å; F24-T60 HydrophobicContact CG-CG2 4.08Å; F24-L63 HydrophobicContact CB-CD2 4.29Å; F24-L63 HydrophobicContact CD1-CD2 4.09Å; F24-L63 WeakPolarHBondContact O-CD2 3.49Å
25L92.8Very high91.7Very high101 Ų10166.3 Ų66.353%0.52935%0.348SS..Hα-helixtrans-61.8-34173.5-172.665.5000112.4D21 K22 I23 L27 T28D21-L25 WeakPolarHBondContact O-CB 3.28Å; D21-L25 PolarHBondContact O-N 3.21Å; K22-L25 PolarHBondContact O-N 3.26Å; I23-L25 VanDerWaalsContact C-N 3.3Å; I23-L25 PolarHBondContact O-N 3.42Å; L25-L27 VanDerWaalsContact C-N 3.27Å; L25-L27 PolarHBondContact O-N 2.7Å; L25-T28 WeakPolarHBondContact O-CG2 3.24Å; L25-T28 PolarHBondContact O-OG1 3.36Å
26A94.7Very high91.8Very high73 Ų7366.9 Ų66.960%0.60335%0.353SS*.THydrogen-bonded Turntrans-79.3-6.5175.600000113.8K22 I23 F24K22-A26 WeakPolarHBondContact O-CB 3.39Å; K22-A26 PolarHBondContact O-N 3.2Å; I23-A26 PolarHBondContact O-N 3.19Å; I23-A26 VanDerWaalsContact O-N 3.11Å; F24-A26 PolarHBondContact O-N 2.86Å
27L95.2Very high91.9Very high30 Ų3063 Ų6316%0.15732%0.32CS..THydrogen-bonded Turntrans-110.916.8-178.7-67.8172.3000112.3I23 F24 L25 D29 S30 L36 C40 L43 L63I23-L27 HydrophobicContact CG2-CD1 3.87Å; I23-L27 VanDerWaalsContact O-CG 3.29Å; I23-L27 WeakPolarHBondContact O-CG 3.32Å; I23-L27 PolarHBondContact O-N 2.73Å; F24-L27 PolarHBondContact O-N 3.16Å; L25-L27 VanDerWaalsContact C-N 3.27Å; L25-L27 PolarHBondContact O-N 2.7Å; L27-D29 PolarHBondContact O-N 3.46Å; L27-S30 WeakPolarHBondContact O-CB 3.33Å; L27-S30 PolarHBondContact O-N 3.04Å; L27-S30 PolarHBondContact O-OG 2.97Å; L27-L36 HydrophobicContact CD2-CD1 3.85Å; L27-L36 HydrophobicContact CD2-CD2 4.37Å; L27-L36 HydrophobicContact CD2-CG 4.24Å; L27-C40 HydrophobicContact CD1-CB 4.46Å; L27-L43 HydrophobicContact CD1-CD1 4.05Å; L27-L63 HydrophobicContact CB-CD2 4.26Å; L27-L63 WeakPolarHBondContact O-CD1 3.42Å
28T93.5Very high91.7Very high79 Ų7955.4 Ų55.449%0.48529%0.292SS..THydrogen-bonded Turntrans-64.4-23-177.848.80000113.7L25 P31L25-T28 WeakPolarHBondContact O-CG2 3.24Å; L25-T28 PolarHBondContact O-OG1 3.36Å; T28-P31 WeakPolarHBondContact O-CD 3.11Å
29D93.8Very high91.9Very high77 Ų7748.8 Ų48.841%0.41227%0.271SS..THydrogen-bonded Turntrans-84.1-8.3174.364.4-31.6000113.3L27 P31 S32L27-D29 PolarHBondContact O-N 3.46Å; D29-P31 VanDerWaalsContact C-N 3.31Å; D29-S32 WeakPolarHBondContact O-CB 3.14Å; D29-S32 PolarHBondContact O-N 2.95Å
30S93Very high92Very high0 Ų045.3 Ų45.30%026%0.256CS..G310 helixtrans-54.1-34.5-179.167.30000115.5L27 S32 H33 A37L27-S30 WeakPolarHBondContact O-CB 3.33Å; L27-S30 PolarHBondContact O-N 3.04Å; L27-S30 PolarHBondContact O-OG 2.97Å; S30-S32 PolarHBondContact O-N 3.14Å; S30-S32 VanDerWaalsContact O-N 3.08Å; S30-H33 PolarHBondContact O-N 3.36Å; S30-H33 VanDerWaalsContact O-O 3.06Å; S30-A37 WeakPolarHBondContact O-CB 2.99Å; S30-A37 PolarHBondContact O-N 2.68Å
31P89.8Confident91.9Very high24 Ų2445.1 Ų45.116%0.15626%0.255CS..G310 helixtrans-65.4-9176.3-20.134.3000114.6T28 D29 L63 E66 L67 Q70T28-P31 WeakPolarHBondContact O-CD 3.11Å; D29-P31 VanDerWaalsContact C-N 3.31Å; P31-L63 HydrophobicContact CG-CD1 3.76Å; P31-E66 HydrophobicContact CB-CB 4.01Å; P31-E66 HydrophobicContact CG-CB 3.65Å; P31-L67 HydrophobicContact CG-CD2 4.13Å; P31-L67 HydrophobicContact CG-CG 4.35Å; P31-Q70 PolarHBondContact O-NE2 3.08Å
32S89.7Confident92Very high97 Ų9743.6 Ų43.668%0.67825%0.247SC*.G310 helixtrans-90.7-5.2173.4-570000113.2D29 S30D29-S32 WeakPolarHBondContact O-CB 3.14Å; D29-S32 PolarHBondContact O-N 2.95Å; S30-S32 PolarHBondContact O-N 3.14Å; S30-S32 VanDerWaalsContact O-N 3.08Å
33H89.2Confident92.1Very high103 Ų10337.5 Ų37.548%0.47722%0.221SC..SBendtrans-136.5107.9-173.5-62.7-55.9000111.2S30 V35 L36 A37S30-H33 PolarHBondContact O-N 3.36Å; S30-H33 VanDerWaalsContact O-O 3.06Å; H33-V35 VanDerWaalsContact C-N 3.34Å; H33-V35 PolarHBondContact O-N 3.24Å; H33-V35 VanDerWaalsContact O-N 3.16Å; H33-L36 HydrophobicContact CB-CB 3.85Å; H33-L36 CarbonylContact O-C 3.37Å; H33-L36 WeakPolarHBondContact O-CA 3.36Å; H33-L36 WeakPolarHBondContact O-CB 3.4Å; H33-L36 PolarHBondContact O-N 2.99Å; H33-A37 PolarHBondContact O-N 2.79Å
34D87.6Confident91.9Very high32 Ų3235.5 Ų35.517%0.17121%0.21CC..Hα-helixtrans-55.6-42.3-169.4-59.5-31.8000114.9L36 A37 M38 A73 E74 Y79D34-L36 VanDerWaalsContact C-N 3.32Å; D34-L36 PolarHBondContact O-N 2.72Å; D34-A37 PolarHBondContact O-N 3.38Å; D34-M38 WeakPolarHBondContact O-CB 3.26Å; D34-M38 PolarHBondContact O-N 2.98Å; D34-A73 HydrophobicContact CB-CB 4.05Å; D34-E74 VanDerWaalsContact OD2-CB 3.23Å; D34-E74 WeakPolarHBondContact OD2-CB 3.34Å; D34-E74 PolarHBondContact OD2-N 3.02Å; D34-Y79 HydrophobicContact CB-CD2 3.75Å; D34-Y79 HydrophobicContact CB-CE2 3.87Å
35V89Confident91.7Very high34 Ų3435.5 Ų35.521%0.20621%0.21CC..Hα-helixtrans-64.3-40.8177.9-177.90000110.9H33 C39 Q78 Y79 C82H33-V35 VanDerWaalsContact C-N 3.34Å; H33-V35 PolarHBondContact O-N 3.24Å; H33-V35 VanDerWaalsContact O-N 3.16Å; V35-C39 PolarHBondContact O-N 3.48Å; V35-C39 VanDerWaalsContact O-N 3.08Å; V35-C39 PolarHBondContact O-SG 2.93Å; V35-Q78 HydrophobicContact CG2-CG 4.31Å; V35-Y79 HydrophobicContact CG2-CD2 4.27Å; V35-C82 HydrophobicContact CG1-CB 3.76Å
36L91.8Very high91.5Very high55 Ų5530.7 Ų30.729%0.28819%0.185SC..Hα-helixtrans-74.7-39.8-178.9-167.260.5000110.7L27 H33 D34 M38 C39 C40L27-L36 HydrophobicContact CD2-CD1 3.85Å; L27-L36 HydrophobicContact CD2-CD2 4.37Å; L27-L36 HydrophobicContact CD2-CG 4.24Å; H33-L36 HydrophobicContact CB-CB 3.85Å; H33-L36 CarbonylContact O-C 3.37Å; H33-L36 WeakPolarHBondContact O-CA 3.36Å; H33-L36 WeakPolarHBondContact O-CB 3.4Å; H33-L36 PolarHBondContact O-N 2.99Å; D34-L36 VanDerWaalsContact C-N 3.32Å; D34-L36 PolarHBondContact O-N 2.72Å; L36-M38 VanDerWaalsContact C-N 3.33Å; L36-M38 PolarHBondContact O-N 3.17Å; L36-C39 PolarHBondContact O-N 3.26Å; L36-C40 VanDerWaalsContact O-CB 3.26Å; L36-C40 WeakPolarHBondContact O-CB 3.42Å; L36-C40 PolarHBondContact O-N 3.47Å
37A91.7Very high91.3Very high0 Ų027.2 Ų27.20%016%0.156CC..Hα-helixtrans-55.6-48.6171.500000110.6S30 H33 D34 C39 C40 S41 L67 A132S30-A37 WeakPolarHBondContact O-CB 2.99Å; S30-A37 PolarHBondContact O-N 2.68Å; H33-A37 PolarHBondContact O-N 2.79Å; D34-A37 PolarHBondContact O-N 3.38Å; A37-C39 PolarHBondContact O-N 3.08Å; A37-C40 PolarHBondContact O-N 2.76Å; A37-S41 WeakPolarHBondContact O-CB 3.15Å; A37-S41 PolarHBondContact O-N 3.31Å; A37-S41 PolarHBondContact O-OG 3.01Å; A37-S41 VanDerWaalsContact O-OG 3.12Å; A37-L67 HydrophobicContact CB-CD2 3.68Å; A37-A132 HydrophobicContact CB-CB 4.15Å
38M88.1Confident90.9Very high0 Ų025.8 Ų25.80%015%0.149CC..Hα-helixtrans-62.2-43.2177.9-166.3176.943.900112.2D34 L36 C42 Y79 C82 K83 I86 A132 M135D34-M38 WeakPolarHBondContact O-CB 3.26Å; D34-M38 PolarHBondContact O-N 2.98Å; L36-M38 VanDerWaalsContact C-N 3.33Å; L36-M38 PolarHBondContact O-N 3.17Å; M38-C42 WeakPolarHBondContact O-CB 3.37Å; M38-C42 PolarHBondContact O-N 3.32Å; M38-Y79 HydrophobicContact CB-CE2 4.39Å; M38-Y79 HydrophobicContact CE-CD2 4.19Å; M38-Y79 HydrophobicContact CE-CE2 3.98Å; M38-Y79 HydrophobicContact SD-CE2 4.12Å; M38-C82 HydrophobicContact CE-CB 3.67Å; M38-K83 HydrophobicContact CE-CB 3.97Å; M38-K83 HydrophobicContact SD-CB 4.06Å; M38-K83 HydrophobicContact SD-CG 4.25Å; M38-I86 HydrophobicContact CB-CD1 4.17Å; M38-I86 HydrophobicContact CE-CD1 4Å; M38-I86 HydrophobicContact CG-CD1 3.6Å; M38-I86 HydrophobicContact SD-CD1 4.16Å; M38-A132 HydrophobicContact CB-CB 4.31Å; M38-M135 HydrophobicContact CG-CE 3.74Å
39C92.2Very high90.4Very high30 Ų3022.6 Ų22.620%0.20313%0.128CC..Hα-helixtrans-61.7-43.1174.1-68.90000112.2L2 V35 L36 A37 C42 L43L2-C39 HydrophobicContact CD1-CB 3.8Å; V35-C39 PolarHBondContact O-N 3.48Å; V35-C39 VanDerWaalsContact O-N 3.08Å; V35-C39 PolarHBondContact O-SG 2.93Å; L36-C39 PolarHBondContact O-N 3.26Å; A37-C39 PolarHBondContact O-N 3.08Å; C39-C42 PolarHBondContact O-N 3.39Å; C39-L43 PolarHBondContact O-N 3.31Å
40C94.7Very high89.9Confident1 Ų119.8 Ų19.81%0.00711%0.113CC..Hα-helixtrans-67.8-43.6-178.8-168.30000111.2L27 L36 A37 C42 L43 F44 L67L27-C40 HydrophobicContact CD1-CB 4.46Å; L36-C40 VanDerWaalsContact O-CB 3.26Å; L36-C40 WeakPolarHBondContact O-CB 3.42Å; L36-C40 PolarHBondContact O-N 3.47Å; A37-C40 PolarHBondContact O-N 2.76Å; C40-C42 VanDerWaalsContact C-N 3.32Å; C40-C42 PolarHBondContact O-N 2.96Å; C40-L43 WeakPolarHBondContact O-CB 3.35Å; C40-L43 PolarHBondContact O-N 3.46Å; C40-L43 VanDerWaalsContact O-N 3.12Å; C40-F44 WeakPolarHBondContact O-CD2 3.49Å; C40-F44 PolarHBondContact O-N 2.79Å; C40-L67 HydrophobicContact CB-CD1 4.11Å; C40-L67 HydrophobicContact CB-CD2 4.46Å
41S91.8Very high89.1Confident0 Ų031.3 Ų31.30%016%0.157CC..Hα-helixtrans-62.2-37.9173.5-63.90000112.4A37 L43 F44 Y45 A132A37-S41 WeakPolarHBondContact O-CB 3.15Å; A37-S41 PolarHBondContact O-N 3.31Å; A37-S41 PolarHBondContact O-OG 3.01Å; A37-S41 VanDerWaalsContact O-OG 3.12Å; S41-L43 VanDerWaalsContact C-N 3.32Å; S41-L43 PolarHBondContact O-N 2.81Å; S41-F44 WeakPolarHBondContact O-CB 3.43Å; S41-F44 PolarHBondContact O-N 2.71Å; S41-Y45 WeakPolarHBondContact O-CB 3.44Å; S41-Y45 PolarHBondContact O-N 3.03Å; S41-A132 WeakPolarHBondContact CB-O 3.12Å; S41-A132 PolarHBondContact OG-O 3.5Å
42C91.5Very high88.6Confident0 Ų036.7 Ų36.70%018%0.183CC..Hα-helixtrans-63.7-38173.5-176.50000111.9L2 M38 C39 C40 Y45 I46 I86 M135L2-C42 HydrophobicContact CD1-CB 4.43Å; L2-C42 HydrophobicContact CD2-CB 4.04Å; M38-C42 WeakPolarHBondContact O-CB 3.37Å; M38-C42 PolarHBondContact O-N 3.32Å; C39-C42 PolarHBondContact O-N 3.39Å; C40-C42 VanDerWaalsContact C-N 3.32Å; C40-C42 PolarHBondContact O-N 2.96Å; C42-Y45 PolarHBondContact O-N 2.75Å; C42-I46 WeakPolarHBondContact O-CG1 3.47Å; C42-I46 PolarHBondContact O-N 3.43Å; C42-I86 HydrophobicContact CB-CD1 4.29Å; C42-I86 HydrophobicContact CB-CG2 4.11Å; C42-M135 HydrophobicContact CB-CE 4.32Å; C42-M135 HydrophobicContact CB-SD 3.97Å
43L93.9Very high88Confident8 Ų833.2 Ų33.24%0.04216%0.159CC..Hα-helixtrans-62.1-48.9172.8-82168.3000111.7M1 L2 C5 I23 F24 L27 C39 C40 S41 Y45 I46 F47M1-L43 HydrophobicContact CE-CD1 3.66Å; M1-L43 HydrophobicContact CE-CD2 3.59Å; M1-L43 HydrophobicContact CE-CG 4.28Å; M1-L43 HydrophobicContact SD-CD1 3.95Å; M1-L43 HydrophobicContact SD-CD2 3.53Å; M1-L43 VanDerWaalsContact SD-CD2 3.53Å; M1-L43 HydrophobicContact SD-CG 4.29Å; L2-L43 HydrophobicContact CD2-CB 4.43Å; L2-L43 HydrophobicContact CD2-CD2 3.67Å; L2-L43 HydrophobicContact CD2-CG 3.58Å; L2-L43 HydrophobicContact CG-CD2 4.18Å; L2-L43 HydrophobicContact CG-CG 3.99Å; C5-L43 HydrophobicContact CB-CD2 4.47Å; I23-L43 HydrophobicContact CG2-CD1 4.49Å; F24-L43 HydrophobicContact CE1-CB 4.16Å; F24-L43 HydrophobicContact CZ-CB 4.21Å; L27-L43 HydrophobicContact CD1-CD1 4.05Å; C39-L43 PolarHBondContact O-N 3.31Å; C40-L43 WeakPolarHBondContact O-CB 3.35Å; C40-L43 PolarHBondContact O-N 3.46Å; C40-L43 VanDerWaalsContact O-N 3.12Å; S41-L43 VanDerWaalsContact C-N 3.32Å; S41-L43 PolarHBondContact O-N 2.81Å; L43-Y45 VanDerWaalsContact C-N 3.26Å; L43-Y45 PolarHBondContact O-N 3.44Å; L43-I46 PolarHBondContact O-N 3.35Å; L43-F47 HydrophobicContact CD2-CD2 4.42Å; L43-F47 HydrophobicContact CD2-CE2 4.02Å; L43-F47 VanDerWaalsContact O-CD2 3.28Å; L43-F47 WeakPolarHBondContact O-CD2 3.28Å; L43-F47 PolarHBondContact O-N 3.44Å; L43-F47 VanDerWaalsContact O-N 3.09Å
44F91.4Very high87.6Confident0 Ų028.6 Ų28.60%014%0.138CC..Hα-helixtrans-53.5-47.2173.9-88.2-70.8000111.6F24 C40 S41 I46 F47 A48 L54 T60 L63 L64 L67 S139F24-F44 HydrophobicContact CD1-CD2 4.26Å; F24-F44 HydrophobicContact CD1-CE1 4.41Å; F24-F44 AromaticContact CD1-CE2 3.64Å; F24-F44 HydrophobicContact CD1-CE2 3.64Å; F24-F44 AromaticContact CD1-CZ 3.73Å; F24-F44 HydrophobicContact CD1-CZ 3.73Å; F24-F44 HydrophobicContact CE1-CD1 4.14Å; F24-F44 AromaticContact CE1-CD2 3.54Å; F24-F44 HydrophobicContact CE1-CD2 3.54Å; F24-F44 HydrophobicContact CE1-CE1 4.03Å; F24-F44 AromaticContact CE1-CE2 3.39Å; F24-F44 HydrophobicContact CE1-CE2 3.39Å; F24-F44 AromaticContact CE1-CG 3.91Å; F24-F44 HydrophobicContact CE1-CG 3.91Å; F24-F44 AromaticContact CE1-CZ 3.65Å; F24-F44 HydrophobicContact CE1-CZ 3.65Å; F24-F44 HydrophobicContact CE2-CD1 4.49Å; F24-F44 HydrophobicContact CE2-CE1 4.26Å; F24-F44 HydrophobicContact CE2-CZ 4.49Å; F24-F44 HydrophobicContact CG-CZ 4.22Å; F24-F44 AromaticContact CZ-CD1 3.88Å; F24-F44 HydrophobicContact CZ-CD1 3.88Å; F24-F44 HydrophobicContact CZ-CD2 4.08Å; F24-F44 AromaticContact CZ-CE1 3.94Å; F24-F44 HydrophobicContact CZ-CE1 3.94Å; F24-F44 HydrophobicContact CZ-CE2 4.12Å; F24-F44 AromaticContact CZ-CG 3.96Å; F24-F44 HydrophobicContact CZ-CG 3.96Å; F24-F44 HydrophobicContact CZ-CZ 4.05Å; C40-F44 WeakPolarHBondContact O-CD2 3.49Å; C40-F44 PolarHBondContact O-N 2.79Å; S41-F44 WeakPolarHBondContact O-CB 3.43Å; S41-F44 PolarHBondContact O-N 2.71Å; F44-I46 PolarHBondContact O-N 2.95Å; F44-F47 PolarHBondContact O-N 2.85Å; F44-A48 WeakPolarHBondContact O-CB 3.42Å; F44-A48 PolarHBondContact O-N 3.41Å; F44-L54 HydrophobicContact CD1-CD2 3.57Å; F44-L54 HydrophobicContact CE1-CD2 3.52Å; F44-T60 HydrophobicContact CE1-CG2 3.48Å; F44-T60 VanDerWaalsContact CE1-CG2 3.48Å; F44-T60 HydrophobicContact CZ-CG2 3.59Å; F44-T60 WeakPolarHBondContact CZ-O 3.38Å; F44-L63 HydrophobicContact CE2-CD2 4.14Å; F44-L63 HydrophobicContact CE2-CG 4.09Å; F44-L63 HydrophobicContact CZ-CD2 4.46Å; F44-L63 HydrophobicContact CZ-CG 4.46Å; F44-L64 HydrophobicContact CB-CD1 4.09Å; F44-L64 HydrophobicContact CD1-CD1 3.83Å; F44-L64 HydrophobicContact CD1-CD2 4.41Å; F44-L64 HydrophobicContact CD2-CD1 3.86Å; F44-L64 HydrophobicContact CE1-CB 4.07Å; F44-L64 HydrophobicContact CE1-CD1 4.14Å; F44-L64 HydrophobicContact CE1-CD2 4.4Å; F44-L64 HydrophobicContact CE1-CG 4.45Å; F44-L64 HydrophobicContact CE2-CB 4.31Å; F44-L64 HydrophobicContact CE2-CD1 4.19Å; F44-L64 HydrophobicContact CG-CD1 3.67Å; F44-L64 HydrophobicContact CZ-CB 3.91Å; F44-L64 HydrophobicContact CZ-CD1 4.32Å; F44-L67 HydrophobicContact CD2-CD1 3.82Å; F44-L67 HydrophobicContact CE2-CD1 3.8Å; F44-S139 VanDerWaalsContact C-OG 3.29Å
45Y89.4Confident87.1Confident1 Ų132.6 Ų32.60%0.00416%0.158CC..Hα-helixtrans-59.2-49.4-177.2-177.1-93.5000112.7S41 C42 L43 F47 R49 L90 W93 F109 L111 E138 S139S41-Y45 WeakPolarHBondContact O-CB 3.44Å; S41-Y45 PolarHBondContact O-N 3.03Å; C42-Y45 PolarHBondContact O-N 2.75Å; L43-Y45 VanDerWaalsContact C-N 3.26Å; L43-Y45 PolarHBondContact O-N 3.44Å; Y45-F47 PolarHBondContact O-N 2.74Å; Y45-R49 PolarHBondContact O-N 3.17Å; Y45-R49 PolarHBondContact OH-NE 2.8Å; Y45-R49 VanDerWaalsContact OH-NE 3.14Å; Y45-R49 PolarHBondContact OH-NH2 3.3Å; Y45-L90 HydrophobicContact CD1-CD2 3.65Å; Y45-L90 HydrophobicContact CE1-CD2 3.91Å; Y45-W93 HydrophobicContact CE1-CH2 4.35Å; Y45-W93 AromaticContact CE1-CZ3 3.93Å; Y45-W93 HydrophobicContact CE1-CZ3 3.93Å; Y45-F109 HydrophobicContact CE1-CE2 4.01Å; Y45-L111 HydrophobicContact CD1-CD1 4.35Å; Y45-L111 HydrophobicContact CD2-CD1 3.99Å; Y45-L111 HydrophobicContact CE1-CD1 3.81Å; Y45-L111 HydrophobicContact CE2-CD1 3.38Å; Y45-L111 HydrophobicContact CE2-CG 4.17Å; Y45-L111 HydrophobicContact CG-CD1 4.42Å; Y45-L111 WeakPolarHBondContact OH-CD1 3.28Å; Y45-E138 HydrophobicContact CD2-CB 4Å; Y45-E138 HydrophobicContact CE2-CB 3.9Å; Y45-E138 HydrophobicContact CE2-CG 4.41Å; Y45-E138 WeakPolarHBondContact CE2-OE2 3.42Å; Y45-S139 WeakPolarHBondContact CA-OG 3.46Å; Y45-S139 PolarHBondContact N-OG 2.88Å
46I90.1Very high86.5Confident0 Ų031.2 Ų31.20%015%0.15CC..Hα-helixtrans-62.5-45.1179.8-73172.5000111L2 C5 C42 L43 F44 I89 L90 W93L2-I46 HydrophobicContact CD2-CD1 4.22Å; C5-I46 HydrophobicContact CB-CG2 4.43Å; C42-I46 WeakPolarHBondContact O-CG1 3.47Å; C42-I46 PolarHBondContact O-N 3.43Å; L43-I46 PolarHBondContact O-N 3.35Å; F44-I46 PolarHBondContact O-N 2.95Å; I46-I89 HydrophobicContact CD1-CG2 4.29Å; I46-L90 HydrophobicContact CD1-CD2 4.33Å; I46-L90 HydrophobicContact CG1-CD2 4.05Å; I46-W93 HydrophobicContact CG1-CD2 4.29Å; I46-W93 HydrophobicContact CG1-CG 4.31Å
47F91Very high85.8Confident0 Ų030.9 Ų30.90%015%0.148CC..Hα-helixtrans-76.7-32.6-176.5-82.5-98.4000113.3C5 R11 L14 K15 I20 L43 F44 Y45 R49 D50 L54C5-F47 HydrophobicContact CB-CE2 4.22Å; R11-F47 HydrophobicContact CB-CE1 3.93Å; R11-F47 HydrophobicContact CB-CZ 4.04Å; R11-F47 HydrophobicContact CG-CE1 4.2Å; R11-F47 HydrophobicContact CG-CE2 4.23Å; R11-F47 HydrophobicContact CG-CZ 3.86Å; L14-F47 HydrophobicContact CB-CE1 4.45Å; L14-F47 HydrophobicContact CB-CZ 4.39Å; L14-F47 HydrophobicContact CD1-CZ 3.91Å; K15-F47 HydrophobicContact CD-CD1 4.06Å; K15-F47 HydrophobicContact CD-CE1 4.36Å; K15-F47 HydrophobicContact CG-CD1 4.04Å; K15-F47 HydrophobicContact CG-CE1 3.96Å; I20-F47 HydrophobicContact CB-CE1 4.4Å; I20-F47 HydrophobicContact CD1-CD1 4.23Å; I20-F47 HydrophobicContact CD1-CD2 4.17Å; I20-F47 HydrophobicContact CD1-CE1 3.89Å; I20-F47 HydrophobicContact CD1-CE2 3.8Å; I20-F47 HydrophobicContact CD1-CG 4.36Å; I20-F47 HydrophobicContact CD1-CZ 3.65Å; I20-F47 HydrophobicContact CG1-CD1 4.04Å; I20-F47 HydrophobicContact CG1-CE1 3.91Å; I20-F47 HydrophobicContact CG1-CG 4.45Å; I20-F47 HydrophobicContact CG1-CZ 4.22Å; L43-F47 HydrophobicContact CD2-CD2 4.42Å; L43-F47 HydrophobicContact CD2-CE2 4.02Å; L43-F47 VanDerWaalsContact O-CD2 3.28Å; L43-F47 WeakPolarHBondContact O-CD2 3.28Å; L43-F47 PolarHBondContact O-N 3.44Å; L43-F47 VanDerWaalsContact O-N 3.09Å; F44-F47 PolarHBondContact O-N 2.85Å; Y45-F47 PolarHBondContact O-N 2.74Å; F47-R49 PolarHBondContact O-N 3.3Å; F47-D50 PolarHBondContact O-N 3.4Å; F47-L54 HydrophobicContact CB-CB 4.26Å; F47-L54 HydrophobicContact CB-CD1 4.42Å; F47-L54 PolarHBondContact O-N 3.42Å
48A85.8Confident85Confident0 Ų037.9 Ų37.90%018%0.179CC..Hα-helixtrans-61.5-34176.800000112F44 S53 I143F44-A48 WeakPolarHBondContact O-CB 3.42Å; F44-A48 PolarHBondContact O-N 3.41Å; A48-S53 PolarHBondContact O-OG 3.44Å; A48-I143 HydrophobicContact CB-CD1 4.14Å; A48-I143 HydrophobicContact CB-CG1 3.89Å
49R82.1Confident84.8Confident12 Ų1239.9 Ų39.95%0.04519%0.193CC..Hα-helixtrans-86.4-12.1-175.4-72.6176.2166.7-105.97.9114.7Y45 F47 W93 V108 E138 Y142 R146Y45-R49 PolarHBondContact O-N 3.17Å; Y45-R49 PolarHBondContact OH-NE 2.8Å; Y45-R49 VanDerWaalsContact OH-NE 3.14Å; Y45-R49 PolarHBondContact OH-NH2 3.3Å; F47-R49 PolarHBondContact O-N 3.3Å; R49-W93 HydrophobicContact CB-CH2 3.92Å; R49-W93 HydrophobicContact CB-CZ2 4Å; R49-W93 HydrophobicContact CG-CH2 4.46Å; R49-V108 PolarHBondContact NH1-O 3.33Å; R49-V108 PolarHBondContact NH2-O 3.25Å; R49-E138 IonicContact CZ-OE2 3.25Å; R49-E138 IonicContact NH2-OE2 3.12Å; R49-E138 PolarHBondContact NH2-OE2 3.16Å; R49-Y142 HydrophobicContact CG-CD1 4Å; R49-Y142 HydrophobicContact CG-CD2 4.14Å; R49-Y142 HydrophobicContact CG-CE1 4.1Å; R49-Y142 HydrophobicContact CG-CE2 4.26Å; R49-Y142 HydrophobicContact CG-CG 4Å; R49-Y142 VanDerWaalsContact CZ-CE2 3.44Å; R49-Y142 PolarHBondContact NH1-OH 3.48Å; R49-R146 PolarHBondContact O-NH1 2.82Å; R49-R146 VanDerWaalsContact O-NH1 3.14Å
50D83.6Confident84.6Confident19 Ų1938.5 Ų38.510%0.10218%0.183CC..SBendtrans-58.2151.2172.1-86.1-17.7000111.8R11 K15 F47 L52 S53 R146R11-D50 IonicContact CZ-OD1 3.5Å; R11-D50 VanDerWaalsContact CZ-OD1 3.23Å; R11-D50 VanDerWaalsContact NE-CG 3.31Å; R11-D50 IonicContact NE-OD1 2.9Å; R11-D50 PolarHBondContact NE-OD1 3.44Å; R11-D50 IonicContact NE-OD2 3.93Å; R11-D50 PolarHBondContact NE-OD2 3.04Å; R11-D50 IonicContact NH2-OD1 3.06Å; R11-D50 PolarHBondContact NH2-OD1 3.4Å; K15-D50 VanDerWaalsContact NZ-CB 3.3Å; K15-D50 IonicContact NZ-OD2 3.64Å; K15-D50 PolarHBondContact NZ-OD2 3.35Å; F47-D50 PolarHBondContact O-N 3.4Å; D50-L52 VanDerWaalsContact C-N 3.28Å; D50-L52 WeakPolarHBondContact CB-O 3.17Å; D50-L52 CarbonylContact O-C 3.41Å; D50-L52 PolarHBondContact O-N 2.93Å; D50-S53 PolarHBondContact O-N 3.09Å; D50-R146 PolarHBondContact O-NH1 3.49Å
51R77.2Confident84Confident241 Ų24138.6 Ų38.691%0.90918%0.184SC*.SBendtrans-53.7-45.5177.7-175.5177.9179.8178.21.4112.2
52L78.7Confident83.6Confident137 Ų13741.7 Ų41.772%0.71721%0.205SC*.SBendtrans-93.297.8164.7-63.3174.7000106.9K15 D50K15-L52 PolarHBondContact NZ-O 3.15Å; D50-L52 VanDerWaalsContact C-N 3.28Å; D50-L52 WeakPolarHBondContact CB-O 3.17Å; D50-L52 CarbonylContact O-C 3.41Å; D50-L52 PolarHBondContact O-N 2.93Å
53S76.5Confident83.6Confident25 Ų2542 Ų4218%0.17521%0.207CC..  trans-62.1167.3-177.6-162.80000111.6A48 D50 I55A48-S53 PolarHBondContact O-OG 3.44Å; D50-S53 PolarHBondContact O-N 3.09Å; S53-I55 PolarHBondContact O-N 3.38Å
54L80.6Confident83.3Confident6 Ų641.6 Ų41.63%0.03121%0.205CC..  trans-59.2129.8175.7-17766.2000110.1I20 F24 F44 F47 V56 T60I20-L54 HydrophobicContact CG1-CD1 3.81Å; I20-L54 HydrophobicContact CG2-CD1 4.06Å; F24-L54 HydrophobicContact CD2-CD1 4.36Å; F24-L54 HydrophobicContact CD2-CD2 4.28Å; F24-L54 HydrophobicContact CE2-CD1 3.75Å; F24-L54 HydrophobicContact CE2-CD2 3.53Å; F24-L54 HydrophobicContact CE2-CG 4.3Å; F24-L54 HydrophobicContact CZ-CD2 4.05Å; F44-L54 HydrophobicContact CD1-CD2 3.57Å; F44-L54 HydrophobicContact CE1-CD2 3.52Å; F47-L54 HydrophobicContact CB-CB 4.26Å; F47-L54 HydrophobicContact CB-CD1 4.42Å; F47-L54 PolarHBondContact O-N 3.42Å; L54-V56 PolarHBondContact O-N 2.96Å; L54-T60 HydrophobicContact CD2-CG2 3.97Å
55I77.7Confident82.9Confident116 Ų11642.5 Ų42.560%0.59521%0.21SC*.  trans-75.7115.7169.1-59.2174.6000106.9S53S53-I55 PolarHBondContact O-N 3.38Å
56V76.4Confident82.8Confident5 Ų546.2 Ų46.23%0.0323%0.228CC..  trans-93.3125.3-179.1-173.90000109.6L54 L61 I143L54-V56 PolarHBondContact O-N 2.96Å; V56-L61 HydrophobicContact CG1-CB 3.51Å; V56-L61 HydrophobicContact CG1-CD1 4.23Å; V56-L61 HydrophobicContact CG1-CG 4.3Å; V56-I143 HydrophobicContact CG2-CD1 3.98Å; V56-I143 HydrophobicContact CG2-CG1 4.35Å; V56-I143 HydrophobicContact CG2-CG2 3.62Å
57N77.2Confident82.7Confident48 Ų4846.2 Ų46.226%0.25723%0.228SC..  trans-111.9-177171.369.243.8000110.2S59 T60 L61N57-S59 PolarHBondContact O-N 3.32Å; N57-S59 PolarHBondContact OD1-N 2.86Å; N57-S59 PolarHBondContact OD1-OG 3.32Å; N57-T60 PolarHBondContact ND2-OG1 3.01Å; N57-T60 PolarHBondContact O-N 2.98Å; N57-T60 VanDerWaalsContact O-N 3.14Å; N57-T60 PolarHBondContact OD1-N 3.48Å; N57-T60 PolarHBondContact OD1-OG1 3.03Å; N57-L61 PolarHBondContact O-N 3.37Å
58K76Confident82.3Confident146 Ų14646.6 Ų46.664%0.63523%0.23SC*.Hα-helixtrans-56.8-52-176.6-173.5179.2-177.8179.60116.3T60 S62 E155K58-T60 VanDerWaalsContact C-N 3.27Å; K58-T60 PolarHBondContact O-N 3.12Å; K58-S62 WeakPolarHBondContact O-CB 3.49Å; K58-S62 PolarHBondContact O-N 3.22Å; K58-S62 VanDerWaalsContact O-N 3.07Å; K58-E155 WeakPolarHBondContact CA-OE1 3.16Å; K58-E155 WeakPolarHBondContact CA-OE2 3.42Å; K58-E155 WeakPolarHBondContact CB-OE2 3.3Å; K58-E155 VanDerWaalsContact CG-OE1 3.27Å; K58-E155 WeakPolarHBondContact CG-OE1 3.39Å; K58-E155 WeakPolarHBondContact CG-OE2 3.28Å
59S84.1Confident82.1Confident42 Ų4250 Ų5029%0.29425%0.245SC..Hα-helixtrans-61.2-39.7176.646.70000112.3N57 L63N57-S59 PolarHBondContact O-N 3.32Å; N57-S59 PolarHBondContact OD1-N 2.86Å; N57-S59 PolarHBondContact OD1-OG 3.32Å; S59-L63 WeakPolarHBondContact O-CB 3.16Å; S59-L63 PolarHBondContact O-N 3.03Å
60T87.9Confident82Confident1 Ų151 Ų511%0.00625%0.25CC..Hα-helixtrans-73.9-38.8-174.8-50.60000112.1F24 F44 L54 N57 K58 L64F24-T60 HydrophobicContact CB-CG2 4.26Å; F24-T60 HydrophobicContact CD2-CG2 3.86Å; F24-T60 HydrophobicContact CE2-CG2 4.41Å; F24-T60 HydrophobicContact CG-CG2 4.08Å; F44-T60 HydrophobicContact CE1-CG2 3.48Å; F44-T60 VanDerWaalsContact CE1-CG2 3.48Å; F44-T60 HydrophobicContact CZ-CG2 3.59Å; F44-T60 WeakPolarHBondContact CZ-O 3.38Å; L54-T60 HydrophobicContact CD2-CG2 3.97Å; N57-T60 PolarHBondContact ND2-OG1 3.01Å; N57-T60 PolarHBondContact O-N 2.98Å; N57-T60 VanDerWaalsContact O-N 3.14Å; N57-T60 PolarHBondContact OD1-N 3.48Å; N57-T60 PolarHBondContact OD1-OG1 3.03Å; K58-T60 VanDerWaalsContact C-N 3.27Å; K58-T60 PolarHBondContact O-N 3.12Å; T60-L64 WeakPolarHBondContact O-CB 3.43Å; T60-L64 PolarHBondContact O-N 3.43Å
61L81.2Confident81.2Confident4 Ų455.8 Ų55.82%0.02127%0.271CS..Hα-helixtrans-69-46.1174.9-170.548.1000110.9V56 N57 L63 L64 V65 F152 E155 M162V56-L61 HydrophobicContact CG1-CB 3.51Å; V56-L61 HydrophobicContact CG1-CD1 4.23Å; V56-L61 HydrophobicContact CG1-CG 4.3Å; N57-L61 PolarHBondContact O-N 3.37Å; L61-L63 VanDerWaalsContact C-N 3.25Å; L61-L63 PolarHBondContact O-N 3.36Å; L61-L64 HydrophobicContact CD1-CD2 4.44Å; L61-L64 WeakPolarHBondContact O-CB 3.4Å; L61-L64 PolarHBondContact O-N 2.99Å; L61-L64 VanDerWaalsContact O-N 3.07Å; L61-V65 HydrophobicContact CD1-CG2 4.31Å; L61-V65 HydrophobicContact CG-CG2 4.47Å; L61-V65 WeakPolarHBondContact O-CG2 3.27Å; L61-V65 PolarHBondContact O-N 3.42Å; L61-F152 HydrophobicContact CD2-CD2 4.32Å; L61-F152 HydrophobicContact CD2-CE2 4.27Å; L61-E155 HydrophobicContact CB-CG 4.2Å; L61-E155 HydrophobicContact CD2-CB 3.64Å; L61-E155 HydrophobicContact CD2-CG 3.45Å; L61-E155 VanDerWaalsContact CD2-CG 3.45Å; L61-E155 HydrophobicContact CG-CG 4.18Å; L61-M162 HydrophobicContact CD1-SD 4.46Å
62S84.2Confident80.7Confident64 Ų6447.1 Ų47.145%0.44825%0.248SC..Hα-helixtrans-54.3-44.7175.7-172.60000111.4K58 V65 E66K58-S62 WeakPolarHBondContact O-CB 3.49Å; K58-S62 PolarHBondContact O-N 3.22Å; K58-S62 VanDerWaalsContact O-N 3.07Å; S62-V65 PolarHBondContact O-N 2.85Å; S62-E66 WeakPolarHBondContact O-CG 3.49Å; S62-E66 PolarHBondContact O-N 3.31Å; S62-E66 VanDerWaalsContact O-N 3.08Å
63L90.3Very high79.9Confident6 Ų641.7 Ų41.73%0.03122%0.223CC..Hα-helixtrans-61.8-46.4175.517655.5000112.2F24 L27 P31 F44 S59 L61 V65 E66 L67F24-L63 HydrophobicContact CB-CD2 4.29Å; F24-L63 HydrophobicContact CD1-CD2 4.09Å; F24-L63 WeakPolarHBondContact O-CD2 3.49Å; L27-L63 HydrophobicContact CB-CD2 4.26Å; L27-L63 WeakPolarHBondContact O-CD1 3.42Å; P31-L63 HydrophobicContact CG-CD1 3.76Å; F44-L63 HydrophobicContact CE2-CD2 4.14Å; F44-L63 HydrophobicContact CE2-CG 4.09Å; F44-L63 HydrophobicContact CZ-CD2 4.46Å; F44-L63 HydrophobicContact CZ-CG 4.46Å; S59-L63 WeakPolarHBondContact O-CB 3.16Å; S59-L63 PolarHBondContact O-N 3.03Å; L61-L63 VanDerWaalsContact C-N 3.25Å; L61-L63 PolarHBondContact O-N 3.36Å; L63-V65 VanDerWaalsContact C-N 3.26Å; L63-V65 PolarHBondContact O-N 3.08Å; L63-E66 PolarHBondContact O-N 3.37Å; L63-L67 HydrophobicContact CD1-CD1 4.3Å; L63-L67 HydrophobicContact CD1-CG 4.25Å; L63-L67 HydrophobicContact CG-CD1 4.23Å; L63-L67 WeakPolarHBondContact O-CG 3.49Å; L63-L67 PolarHBondContact O-N 3.07Å
64L87.7Confident79.2Confident0 Ų047.6 Ų47.60%025%0.248CC..Hα-helixtrans-59.3-39.8178.6-174.662.5000111.7F44 T60 L61 L67 I68 A136 L140 I143F44-L64 HydrophobicContact CB-CD1 4.09Å; F44-L64 HydrophobicContact CD1-CD1 3.83Å; F44-L64 HydrophobicContact CD1-CD2 4.41Å; F44-L64 HydrophobicContact CD2-CD1 3.86Å; F44-L64 HydrophobicContact CE1-CB 4.07Å; F44-L64 HydrophobicContact CE1-CD1 4.14Å; F44-L64 HydrophobicContact CE1-CD2 4.4Å; F44-L64 HydrophobicContact CE1-CG 4.45Å; F44-L64 HydrophobicContact CE2-CB 4.31Å; F44-L64 HydrophobicContact CE2-CD1 4.19Å; F44-L64 HydrophobicContact CG-CD1 3.67Å; F44-L64 HydrophobicContact CZ-CB 3.91Å; F44-L64 HydrophobicContact CZ-CD1 4.32Å; T60-L64 WeakPolarHBondContact O-CB 3.43Å; T60-L64 PolarHBondContact O-N 3.43Å; L61-L64 HydrophobicContact CD1-CD2 4.44Å; L61-L64 WeakPolarHBondContact O-CB 3.4Å; L61-L64 PolarHBondContact O-N 2.99Å; L61-L64 VanDerWaalsContact O-N 3.07Å; L64-L67 PolarHBondContact O-N 3.3Å; L64-I68 HydrophobicContact CG-CD1 4.28Å; L64-I68 VanDerWaalsContact O-CG1 3.29Å; L64-I68 WeakPolarHBondContact O-CG1 3.39Å; L64-I68 PolarHBondContact O-N 2.91Å; L64-I68 VanDerWaalsContact O-N 3.07Å; L64-A136 HydrophobicContact CD1-CB 3.82Å; L64-L140 HydrophobicContact CD2-CB 4.12Å; L64-L140 HydrophobicContact CD2-CD1 4.25Å; L64-I143 HydrophobicContact CD2-CD1 3.87Å
65V82.9Confident78.6Confident19 Ų1956.5 Ų56.512%0.11528%0.281CS..Hα-helixtrans-64.6-43.9176.81720000112L61 S62 L63 L67 I68 K69 M162L61-V65 HydrophobicContact CD1-CG2 4.31Å; L61-V65 HydrophobicContact CG-CG2 4.47Å; L61-V65 WeakPolarHBondContact O-CG2 3.27Å; L61-V65 PolarHBondContact O-N 3.42Å; S62-V65 PolarHBondContact O-N 2.85Å; L63-V65 VanDerWaalsContact C-N 3.26Å; L63-V65 PolarHBondContact O-N 3.08Å; V65-L67 VanDerWaalsContact C-N 3.32Å; V65-L67 PolarHBondContact O-N 3.08Å; V65-I68 PolarHBondContact O-N 3.07Å; V65-K69 HydrophobicContact CG1-CD 4.35Å; V65-K69 WeakPolarHBondContact O-CG 3.49Å; V65-K69 PolarHBondContact O-N 3.34Å; V65-K69 VanDerWaalsContact O-N 3.12Å; V65-M162 HydrophobicContact CG1-CG 4.23Å; V65-M162 HydrophobicContact CG2-CE 4.12Å; V65-M162 HydrophobicContact CG2-CG 3.64Å; V65-M162 HydrophobicContact CG2-SD 3.29Å; V65-M162 WeakPolarHBondContact CG2-SD 3.41Å
66E87.8Confident78.5Confident80 Ų8053.1 Ų53.137%0.37427%0.267SS..Hα-helixtrans-65.6-35.4177.4-67.3-52123.200112.2P31 S62 L63 I68 K69P31-E66 HydrophobicContact CB-CB 4.01Å; P31-E66 HydrophobicContact CG-CB 3.65Å; S62-E66 WeakPolarHBondContact O-CG 3.49Å; S62-E66 PolarHBondContact O-N 3.31Å; S62-E66 VanDerWaalsContact O-N 3.08Å; L63-E66 PolarHBondContact O-N 3.37Å; E66-I68 VanDerWaalsContact C-N 3.34Å; E66-I68 PolarHBondContact O-N 3.02Å; E66-K69 PolarHBondContact O-N 3.23Å; E66-K69 IonicContact OE1-NZ 3.43Å; E66-K69 PolarHBondContact OE1-NZ 3.37Å
67L88.5Confident78.7Confident0 Ų059.4 Ų59.40%030%0.3CS..Hα-helixtrans-64.4-37.7172.8-68.4169.7000112.5P31 A37 C40 F44 L63 L64 V65 K69 Q70 A136P31-L67 HydrophobicContact CG-CD2 4.13Å; P31-L67 HydrophobicContact CG-CG 4.35Å; A37-L67 HydrophobicContact CB-CD2 3.68Å; C40-L67 HydrophobicContact CB-CD1 4.11Å; C40-L67 HydrophobicContact CB-CD2 4.46Å; F44-L67 HydrophobicContact CD2-CD1 3.82Å; F44-L67 HydrophobicContact CE2-CD1 3.8Å; L63-L67 HydrophobicContact CD1-CD1 4.3Å; L63-L67 HydrophobicContact CD1-CG 4.25Å; L63-L67 HydrophobicContact CG-CD1 4.23Å; L63-L67 WeakPolarHBondContact O-CG 3.49Å; L63-L67 PolarHBondContact O-N 3.07Å; L64-L67 PolarHBondContact O-N 3.3Å; V65-L67 VanDerWaalsContact C-N 3.32Å; V65-L67 PolarHBondContact O-N 3.08Å; L67-K69 VanDerWaalsContact C-N 3.31Å; L67-K69 PolarHBondContact O-N 2.82Å; L67-Q70 PolarHBondContact O-N 3.12Å; L67-A136 HydrophobicContact CB-CB 3.92Å
68I82.5Confident79Confident8 Ų863.4 Ų63.44%0.04132%0.318CS..Hα-helixtrans-65.8-35.7176.8-72.2167.1000111.3L64 V65 E66 Q70 A136 L137 L140 M162 F165L64-I68 HydrophobicContact CG-CD1 4.28Å; L64-I68 VanDerWaalsContact O-CG1 3.29Å; L64-I68 WeakPolarHBondContact O-CG1 3.39Å; L64-I68 PolarHBondContact O-N 2.91Å; L64-I68 VanDerWaalsContact O-N 3.07Å; V65-I68 PolarHBondContact O-N 3.07Å; E66-I68 VanDerWaalsContact C-N 3.34Å; E66-I68 PolarHBondContact O-N 3.02Å; I68-Q70 PolarHBondContact O-N 3.44Å; I68-A136 HydrophobicContact CG1-CB 3.62Å; I68-L137 HydrophobicContact CD1-CD1 4.29Å; I68-L137 HydrophobicContact CG1-CB 4.49Å; I68-L137 HydrophobicContact CG2-CD1 4.08Å; I68-L140 HydrophobicContact CD1-CB 4.13Å; I68-L140 HydrophobicContact CD1-CD2 3.72Å; I68-M162 HydrophobicContact CD1-CE 4.42Å; I68-F165 HydrophobicContact CG2-CD1 3.67Å; I68-F165 HydrophobicContact CG2-CE1 3.23Å; I68-F165 HydrophobicContact CG2-CZ 3.84Å; I68-F165 VanDerWaalsContact O-CZ 3.23Å; I68-F165 WeakPolarHBondContact O-CZ 3.47Å
69K81Confident79.4Confident72 Ų7256.8 Ų56.831%0.31329%0.288SS..THydrogen-bonded Turntrans-72.2-12.6-178-72.2172.2-176.51690114.5V65 E66 L67 Q71 F165V65-K69 HydrophobicContact CG1-CD 4.35Å; V65-K69 WeakPolarHBondContact O-CG 3.49Å; V65-K69 PolarHBondContact O-N 3.34Å; V65-K69 VanDerWaalsContact O-N 3.12Å; E66-K69 PolarHBondContact O-N 3.23Å; E66-K69 IonicContact OE1-NZ 3.43Å; E66-K69 PolarHBondContact OE1-NZ 3.37Å; L67-K69 VanDerWaalsContact C-N 3.31Å; L67-K69 PolarHBondContact O-N 2.82Å; K69-Q71 VanDerWaalsContact O-CG 3.31Å; K69-Q71 WeakPolarHBondContact O-CG 3.45Å; K69-Q71 PolarHBondContact O-N 3.2Å; K69-F165 HydrophobicContact CB-CE2 4.29Å; K69-F165 HydrophobicContact CG-CD2 3.92Å; K69-F165 HydrophobicContact CG-CE2 4.04Å
70Q79.8Confident79.2Confident33 Ų3357.8 Ų57.815%0.15429%0.293CS..  trans-62124.6-179.3-78.3-128.1-53.500112P31 L67 I68 N130P31-Q70 PolarHBondContact O-NE2 3.08Å; L67-Q70 PolarHBondContact O-N 3.12Å; I68-Q70 PolarHBondContact O-N 3.44Å; Q70-N130 PolarHBondContact OE1-ND2 2.96Å
71Q67.7Low79.1Confident118 Ų11862.2 Ų62.255%0.55131%0.313SS*.  trans-99.6-35.7-169.2-53-168.916.600113.8K69 R169K69-Q71 VanDerWaalsContact O-CG 3.31Å; K69-Q71 WeakPolarHBondContact O-CG 3.45Å; K69-Q71 PolarHBondContact O-N 3.2Å; Q71-R169 VanDerWaalsContact CG-NH2 3.29Å
72S65.4Low79.3Confident60 Ų6062.9 Ų62.942%0.4232%0.318SS..  trans-149.2135.4-177.751.50000109.7
73A62.4Low79.2Confident23 Ų2361.1 Ų61.119%0.1930%0.303CS..  trans-96.8137.2170.800000109.7D34 R75 Y79 N130D34-A73 HydrophobicContact CB-CB 4.05Å; A73-R75 PolarHBondContact O-N 2.94Å; A73-Y79 HydrophobicContact CB-CD2 4.19Å; A73-Y79 HydrophobicContact CB-CE1 4.04Å; A73-Y79 HydrophobicContact CB-CE2 3.57Å; A73-Y79 VanDerWaalsContact CB-CZ 3.48Å; A73-N130 HydrophobicContact CB-CB 4.44Å
74E62.1Low78.8Confident149 Ų14966.1 Ų66.170%0.69633%0.326SS*.  trans-64.3121.3168.2-150.6174.5-151.100108.9D34 S76D34-E74 VanDerWaalsContact OD2-CB 3.23Å; D34-E74 WeakPolarHBondContact OD2-CB 3.34Å; D34-E74 PolarHBondContact OD2-N 3.02Å; E74-S76 PolarHBondContact O-N 3.33Å
75R67.3Low78.8Confident192 Ų19272.3 Ų72.373%0.72535%0.353SS*.  trans-78.454.4-176.8-64.9-177.2-178.1178.9-0.1111.5A73A73-R75 PolarHBondContact O-N 2.94Å
76S76.8Confident79.1Confident45 Ų4571.5 Ų71.532%0.31535%0.348SS..  trans-65.7155.5172.366.80000110.7E74 Q78 Y79 T80E74-S76 PolarHBondContact O-N 3.33Å; S76-Q78 PolarHBondContact O-N 3.24Å; S76-Y79 WeakPolarHBondContact O-CB 3.33Å; S76-Y79 PolarHBondContact O-N 3.17Å; S76-Y79 VanDerWaalsContact O-N 3.15Å; S76-Y79 WeakPolarHBondContact OG-CB 3.44Å; S76-Y79 PolarHBondContact OG-N 3.48Å; S76-Y79 VanDerWaalsContact OG-N 3.11Å; S76-T80 PolarHBondContact O-N 2.97Å; S76-T80 PolarHBondContact O-OG1 2.73Å
77L80.1Confident79.1Confident138 Ų13869.6 Ų69.672%0.72334%0.337SS*.Hα-helixtrans-54.9-43.5172.8-169.377.8000110.6Y79 T80 E81L77-Y79 VanDerWaalsContact C-N 3.31Å; L77-Y79 PolarHBondContact O-N 3.23Å; L77-T80 PolarHBondContact O-N 3.32Å; L77-T80 VanDerWaalsContact O-N 3.12Å; L77-E81 PolarHBondContact O-N 3.5Å
78Q84.1Confident79Confident132 Ų13275.9 Ų75.962%0.61736%0.364SS*.Hα-helixtrans-62.2-37.2178.9-167.6176.8700112.6V35 S76 C82V35-Q78 HydrophobicContact CG2-CG 4.31Å; S76-Q78 PolarHBondContact O-N 3.24Å; Q78-C82 VanDerWaalsContact O-CB 3.25Å; Q78-C82 WeakPolarHBondContact O-CB 3.35Å; Q78-C82 PolarHBondContact O-N 2.79Å
79Y83.5Confident79.3Confident6 Ų676.1 Ų76.12%0.02437%0.366CS..Hα-helixtrans-61.5-45.1173.6-174-92.5000111.4D34 V35 M38 A73 S76 L77 C82 K83 N130 Q131D34-Y79 HydrophobicContact CB-CD2 3.75Å; D34-Y79 HydrophobicContact CB-CE2 3.87Å; V35-Y79 HydrophobicContact CG2-CD2 4.27Å; M38-Y79 HydrophobicContact CB-CE2 4.39Å; M38-Y79 HydrophobicContact CE-CD2 4.19Å; M38-Y79 HydrophobicContact CE-CE2 3.98Å; M38-Y79 HydrophobicContact SD-CE2 4.12Å; A73-Y79 HydrophobicContact CB-CD2 4.19Å; A73-Y79 HydrophobicContact CB-CE1 4.04Å; A73-Y79 HydrophobicContact CB-CE2 3.57Å; A73-Y79 VanDerWaalsContact CB-CZ 3.48Å; S76-Y79 WeakPolarHBondContact O-CB 3.33Å; S76-Y79 PolarHBondContact O-N 3.17Å; S76-Y79 VanDerWaalsContact O-N 3.15Å; S76-Y79 WeakPolarHBondContact OG-CB 3.44Å; S76-Y79 PolarHBondContact OG-N 3.48Å; S76-Y79 VanDerWaalsContact OG-N 3.11Å; L77-Y79 VanDerWaalsContact C-N 3.31Å; L77-Y79 PolarHBondContact O-N 3.23Å; Y79-C82 PolarHBondContact O-N 3.16Å; Y79-K83 HydrophobicContact CE1-CD 4.46Å; Y79-K83 VanDerWaalsContact O-CB 3.29Å; Y79-K83 WeakPolarHBondContact O-CB 3.37Å; Y79-K83 PolarHBondContact O-N 3.38Å; Y79-N130 PolarHBondContact OH-OD1 3.1Å; Y79-Q131 PolarHBondContact OH-OE1 3.47Å
80T80.1Confident79.6Confident63 Ų6372.7 Ų72.739%0.38735%0.351SS..Hα-helixtrans-65.8-43.6-179.5-50.70000111.9S76 L77 C82 K83 E84S76-T80 PolarHBondContact O-N 2.97Å; S76-T80 PolarHBondContact O-OG1 2.73Å; L77-T80 PolarHBondContact O-N 3.32Å; L77-T80 VanDerWaalsContact O-N 3.12Å; T80-C82 PolarHBondContact O-N 3.11Å; T80-K83 WeakPolarHBondContact O-CB 3.44Å; T80-K83 PolarHBondContact O-N 2.99Å; T80-E84 PolarHBondContact O-N 3.19Å
81E85.3Confident79.9Confident94 Ų9473.5 Ų73.544%0.43936%0.36SS..Hα-helixtrans-64-39.7174.7-70.3-176-176.700112.8L77 K83 K85L77-E81 PolarHBondContact O-N 3.5Å; E81-K83 VanDerWaalsContact C-N 3.3Å; E81-K85 WeakPolarHBondContact O-CG 3.25Å; E81-K85 PolarHBondContact O-N 2.82Å; E81-K85 VanDerWaalsContact O-N 3.17Å
82C85.9Confident81Confident18 Ų1871.1 Ų71.112%0.12235%0.348CS..Hα-helixtrans-65.1-39.1178.2-1710000111.2V35 M38 Q78 Y79 T80 K85 I86V35-C82 HydrophobicContact CG1-CB 3.76Å; M38-C82 HydrophobicContact CE-CB 3.67Å; Q78-C82 VanDerWaalsContact O-CB 3.25Å; Q78-C82 WeakPolarHBondContact O-CB 3.35Å; Q78-C82 PolarHBondContact O-N 2.79Å; Y79-C82 PolarHBondContact O-N 3.16Å; T80-C82 PolarHBondContact O-N 3.11Å; C82-K85 PolarHBondContact O-N 3.15Å; C82-I86 WeakPolarHBondContact O-CB 3.36Å; C82-I86 WeakPolarHBondContact O-CG1 3.41Å; C82-I86 PolarHBondContact O-N 3.42Å
83K82.3Confident82.2Confident27 Ų2768.4 Ų68.412%0.11733%0.329CS..Hα-helixtrans-58.8-48.6178.1-171.9-173.6-159.2179.90111.8M38 Y79 T80 E81 K85 I86 W87 I116 I117 Q131M38-K83 HydrophobicContact CE-CB 3.97Å; M38-K83 HydrophobicContact SD-CB 4.06Å; M38-K83 HydrophobicContact SD-CG 4.25Å; Y79-K83 HydrophobicContact CE1-CD 4.46Å; Y79-K83 VanDerWaalsContact O-CB 3.29Å; Y79-K83 WeakPolarHBondContact O-CB 3.37Å; Y79-K83 PolarHBondContact O-N 3.38Å; T80-K83 WeakPolarHBondContact O-CB 3.44Å; T80-K83 PolarHBondContact O-N 2.99Å; E81-K83 VanDerWaalsContact C-N 3.3Å; K83-K85 PolarHBondContact O-N 3.33Å; K83-I86 PolarHBondContact O-N 3.22Å; K83-W87 PolarHBondContact O-N 2.89Å; K83-I116 WeakPolarHBondContact CD-O 3.42Å; K83-I116 WeakPolarHBondContact CE-O 3.29Å; K83-I116 WeakPolarHBondContact CG-O 3.33Å; K83-I117 VanDerWaalsContact CE-CA 3.42Å; K83-I117 WeakPolarHBondContact CE-O 3.43Å; K83-I117 PolarHBondContact NZ-O 3.12Å; K83-Q131 VanDerWaalsContact CE-CD 3.47Å; K83-Q131 VanDerWaalsContact CE-NE2 3.25Å
84E82.9Confident83.3Confident112 Ų11271.6 Ų71.652%0.52334%0.336SS..Hα-helixtrans-62.6-41.4175.9-69-178.4176.600112T80 W87 K88T80-E84 PolarHBondContact O-N 3.19Å; E84-W87 PolarHBondContact O-N 2.71Å; E84-K88 PolarHBondContact O-N 2.72Å; E84-K88 VanDerWaalsContact O-N 3.08Å
85K87.7Confident84.4Confident130 Ų13067.2 Ų67.257%0.56533%0.326SS*.Hα-helixtrans-63.2-42.7176-73171.8-174.9163.40111.9E81 C82 K83 K88 I89E81-K85 WeakPolarHBondContact O-CG 3.25Å; E81-K85 PolarHBondContact O-N 2.82Å; E81-K85 VanDerWaalsContact O-N 3.17Å; C82-K85 PolarHBondContact O-N 3.15Å; K83-K85 PolarHBondContact O-N 3.33Å; K85-K88 PolarHBondContact O-N 3.15Å; K85-I89 VanDerWaalsContact O-CG1 3.3Å; K85-I89 WeakPolarHBondContact O-CG1 3.37Å; K85-I89 PolarHBondContact O-N 3.39Å
86I88.4Confident85.4Confident2 Ų262 Ų621%0.0131%0.308CS..Hα-helixtrans-63.8-42.9177.2-77.8177.9000111M38 C42 C82 K83 K88 I89 L90 M135M38-I86 HydrophobicContact CB-CD1 4.17Å; M38-I86 HydrophobicContact CE-CD1 4Å; M38-I86 HydrophobicContact CG-CD1 3.6Å; M38-I86 HydrophobicContact SD-CD1 4.16Å; C42-I86 HydrophobicContact CB-CD1 4.29Å; C42-I86 HydrophobicContact CB-CG2 4.11Å; C82-I86 WeakPolarHBondContact O-CB 3.36Å; C82-I86 WeakPolarHBondContact O-CG1 3.41Å; C82-I86 PolarHBondContact O-N 3.42Å; K83-I86 PolarHBondContact O-N 3.22Å; I86-K88 VanDerWaalsContact C-N 3.33Å; I86-K88 PolarHBondContact O-N 3.11Å; I86-I89 WeakPolarHBondContact O-CB 3.23Å; I86-I89 PolarHBondContact O-N 2.95Å; I86-L90 HydrophobicContact CG2-CD1 3.94Å; I86-L90 HydrophobicContact CG2-CG 4.43Å; I86-L90 WeakPolarHBondContact O-CG 3.39Å; I86-L90 PolarHBondContact O-N 2.93Å; I86-M135 HydrophobicContact CG2-CE 4.47Å; I86-M135 HydrophobicContact CG2-SD 4.4Å
87W86.6Confident85.7Confident39 Ų3961.1 Ų61.115%0.14830%0.301CS..Hα-helixtrans-56.4-48.9175.1179.8-114.1000111.6K83 E84 I89 L90 C91 F109 T112 E113 I116 I117K83-W87 PolarHBondContact O-N 2.89Å; E84-W87 PolarHBondContact O-N 2.71Å; W87-I89 VanDerWaalsContact C-N 3.33Å; W87-I89 PolarHBondContact O-N 2.87Å; W87-L90 PolarHBondContact O-N 3.37Å; W87-L90 VanDerWaalsContact O-N 3.15Å; W87-C91 VanDerWaalsContact CE2-SG 3.56Å; W87-C91 PolarHBondContact O-N 3.11Å; W87-C91 PolarHBondContact O-SG 3.34Å; W87-F109 HydrophobicContact CH2-CE1 4.18Å; W87-F109 HydrophobicContact CZ3-CE1 4.28Å; W87-T112 WeakPolarHBondContact CZ3-O 3.21Å; W87-E113 HydrophobicContact CH2-CB 4.1Å; W87-E113 HydrophobicContact CZ2-CB 3.56Å; W87-E113 HydrophobicContact CZ2-CG 4.14Å; W87-I116 HydrophobicContact CB-CG2 4.41Å; W87-I116 HydrophobicContact CE3-CB 3.66Å; W87-I116 HydrophobicContact CE3-CD1 3.73Å; W87-I116 HydrophobicContact CE3-CG1 3.93Å; W87-I116 HydrophobicContact CE3-CG2 4.05Å; W87-I116 HydrophobicContact CZ3-CB 4.06Å; W87-I116 HydrophobicContact CZ3-CD1 3.8Å; W87-I116 HydrophobicContact CZ3-CG1 3.91Å; W87-I117 HydrophobicContact CB-CD1 3.97Å; W87-I117 HydrophobicContact CB-CG1 4.05Å; W87-I117 HydrophobicContact CD2-CD1 4.39Å; W87-I117 HydrophobicContact CD2-CG1 4.4Å; W87-I117 HydrophobicContact CG-CD1 3.72Å; W87-I117 HydrophobicContact CG-CG1 4.01Å
88K86.8Confident85.8Confident132 Ų13257.5 Ų57.557%0.57428%0.28SS*.Hα-helixtrans-58.7-44.3177.5-173.5175.6178.6177.50112.1E84 K85 I86 L90 C91 E92E84-K88 PolarHBondContact O-N 2.72Å; E84-K88 VanDerWaalsContact O-N 3.08Å; K85-K88 PolarHBondContact O-N 3.15Å; I86-K88 VanDerWaalsContact C-N 3.33Å; I86-K88 PolarHBondContact O-N 3.11Å; K88-L90 VanDerWaalsContact C-N 3.33Å; K88-L90 PolarHBondContact O-N 3.2Å; K88-C91 PolarHBondContact O-N 3.36Å; K88-E92 WeakPolarHBondContact CE-OE1 3.5Å; K88-E92 WeakPolarHBondContact O-CG 3.35Å; K88-E92 PolarHBondContact O-N 3.17Å
89I89.1Confident85.7Confident14 Ų1455.5 Ų55.57%0.07228%0.281CS..Hα-helixtrans-59.1-44.2176.5-72.9165.9000111.3L2 V6 I46 K85 I86 W87 E92 W93L2-I89 HydrophobicContact CB-CD1 4.07Å; V6-I89 HydrophobicContact CG2-CG2 3.93Å; I46-I89 HydrophobicContact CD1-CG2 4.29Å; K85-I89 VanDerWaalsContact O-CG1 3.3Å; K85-I89 WeakPolarHBondContact O-CG1 3.37Å; K85-I89 PolarHBondContact O-N 3.39Å; I86-I89 WeakPolarHBondContact O-CB 3.23Å; I86-I89 PolarHBondContact O-N 2.95Å; W87-I89 VanDerWaalsContact C-N 3.33Å; W87-I89 PolarHBondContact O-N 2.87Å; I89-E92 PolarHBondContact O-N 3.11Å; I89-W93 VanDerWaalsContact O-CB 3.28Å; I89-W93 WeakPolarHBondContact O-CB 3.48Å; I89-W93 PolarHBondContact O-N 3.07Å
90L87.6Confident85.4Confident0 Ų061.1 Ų61.10%031%0.311CS..Hα-helixtrans-66.8-39.9179.8-73.2171000112Y45 I46 I86 W87 K88 W93 R94 F109 L111 I116 M135Y45-L90 HydrophobicContact CD1-CD2 3.65Å; Y45-L90 HydrophobicContact CE1-CD2 3.91Å; I46-L90 HydrophobicContact CD1-CD2 4.33Å; I46-L90 HydrophobicContact CG1-CD2 4.05Å; I86-L90 HydrophobicContact CG2-CD1 3.94Å; I86-L90 HydrophobicContact CG2-CG 4.43Å; I86-L90 WeakPolarHBondContact O-CG 3.39Å; I86-L90 PolarHBondContact O-N 2.93Å; W87-L90 PolarHBondContact O-N 3.37Å; W87-L90 VanDerWaalsContact O-N 3.15Å; K88-L90 VanDerWaalsContact C-N 3.33Å; K88-L90 PolarHBondContact O-N 3.2Å; L90-W93 PolarHBondContact O-N 2.94Å; L90-R94 VanDerWaalsContact O-CB 3.27Å; L90-R94 WeakPolarHBondContact O-CB 3.28Å; L90-R94 PolarHBondContact O-N 2.9Å; L90-F109 HydrophobicContact CB-CZ 4.19Å; L90-L111 HydrophobicContact CD1-CD1 4.46Å; L90-I116 HydrophobicContact CD1-CD1 3.31Å; L90-M135 HydrophobicContact CD1-SD 4.18Å
91C86.7Confident85.1Confident50 Ų5061 Ų6134%0.33831%0.308SS..Hα-helixtrans-61.8-46.4173.7-71.70000111.9W87 K88 R94 A95W87-C91 VanDerWaalsContact CE2-SG 3.56Å; W87-C91 PolarHBondContact O-N 3.11Å; W87-C91 PolarHBondContact O-SG 3.34Å; K88-C91 PolarHBondContact O-N 3.36Å; C91-R94 PolarHBondContact O-N 3.11Å; C91-A95 WeakPolarHBondContact O-CB 3.45Å; C91-A95 PolarHBondContact O-N 3.38Å
92E90.4Very high84.2Confident67 Ų6759.3 Ų59.331%0.31331%0.307SS..Hα-helixtrans-64-42.4177-72.5176.4-169.800112.1Q3 V6 K88 I89 K96Q3-E92 PolarHBondContact NE2-OE2 2.95Å; V6-E92 HydrophobicContact CG1-CB 4.27Å; V6-E92 HydrophobicContact CG2-CB 4.49Å; K88-E92 WeakPolarHBondContact CE-OE1 3.5Å; K88-E92 WeakPolarHBondContact O-CG 3.35Å; K88-E92 PolarHBondContact O-N 3.17Å; I89-E92 PolarHBondContact O-N 3.11Å; E92-K96 PolarHBondContact O-N 2.83Å; E92-K96 VanDerWaalsContact O-N 3.11Å
93W90.5Very high82.9Confident3 Ų362.9 Ų62.91%0.01134%0.337CS..Hα-helixtrans-58.9-51.7173.5169.578.7000111.1V6 Y45 I46 R49 I89 L90 A95 K96 V97 F109V6-W93 HydrophobicContact CG2-CB 4.26Å; Y45-W93 HydrophobicContact CE1-CH2 4.35Å; Y45-W93 AromaticContact CE1-CZ3 3.93Å; Y45-W93 HydrophobicContact CE1-CZ3 3.93Å; I46-W93 HydrophobicContact CG1-CD2 4.29Å; I46-W93 HydrophobicContact CG1-CG 4.31Å; R49-W93 HydrophobicContact CB-CH2 3.92Å; R49-W93 HydrophobicContact CB-CZ2 4Å; R49-W93 HydrophobicContact CG-CH2 4.46Å; I89-W93 VanDerWaalsContact O-CB 3.28Å; I89-W93 WeakPolarHBondContact O-CB 3.48Å; I89-W93 PolarHBondContact O-N 3.07Å; L90-W93 PolarHBondContact O-N 2.94Å; W93-A95 VanDerWaalsContact C-N 3.35Å; W93-A95 PolarHBondContact O-N 3.14Å; W93-K96 PolarHBondContact O-N 3.43Å; W93-V97 HydrophobicContact CD2-CG2 4.26Å; W93-V97 HydrophobicContact CG-CG2 4.41Å; W93-V97 HydrophobicContact CZ2-CG2 4.12Å; W93-V97 WeakPolarHBondContact O-CG2 3.27Å; W93-V97 PolarHBondContact O-N 2.98Å; W93-F109 HydrophobicContact CE3-CE2 4.32Å; W93-F109 HydrophobicContact CZ3-CD2 4.09Å; W93-F109 AromaticContact CZ3-CE2 3.93Å; W93-F109 HydrophobicContact CZ3-CE2 3.93Å
94R84.9Confident81.6Confident90 Ų9071.3 Ų71.334%0.3437%0.374SS..Hα-helixtrans-56.1-49.6179.9-178.9-173.7176-172.7-3.1111.2L90 C91 K96 V97 E98 F109L90-R94 VanDerWaalsContact O-CB 3.27Å; L90-R94 WeakPolarHBondContact O-CB 3.28Å; L90-R94 PolarHBondContact O-N 2.9Å; C91-R94 PolarHBondContact O-N 3.11Å; R94-K96 VanDerWaalsContact C-N 3.32Å; R94-K96 PolarHBondContact O-N 3.39Å; R94-V97 PolarHBondContact O-N 2.83Å; R94-V97 VanDerWaalsContact O-N 3.11Å; R94-E98 HydrophobicContact CG-CG 4.31Å; R94-E98 IonicContact CZ-OE1 3.57Å; R94-E98 IonicContact NE-OE1 3.61Å; R94-E98 PolarHBondContact NE-OE1 2.85Å; R94-E98 IonicContact NE-OE2 3.35Å; R94-E98 IonicContact NH2-OE1 3.85Å; R94-E98 PolarHBondContact NH2-OE1 3.23Å; R94-E98 WeakPolarHBondContact O-CB 3.45Å; R94-E98 WeakPolarHBondContact O-CG 3.19Å; R94-E98 PolarHBondContact O-N 3.37Å; R94-F109 HydrophobicContact CB-CD2 4.43Å; R94-F109 HydrophobicContact CB-CE2 4.43Å; R94-F109 HydrophobicContact CG-CD2 4.25Å; R94-F109 HydrophobicContact CG-CG 4.36Å
95A86.3Confident80.3Confident58 Ų5871.3 Ų71.348%0.47937%0.374SS..Hα-helixtrans-58.2-43.5179.800000112C91 W93 S99C91-A95 WeakPolarHBondContact O-CB 3.45Å; C91-A95 PolarHBondContact O-N 3.38Å; W93-A95 VanDerWaalsContact C-N 3.35Å; W93-A95 PolarHBondContact O-N 3.14Å; A95-S99 WeakPolarHBondContact O-CB 3.45Å; A95-S99 PolarHBondContact O-N 2.91Å; A95-S99 PolarHBondContact O-OG 3.33Å
96K88Confident78.6Confident82 Ų8274.9 Ų74.936%0.35738%0.384SS..Hα-helixtrans-67.4-34.2175.6-80-163.3-171170.70113.5V6 D7 E92 W93 R94 S99 N100V6-K96 HydrophobicContact CG1-CD 3.71Å; V6-K96 HydrophobicContact CG1-CG 4.36Å; D7-K96 IonicContact OD1-NZ 2.68Å; D7-K96 PolarHBondContact OD1-NZ 3.19Å; D7-K96 IonicContact OD2-NZ 2.64Å; E92-K96 PolarHBondContact O-N 2.83Å; E92-K96 VanDerWaalsContact O-N 3.11Å; W93-K96 PolarHBondContact O-N 3.43Å; R94-K96 VanDerWaalsContact C-N 3.32Å; R94-K96 PolarHBondContact O-N 3.39Å; K96-S99 PolarHBondContact O-OG 3.3Å; K96-N100 PolarHBondContact O-ND2 3.33Å
97V82.7Confident77.1Confident26 Ų2676.5 Ų76.516%0.15839%0.392CS..Hα-helixtrans-73.7-44.9178.4-1730000110.1W93 R94 S99 N100 L101 I107W93-V97 HydrophobicContact CD2-CG2 4.26Å; W93-V97 HydrophobicContact CG-CG2 4.41Å; W93-V97 HydrophobicContact CZ2-CG2 4.12Å; W93-V97 WeakPolarHBondContact O-CG2 3.27Å; W93-V97 PolarHBondContact O-N 2.98Å; R94-V97 PolarHBondContact O-N 2.83Å; R94-V97 VanDerWaalsContact O-N 3.11Å; V97-S99 VanDerWaalsContact C-N 3.31Å; V97-S99 PolarHBondContact O-N 3.46Å; V97-N100 PolarHBondContact O-N 3Å; V97-N100 VanDerWaalsContact O-N 3.11Å; V97-L101 HydrophobicContact CG1-CD1 3.85Å; V97-L101 WeakPolarHBondContact O-CD1 3.48Å; V97-L101 PolarHBondContact O-N 2.95Å; V97-I107 HydrophobicContact CB-CD1 3.93Å; V97-I107 HydrophobicContact CG1-CD1 3.15Å
98E81.6Confident75.6Confident63 Ų6378.9 Ų78.929%0.29441%0.411SS..Hα-helixtrans-62-35.8176.6-72.8180170.700112.3R94 N100 L101R94-E98 HydrophobicContact CG-CG 4.31Å; R94-E98 IonicContact CZ-OE1 3.57Å; R94-E98 IonicContact NE-OE1 3.61Å; R94-E98 PolarHBondContact NE-OE1 2.85Å; R94-E98 IonicContact NE-OE2 3.35Å; R94-E98 IonicContact NH2-OE1 3.85Å; R94-E98 PolarHBondContact NH2-OE1 3.23Å; R94-E98 WeakPolarHBondContact O-CB 3.45Å; R94-E98 WeakPolarHBondContact O-CG 3.19Å; R94-E98 PolarHBondContact O-N 3.37Å; E98-N100 PolarHBondContact O-N 2.9Å; E98-L101 PolarHBondContact O-N 3.42Å; E98-L101 VanDerWaalsContact O-N 3.15Å
99S83.2Confident74.1Confident90 Ų9073.9 Ų73.963%0.62939%0.389SS*.THydrogen-bonded Turntrans-65-21.3176.372.50000114A95 K96 V97A95-S99 WeakPolarHBondContact O-CB 3.45Å; A95-S99 PolarHBondContact O-N 2.91Å; A95-S99 PolarHBondContact O-OG 3.33Å; K96-S99 PolarHBondContact O-OG 3.3Å; V97-S99 VanDerWaalsContact C-N 3.31Å; V97-S99 PolarHBondContact O-N 3.46Å
100N77.2Confident72.7Confident123 Ų12376.1 Ų76.166%0.65840%0.401SS*.THydrogen-bonded Turntrans-96.5-2.3179.3-70.9-46.8000112.8K96 V97 E98K96-N100 PolarHBondContact O-ND2 3.33Å; V97-N100 PolarHBondContact O-N 3Å; V97-N100 VanDerWaalsContact O-N 3.11Å; E98-N100 PolarHBondContact O-N 2.9Å
101L72.8Confident71.4Confident60 Ų6076.3 Ų76.331%0.31440%0.402SS..SBendtrans-104.3149.6-179.9-76155.4000110.2V97 E98 E105 I107V97-L101 HydrophobicContact CG1-CD1 3.85Å; V97-L101 WeakPolarHBondContact O-CD1 3.48Å; V97-L101 PolarHBondContact O-N 2.95Å; E98-L101 PolarHBondContact O-N 3.42Å; E98-L101 VanDerWaalsContact O-N 3.15Å; L101-E105 HydrophobicContact CB-CB 4.24Å; L101-E105 VanDerWaalsContact CB-O 3.3Å; L101-E105 WeakPolarHBondContact CB-O 3.44Å; L101-E105 WeakPolarHBondContact CD1-O 3.42Å; L101-E105 HydrophobicContact CD2-CB 3.7Å; L101-I107 HydrophobicContact CD1-CD1 3.62Å; L101-I107 HydrophobicContact CD1-CG1 3.64Å
102S66.2Low70.2Confident60 Ų6076.9 Ų76.942%0.4240%0.404SS..  trans-67.1154.9170.969.40000110K104 E105S102-K104 PolarHBondContact O-N 3.09Å; S102-E105 PolarHBondContact N-OE2 3.39Å; S102-E105 PolarHBondContact O-N 2.64Å; S102-E105 WeakPolarHBondContact OG-CG 3.35Å; S102-E105 PolarHBondContact OG-OE2 3.45Å
103A59.6Low68.8Low92 Ų9279.1 Ų79.176%0.7642%0.415SS*.THydrogen-bonded Turntrans-56.9-18-178.600000114.3
104K54.7Low67.4Low204 Ų20484.1 Ų84.189%0.88744%0.438SS*.THydrogen-bonded Turntrans-85.6-16.5176.1-68.6-174177.2-177.30113.8S102S102-K104 PolarHBondContact O-N 3.09Å
105E56Low66.3Low113 Ų11380.4 Ų80.453%0.52843%0.425SS..  trans-10963.5-177-62.2167130.500109.6L101 S102L101-E105 HydrophobicContact CB-CB 4.24Å; L101-E105 VanDerWaalsContact CB-O 3.3Å; L101-E105 WeakPolarHBondContact CB-O 3.44Å; L101-E105 WeakPolarHBondContact CD1-O 3.42Å; L101-E105 HydrophobicContact CD2-CB 3.7Å; S102-E105 PolarHBondContact N-OE2 3.39Å; S102-E105 PolarHBondContact O-N 2.64Å; S102-E105 WeakPolarHBondContact OG-CG 3.35Å; S102-E105 PolarHBondContact OG-OE2 3.45Å
106R52.4Low65Low204 Ų20477.7 Ų77.777%0.7740%0.402SS*.  trans-77.3138.3172.7-68.4-167.6-167.2-170.93110.4
107I55.2Low63.4Low37 Ų3775.7 Ų75.719%0.1940%0.395CS..  trans-77.7129.8170.1-64173.1000107.9V97 L101 F109V97-I107 HydrophobicContact CB-CD1 3.93Å; V97-I107 HydrophobicContact CG1-CD1 3.15Å; L101-I107 HydrophobicContact CD1-CD1 3.62Å; L101-I107 HydrophobicContact CD1-CG1 3.64Å; I107-F109 PolarHBondContact O-N 3.41Å; I107-F109 VanDerWaalsContact O-N 3.1Å
108V55Low62.1Low88 Ų8875.5 Ų75.553%0.53340%0.399SS..  trans-68.9107.3168.8-174.50000107.7R49 D110R49-V108 PolarHBondContact NH1-O 3.33Å; R49-V108 PolarHBondContact NH2-O 3.25Å; V108-D110 WeakPolarHBondContact CG1-OD1 3.21Å; V108-D110 VanDerWaalsContact CG1-OD2 3.28Å; V108-D110 WeakPolarHBondContact CG1-OD2 3.46Å
109F56.8Low60.1Low27 Ų2775.1 Ų75.112%0.11841%0.407CS..  trans-105.293.4177.4-170.3-97.4000108.8Y45 W87 L90 W93 R94 I107 L111Y45-F109 HydrophobicContact CE1-CE2 4.01Å; W87-F109 HydrophobicContact CH2-CE1 4.18Å; W87-F109 HydrophobicContact CZ3-CE1 4.28Å; L90-F109 HydrophobicContact CB-CZ 4.19Å; W93-F109 HydrophobicContact CE3-CE2 4.32Å; W93-F109 HydrophobicContact CZ3-CD2 4.09Å; W93-F109 AromaticContact CZ3-CE2 3.93Å; W93-F109 HydrophobicContact CZ3-CE2 3.93Å; R94-F109 HydrophobicContact CB-CD2 4.43Å; R94-F109 HydrophobicContact CB-CE2 4.43Å; R94-F109 HydrophobicContact CG-CD2 4.25Å; R94-F109 HydrophobicContact CG-CG 4.36Å; I107-F109 PolarHBondContact O-N 3.41Å; I107-F109 VanDerWaalsContact O-N 3.1Å; F109-L111 VanDerWaalsContact C-N 3.32Å; F109-L111 HydrophobicContact CD1-CB 4.47Å; F109-L111 VanDerWaalsContact CD1-O 3.28Å; F109-L111 WeakPolarHBondContact CD1-O 3.09Å; F109-L111 HydrophobicContact CE1-CB 3.93Å; F109-L111 WeakPolarHBondContact CE1-O 3.42Å; F109-L111 HydrophobicContact CZ-CB 4.02Å
110D59Low58.1Low61 Ų6183 Ų8333%0.32642%0.422SS..  trans-83.6-7.1-172.3-71.8-53.7000114.3V108 T112 E138 K191V108-D110 WeakPolarHBondContact CG1-OD1 3.21Å; V108-D110 VanDerWaalsContact CG1-OD2 3.28Å; V108-D110 WeakPolarHBondContact CG1-OD2 3.46Å; D110-T112 PolarHBondContact O-N 2.93Å; D110-E138 WeakPolarHBondContact CB-OE1 3.39Å; D110-K191 IonicContact OD1-NZ 3.56Å
111L60.7Low56Low5 Ų581.6 Ų81.63%0.02642%0.418CS..  trans-81.6117.7177.3-67.1173.8000109.6Y45 L90 F109 I116 L134 M135Y45-L111 HydrophobicContact CD1-CD1 4.35Å; Y45-L111 HydrophobicContact CD2-CD1 3.99Å; Y45-L111 HydrophobicContact CE1-CD1 3.81Å; Y45-L111 HydrophobicContact CE2-CD1 3.38Å; Y45-L111 HydrophobicContact CE2-CG 4.17Å; Y45-L111 HydrophobicContact CG-CD1 4.42Å; Y45-L111 WeakPolarHBondContact OH-CD1 3.28Å; L90-L111 HydrophobicContact CD1-CD1 4.46Å; F109-L111 VanDerWaalsContact C-N 3.32Å; F109-L111 HydrophobicContact CD1-CB 4.47Å; F109-L111 VanDerWaalsContact CD1-O 3.28Å; F109-L111 WeakPolarHBondContact CD1-O 3.09Å; F109-L111 HydrophobicContact CE1-CB 3.93Å; F109-L111 WeakPolarHBondContact CE1-O 3.42Å; F109-L111 HydrophobicContact CZ-CB 4.02Å; L111-I116 HydrophobicContact CB-CD1 3.85Å; L111-I116 HydrophobicContact CB-CG1 4.12Å; L111-I116 HydrophobicContact CD1-CD1 3.66Å; L111-I116 HydrophobicContact CD1-CG1 4.48Å; L111-I116 HydrophobicContact CD2-CD1 4.26Å; L111-I116 HydrophobicContact CD2-CG1 4.21Å; L111-I116 HydrophobicContact CG-CD1 4.12Å; L111-I116 HydrophobicContact CG-CG1 4.49Å; L111-L134 HydrophobicContact CD2-CD2 3.71Å; L111-L134 HydrophobicContact CD2-CG 4.31Å; L111-M135 HydrophobicContact CD1-CG 4.1Å
112T60.5Low53.9Low62 Ų6288.2 Ų88.238%0.3845%0.445SS..  trans-93.9160.7172.764.20000110.4W87 D110 E114 N115 I116W87-T112 WeakPolarHBondContact CZ3-O 3.21Å; D110-T112 PolarHBondContact O-N 2.93Å; T112-E114 PolarHBondContact O-N 2.98Å; T112-N115 PolarHBondContact O-N 3.23Å; T112-N115 VanDerWaalsContact O-N 3.07Å; T112-N115 WeakPolarHBondContact OG1-CB 3.36Å; T112-N115 PolarHBondContact OG1-N 2.63Å; T112-N115 PolarHBondContact OG1-ND2 2.95Å; T112-N115 VanDerWaalsContact OG1-ND2 3.11Å; T112-N115 PolarHBondContact OG1-OD1 3.49Å; T112-I116 PolarHBondContact O-N 3.27Å
113E62.4Low52.1Low113 Ų11388.7 Ų88.753%0.52845%0.447SS..Hα-helixtrans-57.1-37.2172.5-169.8171.6176.200110.2W87 N115 I116 I117W87-E113 HydrophobicContact CH2-CB 4.1Å; W87-E113 HydrophobicContact CZ2-CB 3.56Å; W87-E113 HydrophobicContact CZ2-CG 4.14Å; E113-N115 PolarHBondContact O-N 3.32Å; E113-I116 PolarHBondContact O-N 2.93Å; E113-I117 HydrophobicContact CG-CB 4.16Å; E113-I117 HydrophobicContact CG-CD1 3.45Å; E113-I117 VanDerWaalsContact CG-CD1 3.45Å; E113-I117 HydrophobicContact CG-CG1 3.79Å; E113-I117 VanDerWaalsContact O-CA 3.32Å; E113-I117 WeakPolarHBondContact O-CA 3.29Å; E113-I117 WeakPolarHBondContact O-CB 3.26Å; E113-I117 PolarHBondContact O-N 3.49Å
114E59.3Low50.5Low108 Ų10891.8 Ų91.851%0.50545%0.45SS..Hα-helixtrans-64.5-39.1175-70177.5162.300112.9T112 G118T112-E114 PolarHBondContact O-N 2.98Å; E114-G118 WeakPolarHBondContact O-CA 3.27Å; E114-G118 PolarHBondContact O-N 2.97Å
115N62.7Low49.3Very low12 Ų1285.6 Ų85.66%0.06444%0.436CS..Hα-helixtrans-69.8-35.5179.1-66.1-18.3000112.3T112 E113 Q131 L134T112-N115 PolarHBondContact O-N 3.23Å; T112-N115 VanDerWaalsContact O-N 3.07Å; T112-N115 WeakPolarHBondContact OG1-CB 3.36Å; T112-N115 PolarHBondContact OG1-N 2.63Å; T112-N115 PolarHBondContact OG1-ND2 2.95Å; T112-N115 VanDerWaalsContact OG1-ND2 3.11Å; T112-N115 PolarHBondContact OG1-OD1 3.49Å; E113-N115 PolarHBondContact O-N 3.32Å; N115-Q131 WeakPolarHBondContact O-CG 3.33Å; N115-L134 HydrophobicContact CB-CD2 3.93Å
116I58.3Low48.1Very low1 Ų188.7 Ų88.71%0.00545%0.448CS..Hα-helixtrans-95-39.4-178.2-57.8-159.3000113.2K83 W87 L90 L111 T112 E113 Q131 M135K83-I116 WeakPolarHBondContact CD-O 3.42Å; K83-I116 WeakPolarHBondContact CE-O 3.29Å; K83-I116 WeakPolarHBondContact CG-O 3.33Å; W87-I116 HydrophobicContact CB-CG2 4.41Å; W87-I116 HydrophobicContact CE3-CB 3.66Å; W87-I116 HydrophobicContact CE3-CD1 3.73Å; W87-I116 HydrophobicContact CE3-CG1 3.93Å; W87-I116 HydrophobicContact CE3-CG2 4.05Å; W87-I116 HydrophobicContact CZ3-CB 4.06Å; W87-I116 HydrophobicContact CZ3-CD1 3.8Å; W87-I116 HydrophobicContact CZ3-CG1 3.91Å; L90-I116 HydrophobicContact CD1-CD1 3.31Å; L111-I116 HydrophobicContact CB-CD1 3.85Å; L111-I116 HydrophobicContact CB-CG1 4.12Å; L111-I116 HydrophobicContact CD1-CD1 3.66Å; L111-I116 HydrophobicContact CD1-CG1 4.48Å; L111-I116 HydrophobicContact CD2-CD1 4.26Å; L111-I116 HydrophobicContact CD2-CG1 4.21Å; L111-I116 HydrophobicContact CG-CD1 4.12Å; L111-I116 HydrophobicContact CG-CG1 4.49Å; T112-I116 PolarHBondContact O-N 3.27Å; E113-I116 PolarHBondContact O-N 2.93Å; I116-Q131 WeakPolarHBondContact O-CG 3.49Å; I116-M135 HydrophobicContact CD1-SD 4.49Å
117I56.3Low47.4Very low40 Ų4081.4 Ų81.421%0.20543%0.428CS..Hα-helixtrans-89.9-18.6-179.2-53.6-165.3000111.2K83 W87 E113K83-I117 VanDerWaalsContact CE-CA 3.42Å; K83-I117 WeakPolarHBondContact CE-O 3.43Å; K83-I117 PolarHBondContact NZ-O 3.12Å; W87-I117 HydrophobicContact CB-CD1 3.97Å; W87-I117 HydrophobicContact CB-CG1 4.05Å; W87-I117 HydrophobicContact CD2-CD1 4.39Å; W87-I117 HydrophobicContact CD2-CG1 4.4Å; W87-I117 HydrophobicContact CG-CD1 3.72Å; W87-I117 HydrophobicContact CG-CG1 4.01Å; E113-I117 HydrophobicContact CG-CB 4.16Å; E113-I117 HydrophobicContact CG-CD1 3.45Å; E113-I117 VanDerWaalsContact CG-CD1 3.45Å; E113-I117 HydrophobicContact CG-CG1 3.79Å; E113-I117 VanDerWaalsContact O-CA 3.32Å; E113-I117 WeakPolarHBondContact O-CA 3.29Å; E113-I117 WeakPolarHBondContact O-CB 3.26Å; E113-I117 PolarHBondContact O-N 3.49Å
118G54Low46.8Very low23 Ų2382.8 Ų82.824%0.23744%0.436CS..  trans67.6127.3-17000000109.1E114 R120E114-G118 WeakPolarHBondContact O-CA 3.27Å; E114-G118 PolarHBondContact O-N 2.97Å; G118-R120 PolarHBondContact O-N 3.07Å
119A40.7Very low46.6Very low55 Ų5579.3 Ų79.346%0.45542%0.415SS..  trans-52.1138.4163.900000107.9V121A119-V121 HydrophobicContact CB-CG2 3.86Å; A119-V121 PolarHBondContact O-N 3.49Å
120R40.8Very low47.2Very low255 Ų25578.2 Ų78.296%0.96241%0.41SS*.SBendtrans-58.215.1179.7-100.8-179.6163.5162-2.4114.5G118 F122G118-R120 PolarHBondContact O-N 3.07Å; R120-F122 PolarHBondContact O-N 3.22Å
121V32.3Very low47.9Very low94 Ų9476.6 Ų76.657%0.5740%0.4SS*.  trans-83.7125-167.2-168.30000109.9A119 C123A119-V121 HydrophobicContact CB-CG2 3.86Å; A119-V121 PolarHBondContact O-N 3.49Å; V121-C123 HydrophobicContact CG1-CB 4.43Å; V121-C123 WeakPolarHBondContact CG1-SG 3.43Å; V121-C123 PolarHBondContact O-N 3.39Å
122F30Very low48.9Very low199 Ų19976.3 Ų76.387%0.87340%0.399SS*.  trans-63.745.7174.3-163.5-98.8000112.4R120 I124R120-F122 PolarHBondContact O-N 3.22Å; F122-I124 PolarHBondContact O-N 2.79Å
123C28Very low49.9Very low70 Ų7073.5 Ų73.547%0.47338%0.382SS..  trans-94.196.3-179.6-73.40000111V121V121-C123 HydrophobicContact CG1-CB 4.43Å; V121-C123 WeakPolarHBondContact CG1-SG 3.43Å; V121-C123 PolarHBondContact O-N 3.39Å
124I25.2Very low50.6Low157 Ų15768.5 Ų68.581%0.80536%0.359SS*.  trans17.4122.4130.7-46.7173.4000115.5F122F122-I124 PolarHBondContact O-N 2.79Å
125A29Very low51.8Low74 Ų7463.4 Ų63.461%0.61234%0.335SS*.SBendtrans75.985.1157.800000120.1C127A125-C127 PolarHBondContact O-N 2.78Å
126F31Very low52.9Low178 Ų17862.8 Ų62.878%0.78133%0.332SS*.SBend60.8-9.7129.6-131.1-96.9000122.6
127C37.8Very low53.9Low51 Ų5162.9 Ų62.935%0.34533%0.332SS..  trans-14125-167.1-740000117.8A125 R176A125-C127 PolarHBondContact O-N 2.78Å; C127-R176 PolarHBondContact SG-NH1 3.47Å; C127-R176 PolarHBondContact SG-NH2 3.04Å; C127-R176 VanDerWaalsContact SG-NH2 3.35Å
128L42.4Very low55.1Low66 Ų6661.3 Ų61.335%0.34632%0.324SS..SBendtrans-68.5128.5156.1-83.1154.7000108.1N130 D186 V188L128-N130 PolarHBondContact O-N 2.97Å; L128-D186 WeakPolarHBondContact CD2-OD2 3.11Å; L128-V188 HydrophobicContact CD2-CB 3.34Å; L128-V188 HydrophobicContact CD2-CG1 3.3Å; L128-V188 HydrophobicContact CD2-CG2 4.11Å
129P52.5Low56.5Low15 Ų1560.2 Ų60.210%0.09731%0.313CS..PPolyproline II helixtrans-59.2135.2179.6-2.912.3000108.7Q131 S133 F192P129-Q131 PolarHBondContact O-N 3.47Å; P129-S133 WeakPolarHBondContact CB-OG 3.46Å; P129-F192 HydrophobicContact CB-CD1 4.25Å; P129-F192 HydrophobicContact CB-CD2 3.43Å; P129-F192 VanDerWaalsContact CB-CD2 3.43Å; P129-F192 HydrophobicContact CB-CE1 4.2Å; P129-F192 HydrophobicContact CB-CE2 3.41Å; P129-F192 VanDerWaalsContact CB-CE2 3.41Å; P129-F192 HydrophobicContact CB-CG 3.86Å; P129-F192 HydrophobicContact CB-CZ 3.81Å; P129-F192 HydrophobicContact CG-CB 3.38Å; P129-F192 HydrophobicContact CG-CD1 3.54Å; P129-F192 HydrophobicContact CG-CD2 3.15Å; P129-F192 HydrophobicContact CG-CE1 3.98Å; P129-F192 HydrophobicContact CG-CE2 3.66Å; P129-F192 HydrophobicContact CG-CG 3.07Å; P129-F192 HydrophobicContact CG-CZ 4.04Å
130N68.1Low58.4Low3 Ų357.7 Ų57.72%0.01629%0.291CS..PPolyproline II helixtrans-52.5131.4171.5177.1-14000108.1Q70 A73 Y79 L128 A132 S133 L134Q70-N130 PolarHBondContact OE1-ND2 2.96Å; A73-N130 HydrophobicContact CB-CB 4.44Å; Y79-N130 PolarHBondContact OH-OD1 3.1Å; L128-N130 PolarHBondContact O-N 2.97Å; N130-A132 PolarHBondContact O-N 3.3Å; N130-A132 WeakPolarHBondContact OD1-CB 3.43Å; N130-A132 PolarHBondContact OD1-N 3.12Å; N130-S133 WeakPolarHBondContact O-CA 3.34Å; N130-S133 WeakPolarHBondContact O-CB 2.71Å; N130-S133 PolarHBondContact O-N 3.47Å; N130-S133 PolarHBondContact O-OG 2.95Å; N130-L134 PolarHBondContact O-N 2.93Å
131Q74.9Confident60Low27 Ų2746.4 Ų46.413%0.12625%0.251CS..Hα-helixtrans-54.8-28.2-179.6-68.5886.800112.8Y79 K83 N115 I116 P129 L134 M135Y79-Q131 PolarHBondContact OH-OE1 3.47Å; K83-Q131 VanDerWaalsContact CE-CD 3.47Å; K83-Q131 VanDerWaalsContact CE-NE2 3.25Å; N115-Q131 WeakPolarHBondContact O-CG 3.33Å; I116-Q131 WeakPolarHBondContact O-CG 3.49Å; P129-Q131 PolarHBondContact O-N 3.47Å; Q131-L134 PolarHBondContact O-N 3.31Å; Q131-M135 WeakPolarHBondContact O-CE 3.29Å; Q131-M135 PolarHBondContact O-N 3.47Å; Q131-M135 VanDerWaalsContact O-N 3.1Å
132A81.6Confident62.1Low0 Ų044.2 Ų44.20%023%0.233CC..Hα-helixtrans-58.5-46.217000000112.3A37 M38 S41 N130 A136A37-A132 HydrophobicContact CB-CB 4.15Å; M38-A132 HydrophobicContact CB-CB 4.31Å; S41-A132 WeakPolarHBondContact CB-O 3.12Å; S41-A132 PolarHBondContact OG-O 3.5Å; N130-A132 PolarHBondContact O-N 3.3Å; N130-A132 WeakPolarHBondContact OD1-CB 3.43Å; N130-A132 PolarHBondContact OD1-N 3.12Å; A132-A136 VanDerWaalsContact O-CB 3.26Å; A132-A136 WeakPolarHBondContact O-CB 3.33Å; A132-A136 PolarHBondContact O-N 3.33Å
133S80.5Confident64.3Low2 Ų234.8 Ų34.81%0.01419%0.191CC..Hα-helixtrans-64.2-42.417972.80000111.5P129 N130 A136 L137P129-S133 WeakPolarHBondContact CB-OG 3.46Å; N130-S133 WeakPolarHBondContact O-CA 3.34Å; N130-S133 WeakPolarHBondContact O-CB 2.71Å; N130-S133 PolarHBondContact O-N 3.47Å; N130-S133 PolarHBondContact O-OG 2.95Å; S133-A136 PolarHBondContact O-N 3.35Å; S133-L137 WeakPolarHBondContact O-CB 3.01Å; S133-L137 PolarHBondContact O-N 2.9Å
134L77.9Confident66.4Low8 Ų831.6 Ų31.64%0.04217%0.17CC..Hα-helixtrans-61.4-49.4178.5-171.978.4000111.4L111 N115 N130 Q131 A136 L137 E138 F192 L195L111-L134 HydrophobicContact CD2-CD2 3.71Å; L111-L134 HydrophobicContact CD2-CG 4.31Å; N115-L134 HydrophobicContact CB-CD2 3.93Å; N130-L134 PolarHBondContact O-N 2.93Å; Q131-L134 PolarHBondContact O-N 3.31Å; L134-A136 PolarHBondContact O-N 2.73Å; L134-L137 PolarHBondContact O-N 2.84Å; L134-E138 PolarHBondContact O-N 2.81Å; L134-F192 HydrophobicContact CD1-CD2 4.02Å; L134-L195 HydrophobicContact CD1-CD2 3.47Å; L134-L195 VanDerWaalsContact CD1-CD2 3.47Å; L134-L195 HydrophobicContact CG-CD2 4.07Å
135M83.6Confident68.4Low1 Ų128.2 Ų28.21%0.00516%0.16CC..Hα-helixtrans-63.5-41.1177.3-76-174.1-71.800112.1M38 C42 I86 L90 L111 I116 Q131 L137 E138 S139M38-M135 HydrophobicContact CG-CE 3.74Å; C42-M135 HydrophobicContact CB-CE 4.32Å; C42-M135 HydrophobicContact CB-SD 3.97Å; I86-M135 HydrophobicContact CG2-CE 4.47Å; I86-M135 HydrophobicContact CG2-SD 4.4Å; L90-M135 HydrophobicContact CD1-SD 4.18Å; L111-M135 HydrophobicContact CD1-CG 4.1Å; I116-M135 HydrophobicContact CD1-SD 4.49Å; Q131-M135 WeakPolarHBondContact O-CE 3.29Å; Q131-M135 PolarHBondContact O-N 3.47Å; Q131-M135 VanDerWaalsContact O-N 3.1Å; M135-L137 VanDerWaalsContact C-N 3.33Å; M135-E138 PolarHBondContact O-N 2.68Å; M135-S139 WeakPolarHBondContact O-CB 3.3Å; M135-S139 PolarHBondContact O-N 3.28Å; M135-S139 PolarHBondContact O-OG 3.15Å
136A86.5Confident70.2Confident0 Ų030 Ų300%015%0.151CC..Hα-helixtrans-63.9-40.6177.500000111.5L64 L67 I68 A132 S133 L134 S139 L140L64-A136 HydrophobicContact CD1-CB 3.82Å; L67-A136 HydrophobicContact CB-CB 3.92Å; I68-A136 HydrophobicContact CG1-CB 3.62Å; A132-A136 VanDerWaalsContact O-CB 3.26Å; A132-A136 WeakPolarHBondContact O-CB 3.33Å; A132-A136 PolarHBondContact O-N 3.33Å; S133-A136 PolarHBondContact O-N 3.35Å; L134-A136 PolarHBondContact O-N 2.73Å; A136-S139 WeakPolarHBondContact O-CB 3.41Å; A136-S139 PolarHBondContact O-N 3.35Å; A136-L140 PolarHBondContact O-N 3.09Å
137L79.5Confident71.8Confident2 Ų222.8 Ų22.81%0.0112%0.12CC..Hα-helixtrans-66.6-44.3177.9-167.468.2000111.6I68 S133 L134 M135 S139 L140 V141 F192 L195 L196 T199I68-L137 HydrophobicContact CD1-CD1 4.29Å; I68-L137 HydrophobicContact CG1-CB 4.49Å; I68-L137 HydrophobicContact CG2-CD1 4.08Å; S133-L137 WeakPolarHBondContact O-CB 3.01Å; S133-L137 PolarHBondContact O-N 2.9Å; L134-L137 PolarHBondContact O-N 2.84Å; M135-L137 VanDerWaalsContact C-N 3.33Å; L137-S139 VanDerWaalsContact C-N 3.3Å; L137-S139 PolarHBondContact O-N 3Å; L137-L140 HydrophobicContact CD1-CD2 4.38Å; L137-L140 WeakPolarHBondContact O-CB 3.42Å; L137-L140 PolarHBondContact O-N 3.44Å; L137-V141 WeakPolarHBondContact O-CG2 3.31Å; L137-V141 PolarHBondContact O-N 3.35Å; L137-F192 HydrophobicContact CD2-CE2 4.18Å; L137-L195 HydrophobicContact CB-CD2 3.92Å; L137-L195 HydrophobicContact CB-CG 4.47Å; L137-L195 HydrophobicContact CD2-CB 4.24Å; L137-L195 HydrophobicContact CD2-CD2 3.79Å; L137-L195 HydrophobicContact CD2-CG 3.74Å; L137-L195 HydrophobicContact CG-CD2 4Å; L137-L195 HydrophobicContact CG-CG 4.02Å; L137-L196 HydrophobicContact CD2-CD2 3.82Å; L137-L196 HydrophobicContact CD2-CG 4.14Å; L137-T199 HydrophobicContact CD1-CG2 3.63Å; L137-T199 WeakPolarHBondContact CD1-OG1 3.47Å; L137-T199 HydrophobicContact CG-CG2 4.38Å; L137-T199 VanDerWaalsContact CG-OG1 3.26Å; L137-T199 WeakPolarHBondContact CG-OG1 3.42Å
138E80.1Confident72.6Confident7 Ų726.9 Ų26.93%0.03314%0.143CC..Hα-helixtrans-58.9-41.4171.2-80.5-118.1169.200112.5Y45 R49 D110 L134 M135 L140 V141 Y142 L195Y45-E138 HydrophobicContact CD2-CB 4Å; Y45-E138 HydrophobicContact CE2-CB 3.9Å; Y45-E138 HydrophobicContact CE2-CG 4.41Å; Y45-E138 WeakPolarHBondContact CE2-OE2 3.42Å; R49-E138 IonicContact CZ-OE2 3.25Å; R49-E138 IonicContact NH2-OE2 3.12Å; R49-E138 PolarHBondContact NH2-OE2 3.16Å; D110-E138 WeakPolarHBondContact CB-OE1 3.39Å; L134-E138 PolarHBondContact O-N 2.81Å; M135-E138 PolarHBondContact O-N 2.68Å; E138-L140 VanDerWaalsContact C-N 3.28Å; E138-L140 PolarHBondContact O-N 3.28Å; E138-V141 PolarHBondContact O-N 3Å; E138-Y142 PolarHBondContact O-N 3.42Å; E138-L195 HydrophobicContact CB-CD2 4.49Å; E138-L195 HydrophobicContact CG-CD1 3.78Å; E138-L195 HydrophobicContact CG-CD2 3.58Å; E138-L195 HydrophobicContact CG-CG 4.34Å
139S84.3Confident73.4Confident1 Ų125.2 Ų25.21%0.00714%0.137CC..Hα-helixtrans-60.4-44.2178.3-550000110.6F44 Y45 M135 A136 L137 Y142 I143F44-S139 VanDerWaalsContact C-OG 3.29Å; Y45-S139 WeakPolarHBondContact CA-OG 3.46Å; Y45-S139 PolarHBondContact N-OG 2.88Å; M135-S139 WeakPolarHBondContact O-CB 3.3Å; M135-S139 PolarHBondContact O-N 3.28Å; M135-S139 PolarHBondContact O-OG 3.15Å; A136-S139 WeakPolarHBondContact O-CB 3.41Å; A136-S139 PolarHBondContact O-N 3.35Å; L137-S139 VanDerWaalsContact C-N 3.3Å; L137-S139 PolarHBondContact O-N 3Å; S139-Y142 PolarHBondContact O-N 2.98Å; S139-I143 WeakPolarHBondContact O-CB 3.42Å; S139-I143 WeakPolarHBondContact O-CD1 3.5Å; S139-I143 WeakPolarHBondContact O-CG1 3.29Å; S139-I143 PolarHBondContact O-N 3.1Å
140L80.2Confident73.4Confident1 Ų130.8 Ų30.81%0.00516%0.162CC..Hα-helixtrans-63.1-41.8178.1173.769.8000112.5L64 I68 A136 L137 E138 Y142 I143 S144 M162 T199L64-L140 HydrophobicContact CD2-CB 4.12Å; L64-L140 HydrophobicContact CD2-CD1 4.25Å; I68-L140 HydrophobicContact CD1-CB 4.13Å; I68-L140 HydrophobicContact CD1-CD2 3.72Å; A136-L140 PolarHBondContact O-N 3.09Å; L137-L140 HydrophobicContact CD1-CD2 4.38Å; L137-L140 WeakPolarHBondContact O-CB 3.42Å; L137-L140 PolarHBondContact O-N 3.44Å; E138-L140 VanDerWaalsContact C-N 3.28Å; E138-L140 PolarHBondContact O-N 3.28Å; L140-Y142 VanDerWaalsContact C-N 3.3Å; L140-Y142 PolarHBondContact O-N 2.71Å; L140-I143 PolarHBondContact O-N 3.14Å; L140-S144 VanDerWaalsContact O-CB 3.28Å; L140-S144 WeakPolarHBondContact O-CB 3.48Å; L140-S144 PolarHBondContact O-N 3.28Å; L140-S144 PolarHBondContact O-OG 3.4Å; L140-M162 HydrophobicContact CD1-CE 3.46Å; L140-M162 VanDerWaalsContact CD1-CE 3.46Å; L140-M162 HydrophobicContact CD2-CE 2.96Å; L140-M162 HydrophobicContact CG-CE 3.75Å; L140-T199 HydrophobicContact CD2-CG2 3.52Å; L140-T199 HydrophobicContact CG-CG2 4.31Å
141V74.4Confident72.7Confident18 Ų1838.1 Ų38.111%0.10919%0.194CC..Hα-helixtrans-54.6-51.2174.51720000109.7L137 E138 I143 S144 C145 L195 T198 T199L137-V141 WeakPolarHBondContact O-CG2 3.31Å; L137-V141 PolarHBondContact O-N 3.35Å; E138-V141 PolarHBondContact O-N 3Å; V141-I143 PolarHBondContact O-N 2.88Å; V141-S144 PolarHBondContact O-N 3.32Å; V141-C145 WeakPolarHBondContact O-CB 3.37Å; V141-C145 PolarHBondContact O-N 2.83Å; V141-C145 PolarHBondContact O-SG 3.17Å; V141-L195 HydrophobicContact CG2-CD1 4.35Å; V141-T198 HydrophobicContact CG1-CG2 4.21Å; V141-T198 HydrophobicContact CG2-CG2 4.41Å; V141-T199 HydrophobicContact CG2-CG2 4.31Å; V141-T199 VanDerWaalsContact CG2-OG1 3.22Å; V141-T199 WeakPolarHBondContact CG2-OG1 3.25Å
142Y76Confident71.6Confident48 Ų4837 Ų3719%0.18819%0.189CC..Hα-helixtrans-63.7-41.4-179.4-100.3-92.2000113.3R49 E138 S139 L140 R146R49-Y142 HydrophobicContact CG-CD1 4Å; R49-Y142 HydrophobicContact CG-CD2 4.14Å; R49-Y142 HydrophobicContact CG-CE1 4.1Å; R49-Y142 HydrophobicContact CG-CE2 4.26Å; R49-Y142 HydrophobicContact CG-CG 4Å; R49-Y142 VanDerWaalsContact CZ-CE2 3.44Å; R49-Y142 PolarHBondContact NH1-OH 3.48Å; E138-Y142 PolarHBondContact O-N 3.42Å; S139-Y142 PolarHBondContact O-N 2.98Å; L140-Y142 VanDerWaalsContact C-N 3.3Å; L140-Y142 PolarHBondContact O-N 2.71Å; Y142-R146 WeakPolarHBondContact O-CB 3Å; Y142-R146 WeakPolarHBondContact O-CG 3.4Å; Y142-R146 PolarHBondContact O-N 2.71Å
143I77.4Confident70.2Confident1 Ų138.7 Ų38.71%0.00520%0.197CC..Hα-helixtrans-62.9-48.3176.4-71.3162.6000109.6A48 V56 L64 S139 L140 V141 C145 R146 N147 F152A48-I143 HydrophobicContact CB-CD1 4.14Å; A48-I143 HydrophobicContact CB-CG1 3.89Å; V56-I143 HydrophobicContact CG2-CD1 3.98Å; V56-I143 HydrophobicContact CG2-CG1 4.35Å; V56-I143 HydrophobicContact CG2-CG2 3.62Å; L64-I143 HydrophobicContact CD2-CD1 3.87Å; S139-I143 WeakPolarHBondContact O-CB 3.42Å; S139-I143 WeakPolarHBondContact O-CD1 3.5Å; S139-I143 WeakPolarHBondContact O-CG1 3.29Å; S139-I143 PolarHBondContact O-N 3.1Å; L140-I143 PolarHBondContact O-N 3.14Å; V141-I143 PolarHBondContact O-N 2.88Å; I143-C145 VanDerWaalsContact C-N 3.31Å; I143-C145 PolarHBondContact O-N 3.5Å; I143-R146 PolarHBondContact O-N 3.03Å; I143-R146 VanDerWaalsContact O-N 3.11Å; I143-N147 HydrophobicContact CG2-CB 4.46Å; I143-N147 WeakPolarHBondContact O-CB 3.48Å; I143-N147 PolarHBondContact O-N 3.43Å; I143-F152 HydrophobicContact CG2-CE2 4.01Å; I143-F152 HydrophobicContact CG2-CZ 4.16Å
144S71Confident69Low4 Ų442.1 Ų42.13%0.02822%0.215CC..Hα-helixtrans-64.2-36-176.7-53.80000112.2L140 V141 R146L140-S144 VanDerWaalsContact O-CB 3.28Å; L140-S144 WeakPolarHBondContact O-CB 3.48Å; L140-S144 PolarHBondContact O-N 3.28Å; L140-S144 PolarHBondContact O-OG 3.4Å; V141-S144 PolarHBondContact O-N 3.32Å; S144-R146 VanDerWaalsContact C-N 3.31Å; S144-R146 PolarHBondContact O-N 3.32Å
145C67.8Low67.8Low86 Ų8642.9 Ų42.958%0.58122%0.218SC*.Hα-helixtrans-73.6-17.2176.7-69.90000114.2V141 I143V141-C145 WeakPolarHBondContact O-CB 3.37Å; V141-C145 PolarHBondContact O-N 2.83Å; V141-C145 PolarHBondContact O-SG 3.17Å; I143-C145 VanDerWaalsContact C-N 3.31Å; I143-C145 PolarHBondContact O-N 3.5Å
146R67.1Low66.4Low112 Ų11243.1 Ų43.142%0.42322%0.22SC..Hα-helixtrans-117.2-17.9-172-69-176.1172.7179.70.4114.6R49 D50 Y142 I143 S144R49-R146 PolarHBondContact O-NH1 2.82Å; R49-R146 VanDerWaalsContact O-NH1 3.14Å; D50-R146 PolarHBondContact O-NH1 3.49Å; Y142-R146 WeakPolarHBondContact O-CB 3Å; Y142-R146 WeakPolarHBondContact O-CG 3.4Å; Y142-R146 PolarHBondContact O-N 2.71Å; I143-R146 PolarHBondContact O-N 3.03Å; I143-R146 VanDerWaalsContact O-N 3.11Å; S144-R146 VanDerWaalsContact C-N 3.31Å; S144-R146 PolarHBondContact O-N 3.32Å
147N63.1Low64.7Low26 Ų2646.4 Ų46.414%0.13923%0.232CC..  trans-85.2127.4-173.2-162.1-15.4000111I143 S149 F152I143-N147 HydrophobicContact CG2-CB 4.46Å; I143-N147 WeakPolarHBondContact O-CB 3.48Å; I143-N147 PolarHBondContact O-N 3.43Å; N147-S149 VanDerWaalsContact OD1-CB 3.28Å; N147-S149 WeakPolarHBondContact OD1-CB 3.47Å; N147-S149 PolarHBondContact OD1-N 3.19Å; N147-S149 PolarHBondContact OD1-OG 3.43Å; N147-F152 HydrophobicContact CB-CD1 3.92Å; N147-F152 HydrophobicContact CB-CE1 4.13Å; N147-F152 HydrophobicContact CB-CG 4.25Å; N147-F152 WeakPolarHBondContact ND2-CB 3.49Å; N147-F152 WeakPolarHBondContact ND2-CD2 3.42Å; N147-F152 WeakPolarHBondContact ND2-CG 3.36Å
148T56.6Low63.2Low136 Ų13651.2 Ų51.283%0.83426%0.257SS*.  trans-1147.1175.654.70000112.5
149S57.9Low62.1Low31 Ų3151 Ų5122%0.21726%0.257CS..  trans-77.1140-168.871.40000113.7N147 F151 F152 M153N147-S149 VanDerWaalsContact OD1-CB 3.28Å; N147-S149 WeakPolarHBondContact OD1-CB 3.47Å; N147-S149 PolarHBondContact OD1-N 3.19Å; N147-S149 PolarHBondContact OD1-OG 3.43Å; S149-F151 PolarHBondContact O-N 3.07Å; S149-F151 VanDerWaalsContact O-N 3.17Å; S149-F152 WeakPolarHBondContact O-CB 3.27Å; S149-F152 PolarHBondContact O-N 3.3Å; S149-F152 WeakPolarHBondContact OG-CB 3.26Å; S149-F152 PolarHBondContact OG-N 3.14Å; S149-M153 PolarHBondContact O-N 2.68Å
150Q52.8Low61.4Low132 Ų13251.8 Ų51.862%0.61726%0.262SS*.Hα-helixtrans-51.3-34.8170.4-141.295.214.700112.7M153 D154Q150-M153 HydrophobicContact CB-CE 3.97Å; Q150-M153 HydrophobicContact CG-CE 3.52Å; Q150-M153 WeakPolarHBondContact O-CB 3.3Å; Q150-M153 PolarHBondContact O-N 3.22Å; Q150-M153 VanDerWaalsContact O-N 3.17Å; Q150-D154 PolarHBondContact O-N 3.12Å
151F53.3Low61Low158 Ų15853.8 Ų53.869%0.69328%0.279SS*.Hα-helixtrans-68-37.6179.1-77.1-80.1000113S149 M153 D154S149-F151 PolarHBondContact O-N 3.07Å; S149-F151 VanDerWaalsContact O-N 3.17Å; F151-M153 PolarHBondContact O-N 2.92Å; F151-D154 PolarHBondContact O-N 3.5Å
152F52.8Low61.1Low2 Ų253.3 Ų53.31%0.00928%0.275CS..Hα-helixtrans-67.2-27.3173.7-167.9-119.6000111.3L61 I143 N147 S149 E155 I156 F206L61-F152 HydrophobicContact CD2-CD2 4.32Å; L61-F152 HydrophobicContact CD2-CE2 4.27Å; I143-F152 HydrophobicContact CG2-CE2 4.01Å; I143-F152 HydrophobicContact CG2-CZ 4.16Å; N147-F152 HydrophobicContact CB-CD1 3.92Å; N147-F152 HydrophobicContact CB-CE1 4.13Å; N147-F152 HydrophobicContact CB-CG 4.25Å; N147-F152 WeakPolarHBondContact ND2-CB 3.49Å; N147-F152 WeakPolarHBondContact ND2-CD2 3.42Å; N147-F152 WeakPolarHBondContact ND2-CG 3.36Å; S149-F152 WeakPolarHBondContact O-CB 3.27Å; S149-F152 PolarHBondContact O-N 3.3Å; S149-F152 WeakPolarHBondContact OG-CB 3.26Å; S149-F152 PolarHBondContact OG-N 3.14Å; F152-E155 PolarHBondContact O-N 3.33Å; F152-I156 HydrophobicContact CD1-CD1 3.93Å; F152-I156 HydrophobicContact CD1-CG1 4.15Å; F152-I156 HydrophobicContact CD2-CG1 4.21Å; F152-I156 HydrophobicContact CE1-CD1 3.16Å; F152-I156 HydrophobicContact CE1-CG1 3.78Å; F152-I156 HydrophobicContact CE2-CD1 3.91Å; F152-I156 HydrophobicContact CE2-CG1 3.85Å; F152-I156 HydrophobicContact CG-CG1 4.36Å; F152-I156 HydrophobicContact CZ-CD1 3.15Å; F152-I156 HydrophobicContact CZ-CG1 3.63Å; F152-I156 PolarHBondContact O-N 3.4Å; F152-F206 HydrophobicContact CD1-CD2 4.24Å; F152-F206 AromaticContact CD1-CE1 3.9Å; F152-F206 HydrophobicContact CD1-CE1 3.9Å; F152-F206 AromaticContact CD1-CE2 3.45Å; F152-F206 HydrophobicContact CD1-CE2 3.45Å; F152-F206 VanDerWaalsContact CD1-CE2 3.45Å; F152-F206 AromaticContact CD1-CZ 3.24Å; F152-F206 HydrophobicContact CD1-CZ 3.24Å; F152-F206 HydrophobicContact CE1-CD1 4.23Å; F152-F206 AromaticContact CE1-CD2 3.85Å; F152-F206 HydrophobicContact CE1-CD2 3.85Å; F152-F206 AromaticContact CE1-CE1 3.93Å; F152-F206 HydrophobicContact CE1-CE1 3.93Å; F152-F206 AromaticContact CE1-CE2 3.54Å; F152-F206 HydrophobicContact CE1-CE2 3.54Å; F152-F206 HydrophobicContact CE1-CG 4.19Å; F152-F206 AromaticContact CE1-CZ 3.58Å; F152-F206 HydrophobicContact CE1-CZ 3.58Å; F152-F206 HydrophobicContact CG-CZ 4.39Å
153M51.3Low61.3Low37 Ų3751 Ų5118%0.18227%0.267CS..Hα-helixtrans-63.4-40.3173.3-49.8-154.4-113.500112.8S149 Q150 F151 E155 R157 L210S149-M153 PolarHBondContact O-N 2.68Å; Q150-M153 HydrophobicContact CB-CE 3.97Å; Q150-M153 HydrophobicContact CG-CE 3.52Å; Q150-M153 WeakPolarHBondContact O-CB 3.3Å; Q150-M153 PolarHBondContact O-N 3.22Å; Q150-M153 VanDerWaalsContact O-N 3.17Å; F151-M153 PolarHBondContact O-N 2.92Å; M153-E155 PolarHBondContact O-N 3.32Å; M153-R157 WeakPolarHBondContact O-CB 3.05Å; M153-R157 PolarHBondContact O-N 2.84Å; M153-L210 HydrophobicContact CB-CD1 4.08Å; M153-L210 HydrophobicContact CG-CD1 3.43Å; M153-L210 VanDerWaalsContact CG-CD1 3.43Å; M153-L210 HydrophobicContact SD-CD1 3.28Å; M153-L210 WeakPolarHBondContact SD-CD1 3.38Å; M153-L210 HydrophobicContact SD-CG 4.25Å
154D55.1Low61.5Low73 Ų7353.7 Ų53.739%0.3928%0.279SS..Hα-helixtrans-72.9-14.1178.5-77.5-30.3000112.8Q150 F151 K220Q150-D154 PolarHBondContact O-N 3.12Å; F151-D154 PolarHBondContact O-N 3.5Å; D154-K220 IonicContact OD1-NZ 3.88Å; D154-K220 PolarHBondContact OD1-NZ 3.32Å
155E52.6Low62Low24 Ų2454.9 Ų54.911%0.11228%0.284CS..Hα-helixtrans-117-27.2-171.6-151.7144.8166.500116K58 L61 F152 M153 R157 L158 S159K58-E155 WeakPolarHBondContact CA-OE1 3.16Å; K58-E155 WeakPolarHBondContact CA-OE2 3.42Å; K58-E155 WeakPolarHBondContact CB-OE2 3.3Å; K58-E155 VanDerWaalsContact CG-OE1 3.27Å; K58-E155 WeakPolarHBondContact CG-OE1 3.39Å; K58-E155 WeakPolarHBondContact CG-OE2 3.28Å; L61-E155 HydrophobicContact CB-CG 4.2Å; L61-E155 HydrophobicContact CD2-CB 3.64Å; L61-E155 HydrophobicContact CD2-CG 3.45Å; L61-E155 VanDerWaalsContact CD2-CG 3.45Å; L61-E155 HydrophobicContact CG-CG 4.18Å; F152-E155 PolarHBondContact O-N 3.33Å; M153-E155 PolarHBondContact O-N 3.32Å; E155-R157 PolarHBondContact O-N 3.07Å; E155-L158 HydrophobicContact CB-CD1 4.48Å; E155-L158 HydrophobicContact CG-CB 4.23Å; E155-L158 HydrophobicContact CG-CD1 3.81Å; E155-L158 CarbonylContact O-C 3.56Å; E155-L158 WeakPolarHBondContact O-CA 3.28Å; E155-L158 VanDerWaalsContact O-CB 3.27Å; E155-L158 WeakPolarHBondContact O-CB 3.43Å; E155-L158 PolarHBondContact O-N 2.9Å; E155-S159 PolarHBondContact O-N 3.03Å
156I54.4Low62.6Low6 Ų650.9 Ų50.93%0.03126%0.256CS..Hα-helixtrans-63.4-27.2155-74.3-156.4000110.3F152 L158 S159 F163 L203 F206 L207F152-I156 HydrophobicContact CD1-CD1 3.93Å; F152-I156 HydrophobicContact CD1-CG1 4.15Å; F152-I156 HydrophobicContact CD2-CG1 4.21Å; F152-I156 HydrophobicContact CE1-CD1 3.16Å; F152-I156 HydrophobicContact CE1-CG1 3.78Å; F152-I156 HydrophobicContact CE2-CD1 3.91Å; F152-I156 HydrophobicContact CE2-CG1 3.85Å; F152-I156 HydrophobicContact CG-CG1 4.36Å; F152-I156 HydrophobicContact CZ-CD1 3.15Å; F152-I156 HydrophobicContact CZ-CG1 3.63Å; F152-I156 PolarHBondContact O-N 3.4Å; I156-L158 PolarHBondContact O-N 3.4Å; I156-S159 WeakPolarHBondContact O-CA 3.38Å; I156-S159 WeakPolarHBondContact O-CB 3.42Å; I156-S159 PolarHBondContact O-N 2.95Å; I156-S159 PolarHBondContact O-OG 3.33Å; I156-F163 HydrophobicContact CG2-CE2 4.32Å; I156-L203 HydrophobicContact CD1-CD2 3.96Å; I156-F206 HydrophobicContact CB-CD1 4.43Å; I156-F206 HydrophobicContact CB-CE1 3.98Å; I156-F206 HydrophobicContact CD1-CD1 3.4Å; I156-F206 VanDerWaalsContact CD1-CD1 3.4Å; I156-F206 HydrophobicContact CD1-CE1 3.54Å; I156-F206 HydrophobicContact CD1-CG 4.08Å; I156-F206 HydrophobicContact CD1-CZ 4.32Å; I156-F206 HydrophobicContact CG1-CD1 4.4Å; I156-F206 HydrophobicContact CG1-CE1 4.13Å; I156-F206 HydrophobicContact CG2-CD1 4.01Å; I156-F206 HydrophobicContact CG2-CE1 3.94Å; I156-L207 HydrophobicContact CG2-CD2 4.15Å
157R50.5Low63.5Low70 Ų7045.6 Ų45.626%0.26424%0.237SC..THydrogen-bonded Turntrans-62.2-25.4165.9-175.3-177.7-174-153.82.8113.3M153 E155 S159 K220 E223M153-R157 WeakPolarHBondContact O-CB 3.05Å; M153-R157 PolarHBondContact O-N 2.84Å; E155-R157 PolarHBondContact O-N 3.07Å; R157-S159 VanDerWaalsContact C-N 3.32Å; R157-K220 VanDerWaalsContact CZ-CB 3.49Å; R157-K220 VanDerWaalsContact CZ-CG 3.45Å; R157-K220 PolarHBondContact NE-O 3.07Å; R157-K220 PolarHBondContact NH2-O 3.3Å; R157-K220 VanDerWaalsContact NH2-O 3.09Å; R157-E223 IonicContact CZ-OE2 3.54Å; R157-E223 IonicContact NH2-OE2 2.71Å; R157-E223 PolarHBondContact NH2-OE2 3.21Å
158L49.3Very low64.5Low102 Ų10248.5 Ų48.553%0.53425%0.252SS..THydrogen-bonded Turntrans-83.7-7.8170.3-79.5153.2000112.6E155 I156E155-L158 HydrophobicContact CB-CD1 4.48Å; E155-L158 HydrophobicContact CG-CB 4.23Å; E155-L158 HydrophobicContact CG-CD1 3.81Å; E155-L158 CarbonylContact O-C 3.56Å; E155-L158 WeakPolarHBondContact O-CA 3.28Å; E155-L158 VanDerWaalsContact O-CB 3.27Å; E155-L158 WeakPolarHBondContact O-CB 3.43Å; E155-L158 PolarHBondContact O-N 2.9Å; I156-L158 PolarHBondContact O-N 3.4Å
159S56.9Low65.7Low4 Ų443.6 Ų43.63%0.02822%0.218CC..THydrogen-bonded Turntrans-10126.2-167.693.90000115.2E155 I156 R157 A161 M162 F163E155-S159 PolarHBondContact O-N 3.03Å; I156-S159 WeakPolarHBondContact O-CA 3.38Å; I156-S159 WeakPolarHBondContact O-CB 3.42Å; I156-S159 PolarHBondContact O-N 2.95Å; I156-S159 PolarHBondContact O-OG 3.33Å; R157-S159 VanDerWaalsContact C-N 3.32Å; S159-A161 PolarHBondContact O-N 2.92Å; S159-A161 VanDerWaalsContact O-N 3.13Å; S159-M162 WeakPolarHBondContact CB-SD 3.49Å; S159-M162 WeakPolarHBondContact O-CB 3.28Å; S159-M162 PolarHBondContact O-N 3.22Å; S159-F163 WeakPolarHBondContact O-CD2 3.3Å; S159-F163 PolarHBondContact O-N 2.78Å; S159-F163 VanDerWaalsContact O-N 3.15Å
160S67.8Low66.9Low17 Ų1742.1 Ų42.112%0.11921%0.208CC..Hα-helixtrans-48.8-38159.167.70000109M162 F163 H164 R224S160-M162 VanDerWaalsContact C-N 3.28Å; S160-M162 PolarHBondContact O-N 3.15Å; S160-F163 PolarHBondContact O-N 3.13Å; S160-H164 VanDerWaalsContact O-CB 3.3Å; S160-H164 WeakPolarHBondContact O-CB 3.45Å; S160-H164 PolarHBondContact O-CD2 3.5Å; S160-H164 VanDerWaalsContact O-CG 3.3Å; S160-H164 PolarHBondContact O-N 3.35Å; S160-R224 PolarHBondContact OG-NH2 3.41Å
161A73.1Confident68.4Low43 Ų4337.2 Ų37.236%0.35519%0.187SC..Hα-helixtrans-53.6-36.7172.500000114.5S159 F165S159-A161 PolarHBondContact O-N 2.92Å; S159-A161 VanDerWaalsContact O-N 3.13Å; A161-F165 WeakPolarHBondContact O-CB 3.48Å; A161-F165 PolarHBondContact O-N 3.06Å
162M75.3Confident69.8Low7 Ų733.8 Ų33.83%0.03417%0.174CC..Hα-helixtrans-77.9-41.8178.8-65.3176.264.700111.7L61 V65 I68 L140 S159 S160 H164 F165 C166 L203L61-M162 HydrophobicContact CD1-SD 4.46Å; V65-M162 HydrophobicContact CG1-CG 4.23Å; V65-M162 HydrophobicContact CG2-CE 4.12Å; V65-M162 HydrophobicContact CG2-CG 3.64Å; V65-M162 HydrophobicContact CG2-SD 3.29Å; V65-M162 WeakPolarHBondContact CG2-SD 3.41Å; I68-M162 HydrophobicContact CD1-CE 4.42Å; L140-M162 HydrophobicContact CD1-CE 3.46Å; L140-M162 VanDerWaalsContact CD1-CE 3.46Å; L140-M162 HydrophobicContact CD2-CE 2.96Å; L140-M162 HydrophobicContact CG-CE 3.75Å; S159-M162 WeakPolarHBondContact CB-SD 3.49Å; S159-M162 WeakPolarHBondContact O-CB 3.28Å; S159-M162 PolarHBondContact O-N 3.22Å; S160-M162 VanDerWaalsContact C-N 3.28Å; S160-M162 PolarHBondContact O-N 3.15Å; M162-H164 VanDerWaalsContact C-N 3.35Å; M162-F165 PolarHBondContact O-N 3.23Å; M162-C166 WeakPolarHBondContact O-CB 3.31Å; M162-C166 PolarHBondContact O-N 2.83Å; M162-C166 PolarHBondContact O-SG 2.93Å; M162-L203 HydrophobicContact CB-CD1 4.38Å
163F80.6Confident70.8Confident1 Ų135.7 Ų35.70%0.00418%0.184CC..Hα-helixtrans-59.9-47.7172.7-71.3-80.8000110.9I156 S159 S160 F165 C166 M167 F200 L203 F204 L207 F227 F230I156-F163 HydrophobicContact CG2-CE2 4.32Å; S159-F163 WeakPolarHBondContact O-CD2 3.3Å; S159-F163 PolarHBondContact O-N 2.78Å; S159-F163 VanDerWaalsContact O-N 3.15Å; S160-F163 PolarHBondContact O-N 3.13Å; F163-F165 PolarHBondContact O-N 3.43Å; F163-C166 PolarHBondContact O-N 2.86Å; F163-M167 WeakPolarHBondContact O-CB 3.48Å; F163-M167 PolarHBondContact O-N 3.25Å; F163-F200 HydrophobicContact CB-CE2 4.09Å; F163-F200 AromaticContact CD1-CD2 3.99Å; F163-F200 HydrophobicContact CD1-CD2 3.99Å; F163-F200 AromaticContact CD1-CE2 3.67Å; F163-F200 HydrophobicContact CD1-CE2 3.67Å; F163-F200 HydrophobicContact CG-CE2 4.39Å; F163-L203 HydrophobicContact CD1-CB 4.18Å; F163-L203 HydrophobicContact CD1-CD1 4.45Å; F163-L203 HydrophobicContact CE1-CB 3.38Å; F163-L203 HydrophobicContact CE1-CD1 4.38Å; F163-L203 HydrophobicContact CE1-CG 4.49Å; F163-L203 HydrophobicContact CE2-CB 4.47Å; F163-L203 HydrophobicContact CZ-CB 3.53Å; F163-F204 AromaticContact CD1-CD2 3.9Å; F163-F204 HydrophobicContact CD1-CD2 3.9Å; F163-F204 AromaticContact CD1-CE2 3.36Å; F163-F204 HydrophobicContact CD1-CE2 3.36Å; F163-F204 AromaticContact CD1-CZ 3.9Å; F163-F204 HydrophobicContact CD1-CZ 3.9Å; F163-F204 AromaticContact CE1-CD2 3.62Å; F163-F204 HydrophobicContact CE1-CD2 3.62Å; F163-F204 HydrophobicContact CE1-CE1 4.49Å; F163-F204 AromaticContact CE1-CE2 3.46Å; F163-F204 HydrophobicContact CE1-CE2 3.46Å; F163-F204 VanDerWaalsContact CE1-CE2 3.46Å; F163-F204 HydrophobicContact CE1-CG 4.17Å; F163-F204 AromaticContact CE1-CZ 3.9Å; F163-F204 HydrophobicContact CE1-CZ 3.9Å; F163-L207 HydrophobicContact CE1-CD1 3.81Å; F163-L207 HydrophobicContact CE2-CD1 3.84Å; F163-L207 HydrophobicContact CE2-CG 4.43Å; F163-L207 HydrophobicContact CZ-CD1 3.23Å; F163-L207 HydrophobicContact CZ-CG 3.77Å; F163-F227 HydrophobicContact CB-CE2 3.96Å; F163-F227 AromaticContact CD2-CE2 3.48Å; F163-F227 HydrophobicContact CD2-CE2 3.48Å; F163-F227 VanDerWaalsContact CD2-CE2 3.48Å; F163-F227 AromaticContact CD2-CZ 3.63Å; F163-F227 HydrophobicContact CD2-CZ 3.63Å; F163-F227 HydrophobicContact CE2-CE2 4.11Å; F163-F227 AromaticContact CE2-CZ 3.76Å; F163-F227 HydrophobicContact CE2-CZ 3.76Å; F163-F227 AromaticContact CG-CE2 3.76Å; F163-F227 HydrophobicContact CG-CE2 3.76Å; F163-F227 HydrophobicContact CG-CZ 4.06Å; F163-F227 HydrophobicContact CZ-CZ 4.24Å; F163-F230 HydrophobicContact CB-CE1 3.68Å; F163-F230 HydrophobicContact CB-CZ 4.21Å
164H82.2Confident71.9Confident57 Ų5736.3 Ų36.326%0.26419%0.185SC..Hα-helixtrans-59.6-44.7173.1-74.3-64.1000111.6S160 M162 M167 N168 F230S160-H164 VanDerWaalsContact O-CB 3.3Å; S160-H164 WeakPolarHBondContact O-CB 3.45Å; S160-H164 PolarHBondContact O-CD2 3.5Å; S160-H164 VanDerWaalsContact O-CG 3.3Å; S160-H164 PolarHBondContact O-N 3.35Å; M162-H164 VanDerWaalsContact C-N 3.35Å; H164-M167 PolarHBondContact O-N 2.9Å; H164-N168 WeakPolarHBondContact O-CB 3.27Å; H164-N168 PolarHBondContact O-N 3.25Å; H164-N168 PolarHBondContact O-ND2 3.26Å; H164-N168 PolarHBondContact O-OD1 2.69Å; H164-F230 AromaticContact CE1-CD2 3.12Å; H164-F230 WeakPolarHBondContact CE1-CD2 3.3Å; H164-F230 AromaticContact CE1-CE2 3.72Å; H164-F230 AromaticContact CE1-CG 3.31Å; H164-F230 WeakPolarHBondContact CE1-CG 3.32Å; H164-F230 AromaticContact ND1-CD2 3.18Å; H164-F230 WeakPolarHBondContact ND1-CD2 3.4Å; H164-F230 AromaticContact ND1-CE2 3.25Å; H164-F230 VanDerWaalsContact ND1-CE2 3.25Å; H164-F230 WeakPolarHBondContact ND1-CE2 3.23Å; H164-F230 AromaticContact ND1-CG 3.75Å; H164-F230 AromaticContact ND1-CZ 3.92Å; H164-F230 AromaticContact NE2-CG 4Å
165F80.9Confident72.8Confident28 Ų2835.9 Ų35.912%0.12319%0.188CC..Hα-helixtrans-60.3-50.8178.4173.9-91.9000111.4I68 K69 A161 M162 F163 M167 N168 R169 L196I68-F165 HydrophobicContact CG2-CD1 3.67Å; I68-F165 HydrophobicContact CG2-CE1 3.23Å; I68-F165 HydrophobicContact CG2-CZ 3.84Å; I68-F165 VanDerWaalsContact O-CZ 3.23Å; I68-F165 WeakPolarHBondContact O-CZ 3.47Å; K69-F165 HydrophobicContact CB-CE2 4.29Å; K69-F165 HydrophobicContact CG-CD2 3.92Å; K69-F165 HydrophobicContact CG-CE2 4.04Å; A161-F165 WeakPolarHBondContact O-CB 3.48Å; A161-F165 PolarHBondContact O-N 3.06Å; M162-F165 PolarHBondContact O-N 3.23Å; F163-F165 PolarHBondContact O-N 3.43Å; F165-M167 PolarHBondContact O-N 3.24Å; F165-N168 PolarHBondContact O-N 3.32Å; F165-R169 HydrophobicContact CD1-CG 4.35Å; F165-R169 HydrophobicContact CD2-CG 4.36Å; F165-R169 HydrophobicContact CE1-CG 3.94Å; F165-R169 HydrophobicContact CE2-CG 3.97Å; F165-R169 HydrophobicContact CZ-CG 3.75Å; F165-R169 WeakPolarHBondContact O-CB 3.18Å; F165-R169 WeakPolarHBondContact O-CG 3.5Å; F165-R169 PolarHBondContact O-N 3.43Å; F165-L196 HydrophobicContact CE1-CD2 4.39Å
166C81.5Confident73.4Confident2 Ų240.1 Ų40.11%0.01420%0.203CC..Hα-helixtrans-58.9-48.3179-730000110.8M162 F163 R169 V170 F200M162-C166 WeakPolarHBondContact O-CB 3.31Å; M162-C166 PolarHBondContact O-N 2.83Å; M162-C166 PolarHBondContact O-SG 2.93Å; F163-C166 PolarHBondContact O-N 2.86Å; C166-R169 PolarHBondContact O-N 2.9Å; C166-V170 WeakPolarHBondContact O-CG2 3.23Å; C166-V170 PolarHBondContact O-N 3.49Å; C166-F200 HydrophobicContact CB-CB 4.28Å; C166-F200 HydrophobicContact CB-CD2 3.93Å; C166-F200 HydrophobicContact CB-CG 4.46Å
167M85.1Confident73.9Confident1 Ų142.9 Ų42.91%0.00522%0.223CC..Hα-helixtrans-66.8-43.6179.5-77-55.6-61.800113.4F163 H164 F165 R169 V170 V171 F200 F230 T238 V239 M243F163-M167 WeakPolarHBondContact O-CB 3.48Å; F163-M167 PolarHBondContact O-N 3.25Å; H164-M167 PolarHBondContact O-N 2.9Å; F165-M167 PolarHBondContact O-N 3.24Å; M167-R169 PolarHBondContact O-N 3.3Å; M167-V170 WeakPolarHBondContact O-CB 3.22Å; M167-V170 PolarHBondContact O-N 2.82Å; M167-V170 VanDerWaalsContact O-N 3.09Å; M167-V171 VanDerWaalsContact O-CG2 3.26Å; M167-V171 WeakPolarHBondContact O-CG2 3.43Å; M167-V171 PolarHBondContact O-N 2.62Å; M167-F200 HydrophobicContact CG-CD1 4.37Å; M167-F200 HydrophobicContact CG-CD2 4.05Å; M167-F200 HydrophobicContact CG-CE1 3.75Å; M167-F200 HydrophobicContact CG-CE2 3.31Å; M167-F200 HydrophobicContact CG-CZ 3.13Å; M167-F200 HydrophobicContact SD-CD1 3.68Å; M167-F200 HydrophobicContact SD-CD2 4.35Å; M167-F200 HydrophobicContact SD-CE1 3.25Å; M167-F200 WeakPolarHBondContact SD-CE1 3.41Å; M167-F200 HydrophobicContact SD-CE2 3.94Å; M167-F200 HydrophobicContact SD-CG 4.23Å; M167-F200 HydrophobicContact SD-CZ 3.37Å; M167-F200 WeakPolarHBondContact SD-CZ 3.26Å; M167-F230 HydrophobicContact CB-CE2 4.24Å; M167-F230 HydrophobicContact CB-CZ 3.97Å; M167-F230 HydrophobicContact CG-CE2 4.41Å; M167-F230 HydrophobicContact CG-CZ 3.78Å; M167-T238 HydrophobicContact CE-CG2 3.3Å; M167-V239 HydrophobicContact CE-CG2 4.17Å; M167-M243 HydrophobicContact CE-CE 3.89Å; M167-M243 HydrophobicContact SD-CE 3.64Å
168N85Confident74.3Confident88 Ų8845.6 Ų45.647%0.47124%0.243SC..Hα-helixtrans-59.7-38.2176.9-71.5-10.4000110.7H164 F165 V171 E172H164-N168 WeakPolarHBondContact O-CB 3.27Å; H164-N168 PolarHBondContact O-N 3.25Å; H164-N168 PolarHBondContact O-ND2 3.26Å; H164-N168 PolarHBondContact O-OD1 2.69Å; F165-N168 PolarHBondContact O-N 3.32Å; N168-V171 PolarHBondContact O-N 3.17Å; N168-E172 WeakPolarHBondContact O-CB 3.38Å; N168-E172 VanDerWaalsContact O-CG 3.26Å; N168-E172 WeakPolarHBondContact O-CG 3.17Å; N168-E172 PolarHBondContact O-N 2.63Å
169R81.3Confident74.5Confident32 Ų3244.2 Ų44.212%0.12125%0.253CS..Hα-helixtrans-68.8-37175.2-69.4-73.2167-176.4-11.2113.2Q71 F165 C166 M167 V171 E172 N173 L196Q71-R169 VanDerWaalsContact CG-NH2 3.29Å; F165-R169 HydrophobicContact CD1-CG 4.35Å; F165-R169 HydrophobicContact CD2-CG 4.36Å; F165-R169 HydrophobicContact CE1-CG 3.94Å; F165-R169 HydrophobicContact CE2-CG 3.97Å; F165-R169 HydrophobicContact CZ-CG 3.75Å; F165-R169 WeakPolarHBondContact O-CB 3.18Å; F165-R169 WeakPolarHBondContact O-CG 3.5Å; F165-R169 PolarHBondContact O-N 3.43Å; C166-R169 PolarHBondContact O-N 2.9Å; M167-R169 PolarHBondContact O-N 3.3Å; R169-V171 VanDerWaalsContact C-N 3.35Å; R169-E172 WeakPolarHBondContact CD-OE2 3.12Å; R169-E172 IonicContact CZ-OE2 2.74Å; R169-E172 IonicContact NE-OE2 2.73Å; R169-E172 IonicContact NH1-OE2 2.67Å; R169-E172 PolarHBondContact NH1-OE2 2.9Å; R169-N173 WeakPolarHBondContact O-CB 3.32Å; R169-N173 PolarHBondContact O-N 3.35Å; R169-N173 PolarHBondContact O-ND2 3.2Å; R169-L196 HydrophobicContact CB-CD1 3.52Å; R169-L196 HydrophobicContact CB-CD2 3.95Å; R169-L196 HydrophobicContact CB-CG 4.41Å; R169-L196 HydrophobicContact CG-CD2 4.46Å
170V82.6Confident74.3Confident0 Ų047.8 Ų47.80%028%0.278CS..Hα-helixtrans-60.3-48.6172.5166.30000109.9C166 M167 N173 K174 Y193 L196 L197 M243C166-V170 WeakPolarHBondContact O-CG2 3.23Å; C166-V170 PolarHBondContact O-N 3.49Å; M167-V170 WeakPolarHBondContact O-CB 3.22Å; M167-V170 PolarHBondContact O-N 2.82Å; M167-V170 VanDerWaalsContact O-N 3.09Å; V170-N173 PolarHBondContact O-N 3.36Å; V170-K174 PolarHBondContact O-N 3.15Å; V170-K174 VanDerWaalsContact O-N 3.11Å; V170-Y193 HydrophobicContact CG1-CE2 4Å; V170-L196 HydrophobicContact CG2-CB 4.19Å; V170-L197 HydrophobicContact CG1-CD2 4.33Å; V170-L197 HydrophobicContact CG2-CD2 3.74Å; V170-M243 HydrophobicContact CG1-CE 3.88Å; V170-M243 HydrophobicContact CG1-CG 4.22Å
171V84.9Confident73Confident30 Ų3052.4 Ų52.418%0.18231%0.31CS..Hα-helixtrans-58.9-52.5177.8173.80000110.9M167 N168 R169 N173 K174 S175 T238 F242M167-V171 VanDerWaalsContact O-CG2 3.26Å; M167-V171 WeakPolarHBondContact O-CG2 3.43Å; M167-V171 PolarHBondContact O-N 2.62Å; N168-V171 PolarHBondContact O-N 3.17Å; R169-V171 VanDerWaalsContact C-N 3.35Å; V171-N173 VanDerWaalsContact C-N 3.29Å; V171-N173 PolarHBondContact O-N 3.45Å; V171-K174 PolarHBondContact O-N 2.86Å; V171-K174 VanDerWaalsContact O-N 3.17Å; V171-S175 PolarHBondContact O-N 3.4Å; V171-S175 PolarHBondContact O-OG 3.14Å; V171-T238 HydrophobicContact CG2-CG2 3.63Å; V171-F242 HydrophobicContact CB-CD2 4.43Å; V171-F242 HydrophobicContact CB-CG 4.43Å; V171-F242 HydrophobicContact CG1-CD1 4.19Å; V171-F242 HydrophobicContact CG1-CD2 4.35Å; V171-F242 HydrophobicContact CG1-CE1 3.81Å; V171-F242 HydrophobicContact CG1-CE2 4Å; V171-F242 HydrophobicContact CG1-CG 4.46Å; V171-F242 HydrophobicContact CG1-CZ 3.71Å; V171-F242 HydrophobicContact CG2-CD1 4.49Å; V171-F242 HydrophobicContact CG2-CD2 3.6Å; V171-F242 HydrophobicContact CG2-CE2 3.86Å; V171-F242 HydrophobicContact CG2-CG 3.96Å; V171-F242 HydrophobicContact CG2-CZ 4.4Å
172E81.9Confident71.5Confident86 Ų8654.8 Ų54.840%0.40233%0.33SS..Hα-helixtrans-55.6-41.3179.1-78.5172.1-166.200112.6N168 R169 R176N168-E172 WeakPolarHBondContact O-CB 3.38Å; N168-E172 VanDerWaalsContact O-CG 3.26Å; N168-E172 WeakPolarHBondContact O-CG 3.17Å; N168-E172 PolarHBondContact O-N 2.63Å; R169-E172 WeakPolarHBondContact CD-OE2 3.12Å; R169-E172 IonicContact CZ-OE2 2.74Å; R169-E172 IonicContact NE-OE2 2.73Å; R169-E172 IonicContact NH1-OE2 2.67Å; R169-E172 PolarHBondContact NH1-OE2 2.9Å; E172-R176 VanDerWaalsContact O-CD 3.3Å; E172-R176 WeakPolarHBondContact O-CD 3.4Å; E172-R176 VanDerWaalsContact O-CG 3.27Å; E172-R176 WeakPolarHBondContact O-CG 3.36Å
173N74Confident69.9Low42 Ų4261.3 Ų61.323%0.22537%0.365CS..Hα-helixtrans-66.9-44.4178.6-81.5-60.5000111.6R169 V170 V171 R176 S177 Y193R169-N173 WeakPolarHBondContact O-CB 3.32Å; R169-N173 PolarHBondContact O-N 3.35Å; R169-N173 PolarHBondContact O-ND2 3.2Å; V170-N173 PolarHBondContact O-N 3.36Å; V171-N173 VanDerWaalsContact C-N 3.29Å; V171-N173 PolarHBondContact O-N 3.45Å; N173-R176 PolarHBondContact O-N 3.42Å; N173-S177 PolarHBondContact O-N 2.83Å; N173-Y193 HydrophobicContact CB-CD2 4.32Å
174K74.1Confident68.4Low50 Ų5068.8 Ų68.822%0.21741%0.405CS..Hα-helixtrans-70.4-38.9-179.2-165.774.6168.5-168.20112.8V170 V171 R176 S177 N178 F242 N244V170-K174 PolarHBondContact O-N 3.15Å; V170-K174 VanDerWaalsContact O-N 3.11Å; V171-K174 PolarHBondContact O-N 2.86Å; V171-K174 VanDerWaalsContact O-N 3.17Å; K174-R176 PolarHBondContact O-N 3.29Å; K174-R176 VanDerWaalsContact O-N 3.14Å; K174-S177 PolarHBondContact O-N 3.01Å; K174-S177 PolarHBondContact O-OG 2.88Å; K174-N178 PolarHBondContact O-N 3.33Å; K174-F242 HydrophobicContact CB-CB 4.29Å; K174-F242 HydrophobicContact CB-CD1 4.06Å; K174-F242 VanDerWaalsContact CD-O 3.28Å; K174-F242 WeakPolarHBondContact CD-O 3.37Å; K174-F242 HydrophobicContact CG-CB 4.41Å; K174-F242 HydrophobicContact CG-CD1 4.25Å; K174-F242 VanDerWaalsContact CG-O 3.29Å; K174-F242 WeakPolarHBondContact CG-O 3.41Å; K174-N244 PolarHBondContact NZ-OD1 3.39Å; K174-N244 VanDerWaalsContact NZ-OD1 3.09Å
175S74.4Confident67.4Low64 Ų6472.5 Ų72.545%0.44843%0.427SS..Hα-helixtrans-58.3-28.9176.1-58.80000112.4V171V171-S175 PolarHBondContact O-N 3.4Å; V171-S175 PolarHBondContact O-OG 3.14Å
176R65.7Low66.8Low113 Ų11373.8 Ų73.843%0.42644%0.435SS..Hα-helixtrans-82.7-34179.1-66.516889.5164.87.5113.2C127 E172 N173 K174 N178 G179 S180C127-R176 PolarHBondContact SG-NH1 3.47Å; C127-R176 PolarHBondContact SG-NH2 3.04Å; C127-R176 VanDerWaalsContact SG-NH2 3.35Å; E172-R176 VanDerWaalsContact O-CD 3.3Å; E172-R176 WeakPolarHBondContact O-CD 3.4Å; E172-R176 VanDerWaalsContact O-CG 3.27Å; E172-R176 WeakPolarHBondContact O-CG 3.36Å; N173-R176 PolarHBondContact O-N 3.42Å; K174-R176 PolarHBondContact O-N 3.29Å; K174-R176 VanDerWaalsContact O-N 3.14Å; R176-N178 PolarHBondContact O-N 3.33Å; R176-G179 PolarHBondContact O-N 3.29Å; R176-G179 VanDerWaalsContact O-N 3.13Å; R176-S180 PolarHBondContact O-N 3.46Å; R176-S180 PolarHBondContact O-OG 2.98Å
177S65.3Low66.3Low64 Ų6477.5 Ų77.545%0.44846%0.459SS..Hα-helixtrans-62.3-33.6174.171.80000111.5N173 K174 G179N173-S177 PolarHBondContact O-N 2.83Å; K174-S177 PolarHBondContact O-N 3.01Å; K174-S177 PolarHBondContact O-OG 2.88Å; S177-G179 VanDerWaalsContact C-N 3.28Å; S177-G179 PolarHBondContact O-N 3.16Å
178N59Low65.4Low127 Ų12778.3 Ų78.368%0.67946%0.464SS*.THydrogen-bonded Turntrans-72.1-19.5177.4-70.3-1.9000113.6K174 R176K174-N178 PolarHBondContact O-N 3.33Å; R176-N178 PolarHBondContact O-N 3.33Å
179G53.4Low64.7Low73 Ų7375.8 Ų75.875%0.75346%0.455SS*.THydrogen-bonded Turntrans-99.2-10.6179.700000115R176 S177R176-G179 PolarHBondContact O-N 3.29Å; R176-G179 VanDerWaalsContact O-N 3.13Å; S177-G179 VanDerWaalsContact C-N 3.28Å; S177-G179 PolarHBondContact O-N 3.16Å
180S51.7Low64.3Low79 Ų7978.5 Ų78.555%0.55247%0.472SS*.SBendtrans-110.2131.8-175.2-41.90000109.3R176 A182R176-S180 PolarHBondContact O-N 3.46Å; R176-S180 PolarHBondContact O-OG 2.98Å; S180-A182 VanDerWaalsContact C-N 3.35Å; S180-A182 PolarHBondContact O-N 2.94Å
181S42.1Very low63.8Low113 Ų11381.2 Ų81.279%0.7948%0.484SS*.  trans-63.392.9176.360.80000110.9N183S181-N183 PolarHBondContact O-N 3.44Å
182A40.7Very low63.2Low94 Ų9480.5 Ų80.578%0.77748%0.478SS*.SBendtrans31.77.6151.200000122.6S180S180-A182 VanDerWaalsContact C-N 3.35Å; S180-A182 PolarHBondContact O-N 2.94Å
183N42.3Very low63Low144 Ų14478 Ų7877%0.7747%0.465SS*.  trans-129.26.4-163.8-89.5-3.4000116.9S181S181-N183 PolarHBondContact O-N 3.44Å
184D47.8Very low63.3Low157 Ų15778.6 Ų78.684%0.8447%0.473SS*.  trans-131.272.4171.7-81.2-33.6000110.7D186D184-D186 PolarHBondContact O-N 3.36Å
185D62.2Low63.3Low136 Ų13676.7 Ų76.773%0.72747%0.465SS*.  trans-71.278.9164.3-90.3-14.6000108.7P187 L190D185-P187 WeakPolarHBondContact O-CD 3.28Å; D185-L190 HydrophobicContact CB-CD1 3.62Å
186D68.4Low63.6Low55 Ų5573.7 Ų73.729%0.29444%0.444SS..  trans-57.2118.3175179-6.2000109.3L128 D184 V188 A189 L190L128-D186 WeakPolarHBondContact CD2-OD2 3.11Å; D184-D186 PolarHBondContact O-N 3.36Å; D186-V188 PolarHBondContact O-N 2.92Å; D186-V188 VanDerWaalsContact O-N 3.08Å; D186-V188 PolarHBondContact OD1-N 2.85Å; D186-A189 HydrophobicContact CB-CB 4.05Å; D186-A189 WeakPolarHBondContact O-CB 3.44Å; D186-A189 PolarHBondContact O-N 3.19Å; D186-L190 PolarHBondContact O-N 3.34Å
187P69.5Low64.4Low80 Ų8068.9 Ų68.952%0.51943%0.427SS..Hα-helixtrans-57.3-29.3-176.221.4-33.1000112.9D185 K191D185-P187 WeakPolarHBondContact O-CD 3.28Å; P187-K191 WeakPolarHBondContact O-CB 3.17Å; P187-K191 PolarHBondContact O-N 2.86Å
188V66.5Low65.2Low18 Ų1868.7 Ų68.711%0.10942%0.423CS..Hα-helixtrans-75.2-37.4178.8-176.70000111.2L128 D186 K191 F192L128-V188 HydrophobicContact CD2-CB 3.34Å; L128-V188 HydrophobicContact CD2-CG1 3.3Å; L128-V188 HydrophobicContact CD2-CG2 4.11Å; D186-V188 PolarHBondContact O-N 2.92Å; D186-V188 VanDerWaalsContact O-N 3.08Å; D186-V188 PolarHBondContact OD1-N 2.85Å; V188-K191 PolarHBondContact O-N 3.49Å; V188-F192 PolarHBondContact O-N 2.95Å
189A70.2Confident66.1Low34 Ų3462.6 Ų62.628%0.28139%0.39SS..Hα-helixtrans-65.2-43.6175.100000111D186 K191 F192 Y193D186-A189 HydrophobicContact CB-CB 4.05Å; D186-A189 WeakPolarHBondContact O-CB 3.44Å; D186-A189 PolarHBondContact O-N 3.19Å; A189-K191 PolarHBondContact O-N 3.42Å; A189-F192 PolarHBondContact O-N 2.68Å; A189-Y193 PolarHBondContact O-N 3Å
190L73.1Confident67.5Low90 Ų9059.1 Ų59.147%0.47135%0.354SS..Hα-helixtrans-58.8-44.9172.5-96149.2000112.3D185 D186 F192 Y193 S194D185-L190 HydrophobicContact CB-CD1 3.62Å; D186-L190 PolarHBondContact O-N 3.34Å; L190-F192 VanDerWaalsContact C-N 3.33Å; L190-F192 PolarHBondContact O-N 2.84Å; L190-Y193 PolarHBondContact O-N 2.87Å; L190-S194 WeakPolarHBondContact O-CB 3.09Å; L190-S194 PolarHBondContact O-N 2.99Å
191K72.5Confident69Low56 Ų5655.8 Ų55.824%0.24333%0.331CS..Hα-helixtrans-63.2-40.4177.1-175.464.6174.1179.90111.8D110 P187 V188 A189 S194 L195D110-K191 IonicContact OD1-NZ 3.56Å; P187-K191 WeakPolarHBondContact O-CB 3.17Å; P187-K191 PolarHBondContact O-N 2.86Å; V188-K191 PolarHBondContact O-N 3.49Å; A189-K191 PolarHBondContact O-N 3.42Å; K191-S194 PolarHBondContact O-N 3.11Å; K191-L195 WeakPolarHBondContact O-CB 3.36Å; K191-L195 PolarHBondContact O-N 2.87Å
192F72.4Confident70.8Confident16 Ų1650.7 Ų50.77%0.0730%0.295CS..Hα-helixtrans-65.3-45.1177.1-175.2-114.3000112.5P129 L134 L137 V188 A189 L190 S194 L195 L196P129-F192 HydrophobicContact CB-CD1 4.25Å; P129-F192 HydrophobicContact CB-CD2 3.43Å; P129-F192 VanDerWaalsContact CB-CD2 3.43Å; P129-F192 HydrophobicContact CB-CE1 4.2Å; P129-F192 HydrophobicContact CB-CE2 3.41Å; P129-F192 VanDerWaalsContact CB-CE2 3.41Å; P129-F192 HydrophobicContact CB-CG 3.86Å; P129-F192 HydrophobicContact CB-CZ 3.81Å; P129-F192 HydrophobicContact CG-CB 3.38Å; P129-F192 HydrophobicContact CG-CD1 3.54Å; P129-F192 HydrophobicContact CG-CD2 3.15Å; P129-F192 HydrophobicContact CG-CE1 3.98Å; P129-F192 HydrophobicContact CG-CE2 3.66Å; P129-F192 HydrophobicContact CG-CG 3.07Å; P129-F192 HydrophobicContact CG-CZ 4.04Å; L134-F192 HydrophobicContact CD1-CD2 4.02Å; L137-F192 HydrophobicContact CD2-CE2 4.18Å; V188-F192 PolarHBondContact O-N 2.95Å; A189-F192 PolarHBondContact O-N 2.68Å; L190-F192 VanDerWaalsContact C-N 3.33Å; L190-F192 PolarHBondContact O-N 2.84Å; F192-S194 VanDerWaalsContact C-N 3.35Å; F192-S194 PolarHBondContact O-N 3.42Å; F192-L195 PolarHBondContact O-N 3.42Å; F192-L195 VanDerWaalsContact O-N 3.16Å; F192-L196 HydrophobicContact CD1-CD1 3.62Å; F192-L196 HydrophobicContact CD1-CG 4.16Å; F192-L196 HydrophobicContact CE1-CD1 3.43Å; F192-L196 VanDerWaalsContact CE1-CD1 3.43Å; F192-L196 HydrophobicContact CE1-CD2 4.3Å; F192-L196 HydrophobicContact CE1-CG 3.96Å; F192-L196 HydrophobicContact CG-CD1 4.43Å; F192-L196 HydrophobicContact CZ-CD1 4.08Å; F192-L196 HydrophobicContact CZ-CD2 4.11Å; F192-L196 HydrophobicContact CZ-CG 4.14Å; F192-L196 WeakPolarHBondContact O-CG 3.49Å; F192-L196 PolarHBondContact O-N 3.24Å
193Y77.9Confident72.6Confident33 Ų3346.2 Ų46.213%0.12926%0.258CS..Hα-helixtrans-56.4-49.9173.8176.3-95.1000111.1V170 N173 A189 L190 L195 L196 L197 E247V170-Y193 HydrophobicContact CG1-CE2 4Å; N173-Y193 HydrophobicContact CB-CD2 4.32Å; A189-Y193 PolarHBondContact O-N 3Å; L190-Y193 PolarHBondContact O-N 2.87Å; Y193-L195 VanDerWaalsContact C-N 3.27Å; Y193-L195 PolarHBondContact O-N 2.72Å; Y193-L196 WeakPolarHBondContact O-CB 3.47Å; Y193-L196 PolarHBondContact O-N 3.29Å; Y193-L196 VanDerWaalsContact O-N 3.16Å; Y193-L197 HydrophobicContact CD1-CD1 4.05Å; Y193-L197 HydrophobicContact CD1-CG 4.37Å; Y193-L197 HydrophobicContact CE1-CD1 3.33Å; Y193-L197 HydrophobicContact CE1-CG 3.96Å; Y193-L197 HydrophobicContact CE2-CD2 4.49Å; Y193-L197 WeakPolarHBondContact O-CG 3.42Å; Y193-L197 PolarHBondContact O-N 3.37Å; Y193-E247 PolarHBondContact OH-OE2 3.06Å
194S79.3Confident74.5Confident55 Ų5539.3 Ų39.339%0.38522%0.221SC..Hα-helixtrans-56.9-40.2175.8174.90000112.5L190 K191 F192 L197 T198L190-S194 WeakPolarHBondContact O-CB 3.09Å; L190-S194 PolarHBondContact O-N 2.99Å; K191-S194 PolarHBondContact O-N 3.11Å; F192-S194 VanDerWaalsContact C-N 3.35Å; F192-S194 PolarHBondContact O-N 3.42Å; S194-L197 PolarHBondContact O-N 3.08Å; S194-T198 WeakPolarHBondContact O-CB 3.3Å; S194-T198 PolarHBondContact O-N 3.48Å; S194-T198 PolarHBondContact O-OG1 3.11Å
195L75.9Confident76.2Confident10 Ų1037.6 Ų37.65%0.05220%0.203CC..Hα-helixtrans-72.1-36.4178.3-171.966.1000112.6L134 L137 E138 V141 K191 F192 Y193 T198 T199L134-L195 HydrophobicContact CD1-CD2 3.47Å; L134-L195 VanDerWaalsContact CD1-CD2 3.47Å; L134-L195 HydrophobicContact CG-CD2 4.07Å; L137-L195 HydrophobicContact CB-CD2 3.92Å; L137-L195 HydrophobicContact CB-CG 4.47Å; L137-L195 HydrophobicContact CD2-CB 4.24Å; L137-L195 HydrophobicContact CD2-CD2 3.79Å; L137-L195 HydrophobicContact CD2-CG 3.74Å; L137-L195 HydrophobicContact CG-CD2 4Å; L137-L195 HydrophobicContact CG-CG 4.02Å; E138-L195 HydrophobicContact CB-CD2 4.49Å; E138-L195 HydrophobicContact CG-CD1 3.78Å; E138-L195 HydrophobicContact CG-CD2 3.58Å; E138-L195 HydrophobicContact CG-CG 4.34Å; V141-L195 HydrophobicContact CG2-CD1 4.35Å; K191-L195 WeakPolarHBondContact O-CB 3.36Å; K191-L195 PolarHBondContact O-N 2.87Å; F192-L195 PolarHBondContact O-N 3.42Å; F192-L195 VanDerWaalsContact O-N 3.16Å; Y193-L195 VanDerWaalsContact C-N 3.27Å; Y193-L195 PolarHBondContact O-N 2.72Å; L195-T198 PolarHBondContact O-N 2.84Å; L195-T199 WeakPolarHBondContact O-CB 3.43Å; L195-T199 PolarHBondContact O-N 3.34Å; L195-T199 PolarHBondContact O-OG1 2.95Å
196L79.1Confident76.8Confident0 Ų032 Ų320%017%0.173CC..Hα-helixtrans-59.6-48.4172.5-75.5168.8000110.7L137 F165 R169 V170 F192 Y193 T199 F200L137-L196 HydrophobicContact CD2-CD2 3.82Å; L137-L196 HydrophobicContact CD2-CG 4.14Å; F165-L196 HydrophobicContact CE1-CD2 4.39Å; R169-L196 HydrophobicContact CB-CD1 3.52Å; R169-L196 HydrophobicContact CB-CD2 3.95Å; R169-L196 HydrophobicContact CB-CG 4.41Å; R169-L196 HydrophobicContact CG-CD2 4.46Å; V170-L196 HydrophobicContact CG2-CB 4.19Å; F192-L196 HydrophobicContact CD1-CD1 3.62Å; F192-L196 HydrophobicContact CD1-CG 4.16Å; F192-L196 HydrophobicContact CE1-CD1 3.43Å; F192-L196 VanDerWaalsContact CE1-CD1 3.43Å; F192-L196 HydrophobicContact CE1-CD2 4.3Å; F192-L196 HydrophobicContact CE1-CG 3.96Å; F192-L196 HydrophobicContact CG-CD1 4.43Å; F192-L196 HydrophobicContact CZ-CD1 4.08Å; F192-L196 HydrophobicContact CZ-CD2 4.11Å; F192-L196 HydrophobicContact CZ-CG 4.14Å; F192-L196 WeakPolarHBondContact O-CG 3.49Å; F192-L196 PolarHBondContact O-N 3.24Å; Y193-L196 WeakPolarHBondContact O-CB 3.47Å; Y193-L196 PolarHBondContact O-N 3.29Å; Y193-L196 VanDerWaalsContact O-N 3.16Å; L196-T199 PolarHBondContact O-N 3.07Å; L196-F200 WeakPolarHBondContact O-CB 3.4Å; L196-F200 PolarHBondContact O-N 3.14Å
197L82.9Confident77.3Confident13 Ų1329.7 Ų29.77%0.06816%0.16CC..Hα-helixtrans-59.8-49.6175.5-65.2-171.5000110.9V170 Y193 S194 T199 F200 S201 M243 E247 F251V170-L197 HydrophobicContact CG1-CD2 4.33Å; V170-L197 HydrophobicContact CG2-CD2 3.74Å; Y193-L197 HydrophobicContact CD1-CD1 4.05Å; Y193-L197 HydrophobicContact CD1-CG 4.37Å; Y193-L197 HydrophobicContact CE1-CD1 3.33Å; Y193-L197 HydrophobicContact CE1-CG 3.96Å; Y193-L197 HydrophobicContact CE2-CD2 4.49Å; Y193-L197 WeakPolarHBondContact O-CG 3.42Å; Y193-L197 PolarHBondContact O-N 3.37Å; S194-L197 PolarHBondContact O-N 3.08Å; L197-T199 PolarHBondContact O-N 3.22Å; L197-F200 WeakPolarHBondContact O-CB 3.22Å; L197-F200 PolarHBondContact O-N 3.32Å; L197-F200 VanDerWaalsContact O-N 3.08Å; L197-S201 PolarHBondContact O-N 2.93Å; L197-S201 PolarHBondContact O-OG 3.48Å; L197-M243 HydrophobicContact CD2-CE 3.56Å; L197-M243 HydrophobicContact CD2-CG 4.48Å; L197-M243 HydrophobicContact CD2-SD 3.96Å; L197-E247 VanDerWaalsContact CD1-CD 3.44Å; L197-E247 HydrophobicContact CD1-CG 4.16Å; L197-E247 VanDerWaalsContact CD1-OE1 3.27Å; L197-E247 WeakPolarHBondContact CD1-OE1 3.44Å; L197-F251 HydrophobicContact CB-CE2 4.31Å; L197-F251 HydrophobicContact CB-CZ 4.18Å; L197-F251 HydrophobicContact CD2-CE2 3.93Å; L197-F251 HydrophobicContact CD2-CZ 4.17Å
198T82Confident78Confident59 Ų5926.5 Ų26.536%0.36214%0.14SC..Hα-helixtrans-57.1-40.5178.7-58.40000111.8V141 S194 L195 S202V141-T198 HydrophobicContact CG1-CG2 4.21Å; V141-T198 HydrophobicContact CG2-CG2 4.41Å; S194-T198 WeakPolarHBondContact O-CB 3.3Å; S194-T198 PolarHBondContact O-N 3.48Å; S194-T198 PolarHBondContact O-OG1 3.11Å; L195-T198 PolarHBondContact O-N 2.84Å; T198-S202 VanDerWaalsContact O-CB 3.3Å; T198-S202 WeakPolarHBondContact O-CB 3.36Å; T198-S202 PolarHBondContact O-N 2.95Å; T198-S202 PolarHBondContact O-OG 3.16Å
199T78.8Confident78.7Confident0 Ų031.6 Ų31.60%017%0.166CC..Hα-helixtrans-65.1-48.9176-55.50000110.9L137 L140 V141 L195 L196 L197 S201 S202 L203L137-T199 HydrophobicContact CD1-CG2 3.63Å; L137-T199 WeakPolarHBondContact CD1-OG1 3.47Å; L137-T199 HydrophobicContact CG-CG2 4.38Å; L137-T199 VanDerWaalsContact CG-OG1 3.26Å; L137-T199 WeakPolarHBondContact CG-OG1 3.42Å; L140-T199 HydrophobicContact CD2-CG2 3.52Å; L140-T199 HydrophobicContact CG-CG2 4.31Å; V141-T199 HydrophobicContact CG2-CG2 4.31Å; V141-T199 VanDerWaalsContact CG2-OG1 3.22Å; V141-T199 WeakPolarHBondContact CG2-OG1 3.25Å; L195-T199 WeakPolarHBondContact O-CB 3.43Å; L195-T199 PolarHBondContact O-N 3.34Å; L195-T199 PolarHBondContact O-OG1 2.95Å; L196-T199 PolarHBondContact O-N 3.07Å; L197-T199 PolarHBondContact O-N 3.22Å; T199-S201 VanDerWaalsContact C-N 3.33Å; T199-S201 PolarHBondContact O-N 3.42Å; T199-S202 PolarHBondContact O-N 3.42Å; T199-S202 VanDerWaalsContact O-N 3.11Å; T199-L203 HydrophobicContact CG2-CD1 4.02Å; T199-L203 HydrophobicContact CG2-CG 4.28Å; T199-L203 VanDerWaalsContact O-CG 3.31Å; T199-L203 WeakPolarHBondContact O-CG 3.41Å; T199-L203 PolarHBondContact O-N 2.83Å
200F82.5Confident79Confident0 Ų031 Ų310%016%0.158CC..Hα-helixtrans-59.4-45.4179.7-165.6-120.7000111.4F163 C166 M167 L196 L197 S202 L203 F204 F251 F255F163-F200 HydrophobicContact CB-CE2 4.09Å; F163-F200 AromaticContact CD1-CD2 3.99Å; F163-F200 HydrophobicContact CD1-CD2 3.99Å; F163-F200 AromaticContact CD1-CE2 3.67Å; F163-F200 HydrophobicContact CD1-CE2 3.67Å; F163-F200 HydrophobicContact CG-CE2 4.39Å; C166-F200 HydrophobicContact CB-CB 4.28Å; C166-F200 HydrophobicContact CB-CD2 3.93Å; C166-F200 HydrophobicContact CB-CG 4.46Å; M167-F200 HydrophobicContact CG-CD1 4.37Å; M167-F200 HydrophobicContact CG-CD2 4.05Å; M167-F200 HydrophobicContact CG-CE1 3.75Å; M167-F200 HydrophobicContact CG-CE2 3.31Å; M167-F200 HydrophobicContact CG-CZ 3.13Å; M167-F200 HydrophobicContact SD-CD1 3.68Å; M167-F200 HydrophobicContact SD-CD2 4.35Å; M167-F200 HydrophobicContact SD-CE1 3.25Å; M167-F200 WeakPolarHBondContact SD-CE1 3.41Å; M167-F200 HydrophobicContact SD-CE2 3.94Å; M167-F200 HydrophobicContact SD-CG 4.23Å; M167-F200 HydrophobicContact SD-CZ 3.37Å; M167-F200 WeakPolarHBondContact SD-CZ 3.26Å; L196-F200 WeakPolarHBondContact O-CB 3.4Å; L196-F200 PolarHBondContact O-N 3.14Å; L197-F200 WeakPolarHBondContact O-CB 3.22Å; L197-F200 PolarHBondContact O-N 3.32Å; L197-F200 VanDerWaalsContact O-N 3.08Å; F200-S202 VanDerWaalsContact C-N 3.33Å; F200-S202 PolarHBondContact O-N 3.5Å; F200-L203 PolarHBondContact O-N 3.48Å; F200-F204 HydrophobicContact CD1-CD2 4.31Å; F200-F204 HydrophobicContact CD2-CD2 4.32Å; F200-F204 HydrophobicContact CD2-CE2 4.21Å; F200-F204 HydrophobicContact CE1-CD2 4.02Å; F200-F204 AromaticContact CE1-CE2 3.85Å; F200-F204 HydrophobicContact CE1-CE2 3.85Å; F200-F204 HydrophobicContact CE2-CD2 4.07Å; F200-F204 AromaticContact CE2-CE2 3.54Å; F200-F204 HydrophobicContact CE2-CE2 3.54Å; F200-F204 HydrophobicContact CG-CD2 4.44Å; F200-F204 AromaticContact CZ-CD2 3.91Å; F200-F204 HydrophobicContact CZ-CD2 3.91Å; F200-F204 AromaticContact CZ-CE2 3.32Å; F200-F204 HydrophobicContact CZ-CE2 3.32Å; F200-F204 HydrophobicContact CZ-CZ 4.35Å; F200-F204 PolarHBondContact O-N 3.44Å; F200-F251 HydrophobicContact CB-CE1 4.13Å; F200-F251 HydrophobicContact CB-CZ 4.32Å; F200-F251 AromaticContact CD1-CD1 3.78Å; F200-F251 HydrophobicContact CD1-CD1 3.78Å; F200-F251 AromaticContact CD1-CE1 3.28Å; F200-F251 HydrophobicContact CD1-CE1 3.28Å; F200-F251 AromaticContact CD1-CZ 3.89Å; F200-F251 HydrophobicContact CD1-CZ 3.89Å; F200-F251 HydrophobicContact CE1-CD1 4.12Å; F200-F251 HydrophobicContact CE1-CE1 4.09Å; F200-F251 HydrophobicContact CG-CE1 4.11Å; F200-F255 AromaticContact CE1-CE2 3.78Å; F200-F255 HydrophobicContact CE1-CE2 3.78Å; F200-F255 AromaticContact CE1-CZ 3.48Å; F200-F255 HydrophobicContact CE1-CZ 3.48Å; F200-F255 VanDerWaalsContact CE1-CZ 3.48Å; F200-F255 HydrophobicContact CZ-CE2 4.34Å; F200-F255 AromaticContact CZ-CZ 3.58Å; F200-F255 HydrophobicContact CZ-CZ 3.58Å
201S83.7Confident79.5Confident8 Ų826.7 Ų26.76%0.05614%0.136CC..Hα-helixtrans-61.7-40.5174.4-49.70000111.8L197 T199 F204 R205 F251L197-S201 PolarHBondContact O-N 2.93Å; L197-S201 PolarHBondContact O-OG 3.48Å; T199-S201 VanDerWaalsContact C-N 3.33Å; T199-S201 PolarHBondContact O-N 3.42Å; S201-F204 PolarHBondContact O-N 3.2Å; S201-R205 WeakPolarHBondContact O-CB 3.41Å; S201-R205 VanDerWaalsContact O-CG 3.32Å; S201-R205 WeakPolarHBondContact O-CG 3.48Å; S201-R205 PolarHBondContact O-N 3.46Å; S201-F251 WeakPolarHBondContact OG-CE1 3.46Å; S201-F251 WeakPolarHBondContact OG-CZ 3.48Å
202S78.4Confident80.2Confident6 Ų628 Ų284%0.04215%0.145CC..Hα-helixtrans-67.5-39.7-179.9-59.80000111.8T198 T199 F200 R205 F206T198-S202 VanDerWaalsContact O-CB 3.3Å; T198-S202 WeakPolarHBondContact O-CB 3.36Å; T198-S202 PolarHBondContact O-N 2.95Å; T198-S202 PolarHBondContact O-OG 3.16Å; T199-S202 PolarHBondContact O-N 3.42Å; T199-S202 VanDerWaalsContact O-N 3.11Å; F200-S202 VanDerWaalsContact C-N 3.33Å; F200-S202 PolarHBondContact O-N 3.5Å; S202-R205 PolarHBondContact O-N 3.26Å; S202-F206 WeakPolarHBondContact O-CB 3.43Å; S202-F206 PolarHBondContact O-N 3.02Å
203L78.5Confident80.8Confident0 Ų033.1 Ų33.10%017%0.173CC..Hα-helixtrans-65.7-40.2174.7-68.3172.9000111.4I156 M162 F163 T199 F200 F206 L207I156-L203 HydrophobicContact CD1-CD2 3.96Å; M162-L203 HydrophobicContact CB-CD1 4.38Å; F163-L203 HydrophobicContact CD1-CB 4.18Å; F163-L203 HydrophobicContact CD1-CD1 4.45Å; F163-L203 HydrophobicContact CE1-CB 3.38Å; F163-L203 HydrophobicContact CE1-CD1 4.38Å; F163-L203 HydrophobicContact CE1-CG 4.49Å; F163-L203 HydrophobicContact CE2-CB 4.47Å; F163-L203 HydrophobicContact CZ-CB 3.53Å; T199-L203 HydrophobicContact CG2-CD1 4.02Å; T199-L203 HydrophobicContact CG2-CG 4.28Å; T199-L203 VanDerWaalsContact O-CG 3.31Å; T199-L203 WeakPolarHBondContact O-CG 3.41Å; T199-L203 PolarHBondContact O-N 2.83Å; F200-L203 PolarHBondContact O-N 3.48Å; L203-F206 WeakPolarHBondContact O-CB 3.39Å; L203-F206 PolarHBondContact O-N 3.44Å; L203-L207 PolarHBondContact O-N 3.46Å
204F82.6Confident80.9Confident0 Ų033.6 Ų33.60%018%0.178CC..Hα-helixtrans-69.7-39.3175.1-94.3-74.3000113.5F163 F200 S201 F206 L207 C208 F255 F258F163-F204 AromaticContact CD1-CD2 3.9Å; F163-F204 HydrophobicContact CD1-CD2 3.9Å; F163-F204 AromaticContact CD1-CE2 3.36Å; F163-F204 HydrophobicContact CD1-CE2 3.36Å; F163-F204 AromaticContact CD1-CZ 3.9Å; F163-F204 HydrophobicContact CD1-CZ 3.9Å; F163-F204 AromaticContact CE1-CD2 3.62Å; F163-F204 HydrophobicContact CE1-CD2 3.62Å; F163-F204 HydrophobicContact CE1-CE1 4.49Å; F163-F204 AromaticContact CE1-CE2 3.46Å; F163-F204 HydrophobicContact CE1-CE2 3.46Å; F163-F204 VanDerWaalsContact CE1-CE2 3.46Å; F163-F204 HydrophobicContact CE1-CG 4.17Å; F163-F204 AromaticContact CE1-CZ 3.9Å; F163-F204 HydrophobicContact CE1-CZ 3.9Å; F200-F204 HydrophobicContact CD1-CD2 4.31Å; F200-F204 HydrophobicContact CD2-CD2 4.32Å; F200-F204 HydrophobicContact CD2-CE2 4.21Å; F200-F204 HydrophobicContact CE1-CD2 4.02Å; F200-F204 AromaticContact CE1-CE2 3.85Å; F200-F204 HydrophobicContact CE1-CE2 3.85Å; F200-F204 HydrophobicContact CE2-CD2 4.07Å; F200-F204 AromaticContact CE2-CE2 3.54Å; F200-F204 HydrophobicContact CE2-CE2 3.54Å; F200-F204 HydrophobicContact CG-CD2 4.44Å; F200-F204 AromaticContact CZ-CD2 3.91Å; F200-F204 HydrophobicContact CZ-CD2 3.91Å; F200-F204 AromaticContact CZ-CE2 3.32Å; F200-F204 HydrophobicContact CZ-CE2 3.32Å; F200-F204 HydrophobicContact CZ-CZ 4.35Å; F200-F204 PolarHBondContact O-N 3.44Å; S201-F204 PolarHBondContact O-N 3.2Å; F204-F206 VanDerWaalsContact C-N 3.27Å; F204-F206 PolarHBondContact O-N 2.78Å; F204-L207 HydrophobicContact CD1-CD1 4.24Å; F204-L207 HydrophobicContact CE1-CD1 4.07Å; F204-L207 WeakPolarHBondContact O-CB 3.48Å; F204-L207 PolarHBondContact O-N 3.44Å; F204-L207 VanDerWaalsContact O-N 3.16Å; F204-C208 PolarHBondContact O-N 2.97Å; F204-C208 PolarHBondContact O-SG 2.96Å; F204-F255 HydrophobicContact CD1-CD1 4.07Å; F204-F255 HydrophobicContact CD1-CE1 4.07Å; F204-F255 HydrophobicContact CD2-CE1 4.11Å; F204-F255 HydrophobicContact CD2-CE2 4.38Å; F204-F255 AromaticContact CD2-CZ 3.85Å; F204-F255 HydrophobicContact CD2-CZ 3.85Å; F204-F255 AromaticContact CE1-CD1 3.51Å; F204-F255 HydrophobicContact CE1-CD1 3.51Å; F204-F255 AromaticContact CE1-CE1 3.33Å; F204-F255 HydrophobicContact CE1-CE1 3.33Å; F204-F255 HydrophobicContact CE1-CG 4.44Å; F204-F255 HydrophobicContact CE1-CZ 4.08Å; F204-F255 HydrophobicContact CE2-CD1 4.3Å; F204-F255 AromaticContact CE2-CE1 3.38Å; F204-F255 HydrophobicContact CE2-CE1 3.38Å; F204-F255 HydrophobicContact CE2-CE2 4.26Å; F204-F255 AromaticContact CE2-CZ 3.32Å; F204-F255 HydrophobicContact CE2-CZ 3.32Å; F204-F255 HydrophobicContact CG-CE1 4.43Å; F204-F255 HydrophobicContact CG-CZ 4.44Å; F204-F255 AromaticContact CZ-CD1 3.69Å; F204-F255 HydrophobicContact CZ-CD1 3.69Å; F204-F255 AromaticContact CZ-CE1 2.96Å; F204-F255 HydrophobicContact CZ-CE1 2.96Å; F204-F255 AromaticContact CZ-CZ 3.49Å; F204-F255 HydrophobicContact CZ-CZ 3.49Å; F204-F255 VanDerWaalsContact CZ-CZ 3.49Å; F204-F258 HydrophobicContact CE1-CD1 4.34Å
205R82.9Confident81Confident121 Ų12135.5 Ų35.546%0.45718%0.184SC..Hα-helixtrans-59.7-41.9171.1-77.4178.9-176126.93.1111.2S201 S202 C208 N209 L254S201-R205 WeakPolarHBondContact O-CB 3.41Å; S201-R205 VanDerWaalsContact O-CG 3.32Å; S201-R205 WeakPolarHBondContact O-CG 3.48Å; S201-R205 PolarHBondContact O-N 3.46Å; S202-R205 PolarHBondContact O-N 3.26Å; R205-C208 PolarHBondContact O-N 3.37Å; R205-N209 VanDerWaalsContact O-CG 3.29Å; R205-N209 PolarHBondContact O-N 3.36Å; R205-N209 PolarHBondContact O-ND2 3.25Å; R205-L254 HydrophobicContact CG-CD1 4.36Å; R205-L254 HydrophobicContact CG-CD2 3.51Å
206F76.2Confident81.2Confident19 Ų1939.8 Ų39.88%0.08321%0.207CC..Hα-helixtrans-59.6-46.6173.6177-92.5000111.1F152 I156 S202 L203 F204 C208 N209 L210F152-F206 HydrophobicContact CD1-CD2 4.24Å; F152-F206 AromaticContact CD1-CE1 3.9Å; F152-F206 HydrophobicContact CD1-CE1 3.9Å; F152-F206 AromaticContact CD1-CE2 3.45Å; F152-F206 HydrophobicContact CD1-CE2 3.45Å; F152-F206 VanDerWaalsContact CD1-CE2 3.45Å; F152-F206 AromaticContact CD1-CZ 3.24Å; F152-F206 HydrophobicContact CD1-CZ 3.24Å; F152-F206 HydrophobicContact CE1-CD1 4.23Å; F152-F206 AromaticContact CE1-CD2 3.85Å; F152-F206 HydrophobicContact CE1-CD2 3.85Å; F152-F206 AromaticContact CE1-CE1 3.93Å; F152-F206 HydrophobicContact CE1-CE1 3.93Å; F152-F206 AromaticContact CE1-CE2 3.54Å; F152-F206 HydrophobicContact CE1-CE2 3.54Å; F152-F206 HydrophobicContact CE1-CG 4.19Å; F152-F206 AromaticContact CE1-CZ 3.58Å; F152-F206 HydrophobicContact CE1-CZ 3.58Å; F152-F206 HydrophobicContact CG-CZ 4.39Å; I156-F206 HydrophobicContact CB-CD1 4.43Å; I156-F206 HydrophobicContact CB-CE1 3.98Å; I156-F206 HydrophobicContact CD1-CD1 3.4Å; I156-F206 VanDerWaalsContact CD1-CD1 3.4Å; I156-F206 HydrophobicContact CD1-CE1 3.54Å; I156-F206 HydrophobicContact CD1-CG 4.08Å; I156-F206 HydrophobicContact CD1-CZ 4.32Å; I156-F206 HydrophobicContact CG1-CD1 4.4Å; I156-F206 HydrophobicContact CG1-CE1 4.13Å; I156-F206 HydrophobicContact CG2-CD1 4.01Å; I156-F206 HydrophobicContact CG2-CE1 3.94Å; S202-F206 WeakPolarHBondContact O-CB 3.43Å; S202-F206 PolarHBondContact O-N 3.02Å; L203-F206 WeakPolarHBondContact O-CB 3.39Å; L203-F206 PolarHBondContact O-N 3.44Å; F204-F206 VanDerWaalsContact C-N 3.27Å; F204-F206 PolarHBondContact O-N 2.78Å; F206-C208 PolarHBondContact O-N 3.32Å; F206-N209 PolarHBondContact O-N 3.28Å; F206-L210 HydrophobicContact CE1-CB 4.47Å; F206-L210 HydrophobicContact CE1-CD1 4Å; F206-L210 HydrophobicContact CE1-CD2 4.21Å; F206-L210 HydrophobicContact CE1-CG 4.5Å; F206-L210 HydrophobicContact CZ-CD1 3.79Å; F206-L210 VanDerWaalsContact O-CB 3.28Å; F206-L210 WeakPolarHBondContact O-CB 3.38Å; F206-L210 PolarHBondContact O-N 2.99Å
207L78.6Confident81.2Confident5 Ų540.4 Ų40.43%0.02621%0.211CC..Hα-helixtrans-60.4-42.4175.1-77178000113.1I156 F163 L203 F204 N209 L210 S211 F227 F258I156-L207 HydrophobicContact CG2-CD2 4.15Å; F163-L207 HydrophobicContact CE1-CD1 3.81Å; F163-L207 HydrophobicContact CE2-CD1 3.84Å; F163-L207 HydrophobicContact CE2-CG 4.43Å; F163-L207 HydrophobicContact CZ-CD1 3.23Å; F163-L207 HydrophobicContact CZ-CG 3.77Å; L203-L207 PolarHBondContact O-N 3.46Å; F204-L207 HydrophobicContact CD1-CD1 4.24Å; F204-L207 HydrophobicContact CE1-CD1 4.07Å; F204-L207 WeakPolarHBondContact O-CB 3.48Å; F204-L207 PolarHBondContact O-N 3.44Å; F204-L207 VanDerWaalsContact O-N 3.16Å; L207-N209 VanDerWaalsContact C-N 3.33Å; L207-N209 PolarHBondContact O-N 2.69Å; L207-L210 HydrophobicContact CD2-CD2 4.28Å; L207-L210 WeakPolarHBondContact O-CB 3.42Å; L207-L210 PolarHBondContact O-N 3.35Å; L207-L210 VanDerWaalsContact O-N 3.14Å; L207-S211 WeakPolarHBondContact O-CB 3.06Å; L207-S211 PolarHBondContact O-N 2.82Å; L207-S211 PolarHBondContact O-OG 3.49Å; L207-F227 HydrophobicContact CD1-CE1 3.89Å; L207-F227 HydrophobicContact CD1-CZ 3.72Å; L207-F258 HydrophobicContact CB-CD2 4.06Å; L207-F258 HydrophobicContact CB-CE2 4.39Å
208C85.1Confident81.3Confident14 Ų1439.8 Ų39.810%0.09521%0.207CC..Hα-helixtrans-58.6-47176.4-66.30000111F204 R205 F206 L210 S211 N212 L254 N261F204-C208 PolarHBondContact O-N 2.97Å; F204-C208 PolarHBondContact O-SG 2.96Å; R205-C208 PolarHBondContact O-N 3.37Å; F206-C208 PolarHBondContact O-N 3.32Å; C208-L210 VanDerWaalsContact C-N 3.26Å; C208-L210 PolarHBondContact O-N 2.81Å; C208-S211 PolarHBondContact O-OG 2.98Å; C208-N212 WeakPolarHBondContact O-CB 3.24Å; C208-N212 PolarHBondContact O-N 3.38Å; C208-N212 VanDerWaalsContact O-N 3.17Å; C208-L254 PolarHBondContact SG-O 3.49Å; C208-L254 VanDerWaalsContact SG-O 3.41Å; C208-N261 PolarHBondContact O-ND2 3.45Å
209N80.1Confident81.4Confident125 Ų12539.5 Ų39.567%0.66821%0.208SC*.Hα-helixtrans-64.1-35.3177.4-68.5-19.7000111.9R205 F206 L207R205-N209 VanDerWaalsContact O-CG 3.29Å; R205-N209 PolarHBondContact O-N 3.36Å; R205-N209 PolarHBondContact O-ND2 3.25Å; F206-N209 PolarHBondContact O-N 3.28Å; L207-N209 VanDerWaalsContact C-N 3.33Å; L207-N209 PolarHBondContact O-N 2.69Å
210L77Confident81.4Confident20 Ų2042 Ų4211%0.10522%0.218CC..Hα-helixtrans-71.3-43.8-178.4-166.883000112.5M153 F206 L207 C208 N212 N214 C217M153-L210 HydrophobicContact CB-CD1 4.08Å; M153-L210 HydrophobicContact CG-CD1 3.43Å; M153-L210 VanDerWaalsContact CG-CD1 3.43Å; M153-L210 HydrophobicContact SD-CD1 3.28Å; M153-L210 WeakPolarHBondContact SD-CD1 3.38Å; M153-L210 HydrophobicContact SD-CG 4.25Å; F206-L210 HydrophobicContact CE1-CB 4.47Å; F206-L210 HydrophobicContact CE1-CD1 4Å; F206-L210 HydrophobicContact CE1-CD2 4.21Å; F206-L210 HydrophobicContact CE1-CG 4.5Å; F206-L210 HydrophobicContact CZ-CD1 3.79Å; F206-L210 VanDerWaalsContact O-CB 3.28Å; F206-L210 WeakPolarHBondContact O-CB 3.38Å; F206-L210 PolarHBondContact O-N 2.99Å; L207-L210 HydrophobicContact CD2-CD2 4.28Å; L207-L210 WeakPolarHBondContact O-CB 3.42Å; L207-L210 PolarHBondContact O-N 3.35Å; L207-L210 VanDerWaalsContact O-N 3.14Å; C208-L210 VanDerWaalsContact C-N 3.26Å; C208-L210 PolarHBondContact O-N 2.81Å; L210-N212 VanDerWaalsContact C-N 3.35Å; L210-N214 WeakPolarHBondContact O-CB 3.31Å; L210-N214 PolarHBondContact O-ND2 2.76Å; L210-C217 WeakPolarHBondContact CD2-SG 3.45Å; L210-C217 HydrophobicContact CG-CB 4.37Å; L210-C217 VanDerWaalsContact CG-SG 3.57Å
211S83.2Confident81.4Confident1 Ų142.4 Ų42.41%0.00722%0.221CC..Hα-helixtrans-78.5-20.9-176.857.80000112.8L207 C208 N213 N214 N261L207-S211 WeakPolarHBondContact O-CB 3.06Å; L207-S211 PolarHBondContact O-N 2.82Å; L207-S211 PolarHBondContact O-OG 3.49Å; C208-S211 PolarHBondContact O-OG 2.98Å; S211-N213 PolarHBondContact O-N 2.77Å; S211-N213 VanDerWaalsContact O-N 3.15Å; S211-N214 PolarHBondContact O-N 3.18Å; S211-N261 WeakPolarHBondContact OG-CB 3.21Å
212N86.9Confident81.6Confident82 Ų8242.8 Ų42.844%0.43922%0.223SC..THydrogen-bonded Turntrans-61.5115.3179.5-1748.6000111.4C208 L210 N214C208-N212 WeakPolarHBondContact O-CB 3.24Å; C208-N212 PolarHBondContact O-N 3.38Å; C208-N212 VanDerWaalsContact O-N 3.17Å; L210-N212 VanDerWaalsContact C-N 3.35Å; N212-N214 PolarHBondContact O-N 3.44Å
213N84.5Confident81.9Confident124 Ų12449 Ų4966%0.66325%0.252SS*.THydrogen-bonded Turntrans51.635.3-179.3-64.5-55000114.1S211S211-N213 PolarHBondContact O-N 2.77Å; S211-N213 VanDerWaalsContact O-N 3.15Å
214N80.4Confident82.1Confident43 Ų4352.3 Ų52.323%0.2326%0.264CS..  trans-126.586.9-176.8-171.6-14.9000112L210 S211 N212 L216 C217 C218L210-N214 WeakPolarHBondContact O-CB 3.31Å; L210-N214 PolarHBondContact O-ND2 2.76Å; S211-N214 PolarHBondContact O-N 3.18Å; N212-N214 PolarHBondContact O-N 3.44Å; N214-L216 VanDerWaalsContact C-N 3.3Å; N214-L216 PolarHBondContact O-N 2.65Å; N214-C217 HydrophobicContact CB-CB 3.91Å; N214-C217 WeakPolarHBondContact ND2-CB 3.25Å; N214-C217 WeakPolarHBondContact O-CB 3.12Å; N214-C217 PolarHBondContact O-N 3.12Å; N214-C217 VanDerWaalsContact O-N 3.09Å; N214-C217 WeakPolarHBondContact OD1-CB 3.18Å; N214-C217 PolarHBondContact OD1-N 3.37Å; N214-C217 VanDerWaalsContact OD1-N 3.16Å; N214-C218 PolarHBondContact O-N 3.09Å; N214-C218 VanDerWaalsContact O-N 3.15Å
215D81.1Confident82.2Confident95 Ų9555.4 Ų55.451%0.50829%0.286SS..Hα-helixtrans-60.8-41.2-172.2-65.8-14.6000113.3C217 C218 S219 H266D215-C217 VanDerWaalsContact C-N 3.3Å; D215-C217 PolarHBondContact O-N 3.37Å; D215-C218 PolarHBondContact O-N 2.67Å; D215-S219 WeakPolarHBondContact O-CB 3.02Å; D215-S219 PolarHBondContact O-N 3.05Å; D215-S219 PolarHBondContact O-OG 3.04Å; D215-S219 VanDerWaalsContact O-OG 3.14Å; D215-H266 WeakPolarHBondContact CA-CE1 3.19Å; D215-H266 WeakPolarHBondContact CA-NE2 3.42Å; D215-H266 PolarHBondContact O-CE1 3.44Å; D215-H266 VanDerWaalsContact O-CE1 3.28Å; D215-H266 IonicContact OD1-CE1 3.37Å; D215-H266 IonicContact OD1-NE2 2.76Å; D215-H266 PolarHBondContact OD1-NE2 3.27Å
216L80.7Confident82.4Confident101 Ų10153.5 Ų53.553%0.52929%0.285SS..Hα-helixtrans-63.4-38.9179.5-177.765.4000111.4N214 K220N214-L216 VanDerWaalsContact C-N 3.3Å; N214-L216 PolarHBondContact O-N 2.65Å; L216-K220 HydrophobicContact CG-CD 4.38Å; L216-K220 VanDerWaalsContact O-CB 3.26Å; L216-K220 WeakPolarHBondContact O-CB 3.16Å; L216-K220 VanDerWaalsContact O-CG 3.27Å; L216-K220 WeakPolarHBondContact O-CG 3.5Å; L216-K220 PolarHBondContact O-N 2.82Å
217C79.7Confident83Confident13 Ų1353.1 Ų53.19%0.08828%0.283CS..Hα-helixtrans-62.3-51.1176.11740000110.9L210 N214 D215 S219 K220 L221L210-C217 WeakPolarHBondContact CD2-SG 3.45Å; L210-C217 HydrophobicContact CG-CB 4.37Å; L210-C217 VanDerWaalsContact CG-SG 3.57Å; N214-C217 HydrophobicContact CB-CB 3.91Å; N214-C217 WeakPolarHBondContact ND2-CB 3.25Å; N214-C217 WeakPolarHBondContact O-CB 3.12Å; N214-C217 PolarHBondContact O-N 3.12Å; N214-C217 VanDerWaalsContact O-N 3.09Å; N214-C217 WeakPolarHBondContact OD1-CB 3.18Å; N214-C217 PolarHBondContact OD1-N 3.37Å; N214-C217 VanDerWaalsContact OD1-N 3.16Å; D215-C217 VanDerWaalsContact C-N 3.3Å; D215-C217 PolarHBondContact O-N 3.37Å; C217-S219 PolarHBondContact O-N 3.32Å; C217-K220 CarbonylContact O-C 3.51Å; C217-K220 WeakPolarHBondContact O-CB 3.34Å; C217-K220 PolarHBondContact O-N 3.29Å; C217-K220 VanDerWaalsContact O-N 3.17Å; C217-L221 WeakPolarHBondContact O-CB 3.32Å; C217-L221 WeakPolarHBondContact O-CG 3.12Å; C217-L221 PolarHBondContact O-N 2.9Å
218C85.5Confident83.5Confident0 Ų052.9 Ų52.90%028%0.282CS..Hα-helixtrans-68.5-35.7-177.3-65.20000112.6N214 D215 K220 L221 S222 F262 H266N214-C218 PolarHBondContact O-N 3.09Å; N214-C218 VanDerWaalsContact O-N 3.15Å; D215-C218 PolarHBondContact O-N 2.67Å; C218-K220 PolarHBondContact O-N 3.18Å; C218-L221 PolarHBondContact O-N 3.22Å; C218-S222 PolarHBondContact O-N 2.88Å; C218-S222 PolarHBondContact O-OG 3.16Å; C218-F262 HydrophobicContact CB-CD2 4.06Å; C218-F262 HydrophobicContact CB-CE2 4.46Å; C218-F262 WeakPolarHBondContact O-CE2 3.27Å; C218-H266 WeakPolarHBondContact CB-CD2 3.35Å; C218-H266 WeakPolarHBondContact CB-NE2 3.17Å
219S82.7Confident83.8Confident53 Ų5354.2 Ų54.237%0.37129%0.287SS..Hα-helixtrans-59.3-46.7168.7-65.40000111.5D215 C217 L221 S222 E223D215-S219 WeakPolarHBondContact O-CB 3.02Å; D215-S219 PolarHBondContact O-N 3.05Å; D215-S219 PolarHBondContact O-OG 3.04Å; D215-S219 VanDerWaalsContact O-OG 3.14Å; C217-S219 PolarHBondContact O-N 3.32Å; S219-L221 VanDerWaalsContact C-N 3.32Å; S219-L221 PolarHBondContact O-N 2.9Å; S219-S222 VanDerWaalsContact O-CB 3.3Å; S219-S222 WeakPolarHBondContact O-CB 3.41Å; S219-S222 PolarHBondContact O-N 3.33Å; S219-S222 VanDerWaalsContact O-N 3.12Å; S219-E223 PolarHBondContact O-N 3.11Å
220K79.1Confident84.3Confident51 Ų5149.3 Ų49.322%0.22226%0.259CS..Hα-helixtrans-65.1-31.9177.6-83-176.1170.4-176.60113.8D154 R157 L216 C217 C218D154-K220 IonicContact OD1-NZ 3.88Å; D154-K220 PolarHBondContact OD1-NZ 3.32Å; R157-K220 VanDerWaalsContact CZ-CB 3.49Å; R157-K220 VanDerWaalsContact CZ-CG 3.45Å; R157-K220 PolarHBondContact NE-O 3.07Å; R157-K220 PolarHBondContact NH2-O 3.3Å; R157-K220 VanDerWaalsContact NH2-O 3.09Å; L216-K220 HydrophobicContact CG-CD 4.38Å; L216-K220 VanDerWaalsContact O-CB 3.26Å; L216-K220 WeakPolarHBondContact O-CB 3.16Å; L216-K220 VanDerWaalsContact O-CG 3.27Å; L216-K220 WeakPolarHBondContact O-CG 3.5Å; L216-K220 PolarHBondContact O-N 2.82Å; C217-K220 CarbonylContact O-C 3.51Å; C217-K220 WeakPolarHBondContact O-CB 3.34Å; C217-K220 PolarHBondContact O-N 3.29Å; C217-K220 VanDerWaalsContact O-N 3.17Å; C218-K220 PolarHBondContact O-N 3.18Å
221L83.5Confident85Confident9 Ų948.4 Ų48.45%0.04726%0.255CS..Hα-helixtrans-71.6-33.8172.9-76.8171.1000111.4C217 C218 S219 E223 R224 F227 I228 F258 F262C217-L221 WeakPolarHBondContact O-CB 3.32Å; C217-L221 WeakPolarHBondContact O-CG 3.12Å; C217-L221 PolarHBondContact O-N 2.9Å; C218-L221 PolarHBondContact O-N 3.22Å; S219-L221 VanDerWaalsContact C-N 3.32Å; S219-L221 PolarHBondContact O-N 2.9Å; L221-E223 PolarHBondContact O-N 3.25Å; L221-R224 CarbonylContact O-C 3.55Å; L221-R224 WeakPolarHBondContact O-CA 3.33Å; L221-R224 PolarHBondContact O-N 2.91Å; L221-F227 HydrophobicContact CD2-CD1 4.15Å; L221-F227 HydrophobicContact CD2-CE1 4.25Å; L221-I228 HydrophobicContact CB-CD1 4.41Å; L221-F258 HydrophobicContact CD1-CE2 3.86Å; L221-F258 HydrophobicContact CD1-CZ 4.2Å; L221-F262 HydrophobicContact CB-CD2 4.05Å; L221-F262 HydrophobicContact CB-CE2 3.6Å; L221-F262 HydrophobicContact CD1-CD2 4.13Å
222S86.7Confident85.5Confident16 Ų1648.3 Ų48.311%0.11225%0.254CS..Hα-helixtrans-63.4-31.3175.5-58.50000112.2C218 S219 R224 S268 I272C218-S222 PolarHBondContact O-N 2.88Å; C218-S222 PolarHBondContact O-OG 3.16Å; S219-S222 VanDerWaalsContact O-CB 3.3Å; S219-S222 WeakPolarHBondContact O-CB 3.41Å; S219-S222 PolarHBondContact O-N 3.33Å; S219-S222 VanDerWaalsContact O-N 3.12Å; S222-R224 PolarHBondContact O-N 3.48Å; S222-S268 WeakPolarHBondContact CB-OG 3.43Å; S222-S268 PolarHBondContact OG-OG 2.75Å; S222-I272 VanDerWaalsContact O-CD1 3.27Å; S222-I272 WeakPolarHBondContact O-CD1 3.5Å
223E84.1Confident85.7Confident138 Ų13847 Ų4765%0.64525%0.245SC*.THydrogen-bonded Turntrans-65.9-13.1171.8-64172.8-161.200113.1R157 S219 L221R157-E223 IonicContact CZ-OE2 3.54Å; R157-E223 IonicContact NH2-OE2 2.71Å; R157-E223 PolarHBondContact NH2-OE2 3.21Å; S219-E223 PolarHBondContact O-N 3.11Å; L221-E223 PolarHBondContact O-N 3.25Å
224R82.8Confident86Confident69 Ų6941 Ų4126%0.2621%0.214SC..THydrogen-bonded Turntrans-116.756-179.7-64.8-61.4-57.2-101.2-0.3110.6S160 L221 S222 D226 F227 I228S160-R224 PolarHBondContact OG-NH2 3.41Å; L221-R224 CarbonylContact O-C 3.55Å; L221-R224 WeakPolarHBondContact O-CA 3.33Å; L221-R224 PolarHBondContact O-N 2.91Å; S222-R224 PolarHBondContact O-N 3.48Å; R224-D226 VanDerWaalsContact CA-OD1 3.23Å; R224-D226 WeakPolarHBondContact CA-OD1 3.28Å; R224-D226 IonicContact CZ-OD1 3.23Å; R224-D226 IonicContact CZ-OD2 3.03Å; R224-D226 IonicContact NE-OD1 2.88Å; R224-D226 PolarHBondContact NE-OD1 3.24Å; R224-D226 IonicContact NE-OD2 2.75Å; R224-D226 PolarHBondContact NE-OD2 3.42Å; R224-D226 IonicContact NH2-OD1 3.36Å; R224-D226 IonicContact NH2-OD2 3.09Å; R224-D226 PolarHBondContact NH2-OD2 3.38Å; R224-D226 PolarHBondContact O-N 2.98Å; R224-D226 VanDerWaalsContact O-N 3.14Å; R224-F227 HydrophobicContact CB-CB 4.16Å; R224-F227 WeakPolarHBondContact O-CB 3.48Å; R224-F227 PolarHBondContact O-N 2.94Å; R224-I228 PolarHBondContact O-N 3.25Å
225S86.3Confident86.4Confident65 Ų6539 Ų3946%0.45520%0.203SC..Hα-helixtrans-57.8-26.4178.360.50000112.9F227 I228 Q229S225-F227 VanDerWaalsContact C-N 3.34Å; S225-I228 PolarHBondContact O-N 3.43Å; S225-Q229 VanDerWaalsContact O-CB 3.24Å; S225-Q229 WeakPolarHBondContact O-CB 3.44Å; S225-Q229 PolarHBondContact O-N 2.83Å
226D87.3Confident86.9Confident80 Ų8034.6 Ų34.643%0.42818%0.179SC..Hα-helixtrans-57.8-44.3171.162.5-47.1000112.2R224 F230R224-D226 VanDerWaalsContact CA-OD1 3.23Å; R224-D226 WeakPolarHBondContact CA-OD1 3.28Å; R224-D226 IonicContact CZ-OD1 3.23Å; R224-D226 IonicContact CZ-OD2 3.03Å; R224-D226 IonicContact NE-OD1 2.88Å; R224-D226 PolarHBondContact NE-OD1 3.24Å; R224-D226 IonicContact NE-OD2 2.75Å; R224-D226 PolarHBondContact NE-OD2 3.42Å; R224-D226 IonicContact NH2-OD1 3.36Å; R224-D226 IonicContact NH2-OD2 3.09Å; R224-D226 PolarHBondContact NH2-OD2 3.38Å; R224-D226 PolarHBondContact O-N 2.98Å; R224-D226 VanDerWaalsContact O-N 3.14Å; D226-F230 PolarHBondContact O-N 3.43Å
227F87.2Confident87.3Confident12 Ų1232.4 Ų32.45%0.05317%0.165CC..Hα-helixtrans-71.5-41.3178.9176.9-113000111.6F163 L207 L221 R224 S225 Q229 F230 C231F163-F227 HydrophobicContact CB-CE2 3.96Å; F163-F227 AromaticContact CD2-CE2 3.48Å; F163-F227 HydrophobicContact CD2-CE2 3.48Å; F163-F227 VanDerWaalsContact CD2-CE2 3.48Å; F163-F227 AromaticContact CD2-CZ 3.63Å; F163-F227 HydrophobicContact CD2-CZ 3.63Å; F163-F227 HydrophobicContact CE2-CE2 4.11Å; F163-F227 AromaticContact CE2-CZ 3.76Å; F163-F227 HydrophobicContact CE2-CZ 3.76Å; F163-F227 AromaticContact CG-CE2 3.76Å; F163-F227 HydrophobicContact CG-CE2 3.76Å; F163-F227 HydrophobicContact CG-CZ 4.06Å; F163-F227 HydrophobicContact CZ-CZ 4.24Å; L207-F227 HydrophobicContact CD1-CE1 3.89Å; L207-F227 HydrophobicContact CD1-CZ 3.72Å; L221-F227 HydrophobicContact CD2-CD1 4.15Å; L221-F227 HydrophobicContact CD2-CE1 4.25Å; R224-F227 HydrophobicContact CB-CB 4.16Å; R224-F227 WeakPolarHBondContact O-CB 3.48Å; R224-F227 PolarHBondContact O-N 2.94Å; S225-F227 VanDerWaalsContact C-N 3.34Å; F227-Q229 VanDerWaalsContact C-N 3.32Å; F227-Q229 PolarHBondContact O-N 3.46Å; F227-F230 HydrophobicContact CD2-CD1 4.11Å; F227-F230 HydrophobicContact CE2-CD1 4.04Å; F227-F230 HydrophobicContact CE2-CE1 4.4Å; F227-F230 WeakPolarHBondContact O-CB 3.44Å; F227-F230 PolarHBondContact O-N 3.12Å; F227-C231 VanDerWaalsContact CZ-SG 3.56Å; F227-C231 PolarHBondContact O-N 3.35Å; F227-C231 PolarHBondContact O-SG 2.88Å; F227-C231 VanDerWaalsContact O-SG 3.32Å
228I90.2Very high87.7Confident0 Ų032.8 Ų32.80%017%0.166CC..Hα-helixtrans-61.2-45175.1-57.6-56.1000110.3L221 R224 S225 F230 C231 L232 F258 F262 I272 V273L221-I228 HydrophobicContact CB-CD1 4.41Å; R224-I228 PolarHBondContact O-N 3.25Å; S225-I228 PolarHBondContact O-N 3.43Å; I228-F230 VanDerWaalsContact C-N 3.3Å; I228-F230 PolarHBondContact O-N 2.99Å; I228-C231 WeakPolarHBondContact O-CB 3.43Å; I228-C231 PolarHBondContact O-N 3.22Å; I228-L232 HydrophobicContact CG2-CD1 4.35Å; I228-L232 HydrophobicContact CG2-CG 4.45Å; I228-L232 WeakPolarHBondContact O-CG 3.42Å; I228-L232 PolarHBondContact O-N 3.01Å; I228-F258 HydrophobicContact CD1-CE1 4.19Å; I228-F258 HydrophobicContact CD1-CZ 3.84Å; I228-F262 HydrophobicContact CD1-CD1 4.27Å; I228-F262 HydrophobicContact CD1-CD2 4.46Å; I228-F262 HydrophobicContact CD1-CE1 3.93Å; I228-F262 HydrophobicContact CD1-CE2 4.13Å; I228-F262 HydrophobicContact CD1-CZ 3.85Å; I228-F262 HydrophobicContact CG1-CE1 3.99Å; I228-F262 HydrophobicContact CG1-CZ 3.85Å; I228-F262 HydrophobicContact CG2-CE1 4.02Å; I228-I272 HydrophobicContact CB-CG2 4.25Å; I228-I272 HydrophobicContact CG2-CG2 3.99Å; I228-V273 HydrophobicContact CG2-CG2 4.33Å
229Q92Very high87.9Confident41 Ų4132.8 Ų32.819%0.19217%0.166CC..Hα-helixtrans-56.6-44.4174.9-178.959.340.500111.7S225 F227 C231 L232 E233 S276 K277S225-Q229 VanDerWaalsContact O-CB 3.24Å; S225-Q229 WeakPolarHBondContact O-CB 3.44Å; S225-Q229 PolarHBondContact O-N 2.83Å; F227-Q229 VanDerWaalsContact C-N 3.32Å; F227-Q229 PolarHBondContact O-N 3.46Å; Q229-C231 PolarHBondContact O-N 2.78Å; Q229-L232 PolarHBondContact O-N 2.94Å; Q229-E233 PolarHBondContact NE2-OE1 2.92Å; Q229-E233 PolarHBondContact O-N 2.78Å; Q229-S276 PolarHBondContact OE1-OG 3.13Å; Q229-K277 PolarHBondContact NE2-O 3.29Å
230F90.3Very high88.1Confident22 Ų2232.1 Ų32.110%0.09616%0.161CC..Hα-helixtrans-59.9-42.6173.3164.2-95.6000112.9F163 H164 M167 D226 F227 I228 L232 E233 C234F163-F230 HydrophobicContact CB-CE1 3.68Å; F163-F230 HydrophobicContact CB-CZ 4.21Å; H164-F230 AromaticContact CE1-CD2 3.12Å; H164-F230 WeakPolarHBondContact CE1-CD2 3.3Å; H164-F230 AromaticContact CE1-CE2 3.72Å; H164-F230 AromaticContact CE1-CG 3.31Å; H164-F230 WeakPolarHBondContact CE1-CG 3.32Å; H164-F230 AromaticContact ND1-CD2 3.18Å; H164-F230 WeakPolarHBondContact ND1-CD2 3.4Å; H164-F230 AromaticContact ND1-CE2 3.25Å; H164-F230 VanDerWaalsContact ND1-CE2 3.25Å; H164-F230 WeakPolarHBondContact ND1-CE2 3.23Å; H164-F230 AromaticContact ND1-CG 3.75Å; H164-F230 AromaticContact ND1-CZ 3.92Å; H164-F230 AromaticContact NE2-CG 4Å; M167-F230 HydrophobicContact CB-CE2 4.24Å; M167-F230 HydrophobicContact CB-CZ 3.97Å; M167-F230 HydrophobicContact CG-CE2 4.41Å; M167-F230 HydrophobicContact CG-CZ 3.78Å; D226-F230 PolarHBondContact O-N 3.43Å; F227-F230 HydrophobicContact CD2-CD1 4.11Å; F227-F230 HydrophobicContact CE2-CD1 4.04Å; F227-F230 HydrophobicContact CE2-CE1 4.4Å; F227-F230 WeakPolarHBondContact O-CB 3.44Å; F227-F230 PolarHBondContact O-N 3.12Å; I228-F230 VanDerWaalsContact C-N 3.3Å; I228-F230 PolarHBondContact O-N 2.99Å; F230-L232 VanDerWaalsContact C-N 3.32Å; F230-L232 PolarHBondContact O-N 3.43Å; F230-E233 PolarHBondContact O-N 3.16Å; F230-C234 VanDerWaalsContact CE2-SG 3.56Å; F230-C234 WeakPolarHBondContact CZ-SG 3.01Å; F230-C234 PolarHBondContact O-N 2.92Å; F230-C234 PolarHBondContact O-SG 3.5Å
231C90.9Very high88.5Confident1 Ų134.1 Ų34.11%0.00717%0.172CC..Hα-helixtrans-61.1-41.2176-67.40000111.9F227 I228 Q229 C234 V235 F255 F258F227-C231 VanDerWaalsContact CZ-SG 3.56Å; F227-C231 PolarHBondContact O-N 3.35Å; F227-C231 PolarHBondContact O-SG 2.88Å; F227-C231 VanDerWaalsContact O-SG 3.32Å; I228-C231 WeakPolarHBondContact O-CB 3.43Å; I228-C231 PolarHBondContact O-N 3.22Å; Q229-C231 PolarHBondContact O-N 2.78Å; C231-C234 WeakPolarHBondContact O-CB 3.48Å; C231-C234 PolarHBondContact O-N 3.27Å; C231-V235 PolarHBondContact O-N 3.18Å; C231-F255 HydrophobicContact CB-CD1 4.27Å; C231-F255 HydrophobicContact CB-CE1 4.21Å; C231-F258 HydrophobicContact CB-CE1 4.37Å
232L93.1Very high88.6Confident0 Ų035.1 Ų35.10%018%0.176CC..Hα-helixtrans-65.7-44.6177.4-61.8175.9000111.1I228 Q229 F230 C234 V235 T236 L259 S276 V278 F290I228-L232 HydrophobicContact CG2-CD1 4.35Å; I228-L232 HydrophobicContact CG2-CG 4.45Å; I228-L232 WeakPolarHBondContact O-CG 3.42Å; I228-L232 PolarHBondContact O-N 3.01Å; Q229-L232 PolarHBondContact O-N 2.94Å; F230-L232 VanDerWaalsContact C-N 3.32Å; F230-L232 PolarHBondContact O-N 3.43Å; L232-C234 VanDerWaalsContact C-N 3.26Å; L232-C234 PolarHBondContact O-N 2.95Å; L232-V235 WeakPolarHBondContact O-CG1 3.1Å; L232-V235 PolarHBondContact O-N 3.46Å; L232-T236 WeakPolarHBondContact O-CG2 3.44Å; L232-T236 PolarHBondContact O-N 3.26Å; L232-T236 PolarHBondContact O-OG1 3Å; L232-L259 HydrophobicContact CD2-CD1 3.63Å; L232-L259 HydrophobicContact CD2-CD2 3.66Å; L232-L259 HydrophobicContact CD2-CG 4.3Å; L232-S276 WeakPolarHBondContact CD1-OG 3.29Å; L232-V278 HydrophobicContact CB-CG1 3.7Å; L232-F290 HydrophobicContact CB-CD2 4.26Å; L232-F290 HydrophobicContact CB-CE2 4.49Å; L232-F290 HydrophobicContact CD1-CB 4.5Å; L232-F290 HydrophobicContact CD1-CG 4.38Å; L232-F290 HydrophobicContact CD2-CD1 3.93Å; L232-F290 HydrophobicContact CD2-CD2 3.89Å; L232-F290 HydrophobicContact CD2-CE1 3.75Å; L232-F290 HydrophobicContact CD2-CE2 3.74Å; L232-F290 HydrophobicContact CD2-CG 3.99Å; L232-F290 HydrophobicContact CD2-CZ 3.66Å; L232-F290 HydrophobicContact CG-CD2 4.49Å
233E91.2Very high88.5Confident53 Ų5334.8 Ų34.825%0.24817%0.173CC..Hα-helixtrans-64.5-31.3175.7-74.5-179.2-147.300113.1Q229 F230 Y237 T238 V278 R279Q229-E233 PolarHBondContact NE2-OE1 2.92Å; Q229-E233 PolarHBondContact O-N 2.78Å; F230-E233 PolarHBondContact O-N 3.16Å; E233-Y237 PolarHBondContact O-N 3.21Å; E233-T238 PolarHBondContact O-N 2.87Å; E233-T238 PolarHBondContact O-OG1 3.37Å; E233-V278 HydrophobicContact CG-CG1 4.36Å; E233-R279 IonicContact OE2-NH2 2.91Å
234C90.9Very high88.6Confident0 Ų031.8 Ų31.80%016%0.161CC..Iπ-helixtrans-59.2-49.8173.1-73.80000110.8F230 C231 L232 T238 V239 F255F230-C234 VanDerWaalsContact CE2-SG 3.56Å; F230-C234 WeakPolarHBondContact CZ-SG 3.01Å; F230-C234 PolarHBondContact O-N 2.92Å; F230-C234 PolarHBondContact O-SG 3.5Å; C231-C234 WeakPolarHBondContact O-CB 3.48Å; C231-C234 PolarHBondContact O-N 3.27Å; L232-C234 VanDerWaalsContact C-N 3.26Å; L232-C234 PolarHBondContact O-N 2.95Å; C234-T238 PolarHBondContact O-N 3.06Å; C234-V239 HydrophobicContact CB-CG2 4.35Å; C234-V239 WeakPolarHBondContact O-CB 3.5Å; C234-V239 WeakPolarHBondContact O-CG2 3.41Å; C234-V239 PolarHBondContact O-N 3.36Å; C234-F255 HydrophobicContact CB-CE1 3.64Å; C234-F255 HydrophobicContact CB-CE2 4.17Å; C234-F255 HydrophobicContact CB-CZ 3.45Å; C234-F255 VanDerWaalsContact CB-CZ 3.45Å
235V90.4Very high88.4Confident0 Ų033.5 Ų33.50%018%0.182CC..Iπ-helixtrans-73.1-33.4-176.670.60000112.9C231 L232 P240 F255 F290 Y293C231-V235 PolarHBondContact O-N 3.18Å; L232-V235 WeakPolarHBondContact O-CG1 3.1Å; L232-V235 PolarHBondContact O-N 3.46Å; V235-P240 WeakPolarHBondContact O-CD 3.41Å; V235-P240 WeakPolarHBondContact O-CG 3.46Å; V235-F255 HydrophobicContact CB-CB 4.15Å; V235-F255 HydrophobicContact CB-CG 4.32Å; V235-F255 HydrophobicContact CG2-CB 4.27Å; V235-F290 HydrophobicContact CG1-CE2 3.91Å; V235-F290 HydrophobicContact CG1-CZ 4.39Å; V235-Y293 HydrophobicContact CG1-CE1 4.46Å
236T90.1Very high88.1Confident3 Ų332.6 Ų32.62%0.01818%0.182CC..Iπ-helixtrans-88.8-25.4-174.865.80000114.6L232 V278 R279 L280 F290 Y293L232-T236 WeakPolarHBondContact O-CG2 3.44Å; L232-T236 PolarHBondContact O-N 3.26Å; L232-T236 PolarHBondContact O-OG1 3Å; T236-V278 HydrophobicContact CG2-CB 4.29Å; T236-V278 HydrophobicContact CG2-CG2 3.85Å; T236-R279 VanDerWaalsContact CB-O 3.3Å; T236-R279 WeakPolarHBondContact CB-O 3.46Å; T236-R279 PolarHBondContact OG1-O 3.3Å; T236-L280 HydrophobicContact CG2-CD2 4.48Å; T236-F290 HydrophobicContact CG2-CD2 3.74Å; T236-F290 HydrophobicContact CG2-CE2 3.66Å; T236-Y293 HydrophobicContact CG2-CD1 3.62Å; T236-Y293 HydrophobicContact CG2-CD2 3.8Å; T236-Y293 HydrophobicContact CG2-CE1 3.94Å; T236-Y293 HydrophobicContact CG2-CE2 4.1Å; T236-Y293 HydrophobicContact CG2-CG 3.53Å
237Y89.3Confident88Confident55 Ų5531.1 Ų31.122%0.21617%0.173CC..Iπ-helixtrans-135.5-58.9-172.9-176-100.2000112.7E233 P240 M241 R279E233-Y237 PolarHBondContact O-N 3.21Å; Y237-P240 WeakPolarHBondContact O-CD 3.34Å; Y237-M241 WeakPolarHBondContact O-CB 3.37Å; Y237-M241 PolarHBondContact O-N 3.35Å; Y237-R279 HydrophobicContact CD2-CB 4.08Å; Y237-R279 HydrophobicContact CG-CB 4.12Å
238T88.6Confident88.1Confident20 Ų2031.4 Ų31.412%0.12318%0.176CC..Iπ-helixtrans-67-47.6-167.5-43.20000112.6M167 V171 E233 C234 M241 F242M167-T238 HydrophobicContact CE-CG2 3.3Å; V171-T238 HydrophobicContact CG2-CG2 3.63Å; E233-T238 PolarHBondContact O-N 2.87Å; E233-T238 PolarHBondContact O-OG1 3.37Å; C234-T238 PolarHBondContact O-N 3.06Å; T238-M241 PolarHBondContact O-N 3.47Å; T238-F242 HydrophobicContact CG2-CD2 3.75Å; T238-F242 HydrophobicContact CG2-CE2 4.16Å; T238-F242 WeakPolarHBondContact O-CB 3.36Å; T238-F242 WeakPolarHBondContact O-CD2 3.37Å; T238-F242 PolarHBondContact O-N 2.92Å; T238-F242 VanDerWaalsContact O-N 3.09Å
239V88.9Confident88Confident0 Ų034 Ų340%019%0.186CC..Hα-helixtrans-63.8-53.3178.5166.40000110.5M167 C234 M241 F242 M243 C248 F251 F255M167-V239 HydrophobicContact CE-CG2 4.17Å; C234-V239 HydrophobicContact CB-CG2 4.35Å; C234-V239 WeakPolarHBondContact O-CB 3.5Å; C234-V239 WeakPolarHBondContact O-CG2 3.41Å; C234-V239 PolarHBondContact O-N 3.36Å; V239-M241 VanDerWaalsContact C-N 3.25Å; V239-M241 PolarHBondContact O-N 3.2Å; V239-F242 PolarHBondContact O-N 2.98Å; V239-M243 HydrophobicContact CB-SD 4.24Å; V239-M243 HydrophobicContact CG1-CB 4.47Å; V239-M243 HydrophobicContact CG1-CG 4.47Å; V239-M243 HydrophobicContact CG1-SD 3.78Å; V239-M243 HydrophobicContact CG2-CE 3.9Å; V239-M243 HydrophobicContact CG2-SD 4Å; V239-M243 WeakPolarHBondContact O-CB 3.25Å; V239-M243 PolarHBondContact O-N 2.92Å; V239-C248 HydrophobicContact CG1-CB 4.02Å; V239-C248 PolarHBondContact O-SG 2.94Å; V239-C248 VanDerWaalsContact O-SG 3.34Å; V239-F251 HydrophobicContact CG1-CB 3.96Å; V239-F251 HydrophobicContact CG2-CB 4.35Å; V239-F255 HydrophobicContact CG2-CE2 4.11Å
240P87.8Confident87.8Confident40 Ų4037.4 Ų37.426%0.2620%0.202SC..Hα-helixtrans-57.9-33.5178-25.934.3000114.8V235 Y237 L281V235-P240 WeakPolarHBondContact O-CD 3.41Å; V235-P240 WeakPolarHBondContact O-CG 3.46Å; Y237-P240 WeakPolarHBondContact O-CD 3.34Å; P240-L281 HydrophobicContact CB-CD1 4.21Å; P240-L281 HydrophobicContact CB-CD2 3.97Å
241M87.8Confident87.9Confident92 Ų9236.5 Ų36.545%0.45320%0.198SC..Hα-helixtrans-77.3-38.6-177.6-176.163-177.900113.1Y237 T238 V239 L281Y237-M241 WeakPolarHBondContact O-CB 3.37Å; Y237-M241 PolarHBondContact O-N 3.35Å; T238-M241 PolarHBondContact O-N 3.47Å; V239-M241 VanDerWaalsContact C-N 3.25Å; V239-M241 PolarHBondContact O-N 3.2Å; M241-L281 HydrophobicContact CB-CD1 3.61Å; M241-L281 HydrophobicContact CG-CD1 4.24Å; M241-L281 HydrophobicContact SD-CD1 3.71Å
242F85.3Confident87.9Confident30 Ų3036.8 Ų36.813%0.13220%0.2CC..Hα-helixtrans-110.5-14.6-167-62.8-72.8000114.5V171 K174 T238 V239V171-F242 HydrophobicContact CB-CD2 4.43Å; V171-F242 HydrophobicContact CB-CG 4.43Å; V171-F242 HydrophobicContact CG1-CD1 4.19Å; V171-F242 HydrophobicContact CG1-CD2 4.35Å; V171-F242 HydrophobicContact CG1-CE1 3.81Å; V171-F242 HydrophobicContact CG1-CE2 4Å; V171-F242 HydrophobicContact CG1-CG 4.46Å; V171-F242 HydrophobicContact CG1-CZ 3.71Å; V171-F242 HydrophobicContact CG2-CD1 4.49Å; V171-F242 HydrophobicContact CG2-CD2 3.6Å; V171-F242 HydrophobicContact CG2-CE2 3.86Å; V171-F242 HydrophobicContact CG2-CG 3.96Å; V171-F242 HydrophobicContact CG2-CZ 4.4Å; K174-F242 HydrophobicContact CB-CB 4.29Å; K174-F242 HydrophobicContact CB-CD1 4.06Å; K174-F242 VanDerWaalsContact CD-O 3.28Å; K174-F242 WeakPolarHBondContact CD-O 3.37Å; K174-F242 HydrophobicContact CG-CB 4.41Å; K174-F242 HydrophobicContact CG-CD1 4.25Å; K174-F242 VanDerWaalsContact CG-O 3.29Å; K174-F242 WeakPolarHBondContact CG-O 3.41Å; T238-F242 HydrophobicContact CG2-CD2 3.75Å; T238-F242 HydrophobicContact CG2-CE2 4.16Å; T238-F242 WeakPolarHBondContact O-CB 3.36Å; T238-F242 WeakPolarHBondContact O-CD2 3.37Å; T238-F242 PolarHBondContact O-N 2.92Å; T238-F242 VanDerWaalsContact O-N 3.09Å; V239-F242 PolarHBondContact O-N 2.98Å
243M85.4Confident87.9Confident10 Ų1038.2 Ų38.25%0.04921%0.209CC..SBendtrans-106.4163.4-179-59.8-175.3-17500112.3M167 V170 L197 V239 E247 F251M167-M243 HydrophobicContact CE-CE 3.89Å; M167-M243 HydrophobicContact SD-CE 3.64Å; V170-M243 HydrophobicContact CG1-CE 3.88Å; V170-M243 HydrophobicContact CG1-CG 4.22Å; L197-M243 HydrophobicContact CD2-CE 3.56Å; L197-M243 HydrophobicContact CD2-CG 4.48Å; L197-M243 HydrophobicContact CD2-SD 3.96Å; V239-M243 HydrophobicContact CB-SD 4.24Å; V239-M243 HydrophobicContact CG1-CB 4.47Å; V239-M243 HydrophobicContact CG1-CG 4.47Å; V239-M243 HydrophobicContact CG1-SD 3.78Å; V239-M243 HydrophobicContact CG2-CE 3.9Å; V239-M243 HydrophobicContact CG2-SD 4Å; V239-M243 WeakPolarHBondContact O-CB 3.25Å; V239-M243 PolarHBondContact O-N 2.92Å; M243-E247 HydrophobicContact CB-CB 4.16Å; M243-F251 HydrophobicContact CE-CD2 4.11Å; M243-F251 HydrophobicContact CE-CE2 4Å; M243-F251 HydrophobicContact CE-CZ 4.43Å; M243-F251 HydrophobicContact SD-CD2 3.37Å; M243-F251 WeakPolarHBondContact SD-CD2 3.26Å; M243-F251 HydrophobicContact SD-CE2 3.6Å; M243-F251 VanDerWaalsContact SD-CE2 3.6Å; M243-F251 HydrophobicContact SD-CG 4.19Å
244N84.6Confident87.9Confident74 Ų7436.9 Ų36.940%0.39620%0.203SC..  trans-78.4154176.3-60.9-38.4000110.6K174 G246 E247 C248K174-N244 PolarHBondContact NZ-OD1 3.39Å; K174-N244 VanDerWaalsContact NZ-OD1 3.09Å; N244-G246 VanDerWaalsContact C-N 3.33Å; N244-G246 PolarHBondContact O-N 2.93Å; N244-G246 VanDerWaalsContact O-N 3.12Å; N244-E247 HydrophobicContact CB-CG 4.45Å; N244-E247 PolarHBondContact N-OE2 3.04Å; N244-E247 WeakPolarHBondContact O-CB 3.33Å; N244-E247 PolarHBondContact O-N 3.49Å; N244-C248 PolarHBondContact O-N 3.08Å; N244-C248 PolarHBondContact O-SG 2.95Å
245P79.2Confident87.9Confident106 Ų10636.9 Ų36.969%0.68820%0.203SC*.Hα-helixtrans-51.6-42.3-173.3-29.835.2000115.6C248 Y249P245-C248 WeakPolarHBondContact O-CB 3.48Å; P245-C248 PolarHBondContact O-N 2.71Å; P245-Y249 PolarHBondContact O-N 2.89Å; P245-Y249 VanDerWaalsContact O-N 3.16Å
246G80.1Confident88.1Confident45 Ų4537 Ų3746%0.46420%0.203SC..Hα-helixtrans-67.5-36.4177.900000113.5N244 E250N244-G246 VanDerWaalsContact C-N 3.33Å; N244-G246 PolarHBondContact O-N 2.93Å; N244-G246 VanDerWaalsContact O-N 3.12Å; G246-E250 PolarHBondContact O-N 3.11Å
247E84.9Confident88.2Confident49 Ų4938.5 Ų38.523%0.22921%0.214CC..Hα-helixtrans-68-41.5174.1-60.8168.9159.500110Y193 L197 M243 N244 Y249 E250 F251Y193-E247 PolarHBondContact OH-OE2 3.06Å; L197-E247 VanDerWaalsContact CD1-CD 3.44Å; L197-E247 HydrophobicContact CD1-CG 4.16Å; L197-E247 VanDerWaalsContact CD1-OE1 3.27Å; L197-E247 WeakPolarHBondContact CD1-OE1 3.44Å; M243-E247 HydrophobicContact CB-CB 4.16Å; N244-E247 HydrophobicContact CB-CG 4.45Å; N244-E247 PolarHBondContact N-OE2 3.04Å; N244-E247 WeakPolarHBondContact O-CB 3.33Å; N244-E247 PolarHBondContact O-N 3.49Å; E247-Y249 VanDerWaalsContact C-N 3.29Å; E247-Y249 PolarHBondContact O-N 2.98Å; E247-E250 PolarHBondContact O-N 3.34Å; E247-F251 WeakPolarHBondContact O-CD2 3.41Å; E247-F251 PolarHBondContact O-N 3.06Å
248C88.6Confident88.3Confident18 Ų1835.9 Ų35.912%0.12220%0.204CC..Hα-helixtrans-56.4-43178-650000112.2V239 N244 P245 S252V239-C248 HydrophobicContact CG1-CB 4.02Å; V239-C248 PolarHBondContact O-SG 2.94Å; V239-C248 VanDerWaalsContact O-SG 3.34Å; N244-C248 PolarHBondContact O-N 3.08Å; N244-C248 PolarHBondContact O-SG 2.95Å; P245-C248 WeakPolarHBondContact O-CB 3.48Å; P245-C248 PolarHBondContact O-N 2.71Å; C248-S252 VanDerWaalsContact O-CB 3.22Å; C248-S252 WeakPolarHBondContact O-CB 3.26Å; C248-S252 PolarHBondContact O-N 2.8Å; C248-S252 PolarHBondContact O-OG 3Å
249Y88.9Confident88.6Confident56 Ų5635 Ų3522%0.2220%0.199CC..Hα-helixtrans-61.7-52178.1169.4-114.3000111.8P245 E247 F251 S252 V253 E335 V338 L339P245-Y249 PolarHBondContact O-N 2.89Å; P245-Y249 VanDerWaalsContact O-N 3.16Å; E247-Y249 VanDerWaalsContact C-N 3.29Å; E247-Y249 PolarHBondContact O-N 2.98Å; Y249-F251 VanDerWaalsContact C-N 3.31Å; Y249-F251 PolarHBondContact O-N 3.09Å; Y249-S252 PolarHBondContact O-N 3.38Å; Y249-V253 HydrophobicContact CD2-CG2 3.9Å; Y249-V253 HydrophobicContact CE2-CG2 3.39Å; Y249-V253 WeakPolarHBondContact O-CG2 3.38Å; Y249-V253 PolarHBondContact O-N 2.84Å; Y249-E335 HydrophobicContact CD1-CB 4.47Å; Y249-E335 HydrophobicContact CD1-CG 3.72Å; Y249-E335 WeakPolarHBondContact CD1-OE1 3.42Å; Y249-E335 HydrophobicContact CD2-CB 3.49Å; Y249-E335 VanDerWaalsContact CD2-CB 3.49Å; Y249-E335 HydrophobicContact CD2-CG 3.68Å; Y249-E335 HydrophobicContact CE1-CG 3.84Å; Y249-E335 VanDerWaalsContact CE2-CA 3.47Å; Y249-E335 HydrophobicContact CE2-CB 3.62Å; Y249-E335 HydrophobicContact CE2-CG 3.8Å; Y249-E335 HydrophobicContact CG-CB 3.95Å; Y249-E335 HydrophobicContact CG-CG 3.63Å; Y249-V338 HydrophobicContact CE2-CB 4.32Å; Y249-V338 HydrophobicContact CE2-CG1 4.39Å; Y249-L339 HydrophobicContact CD2-CD1 4.21Å; Y249-L339 HydrophobicContact CD2-CG 4.22Å; Y249-L339 HydrophobicContact CE2-CG 4.33Å
250E88.6Confident88.8Confident111 Ų11135.6 Ų35.652%0.51920%0.202SC..Hα-helixtrans-57.6-44.1-179.6-69.8-168.1169.300112.1G246 E247 L254G246-E250 PolarHBondContact O-N 3.11Å; E247-E250 PolarHBondContact O-N 3.34Å; E250-L254 WeakPolarHBondContact O-CG 3.41Å; E250-L254 PolarHBondContact O-N 2.92Å
251F90.6Very high89Confident3 Ų335.3 Ų35.31%0.01320%0.198CC..Hα-helixtrans-65.3-48.8176.2-82-66.9000111.4L197 F200 S201 V239 M243 E247 Y249 V253 L254 F255L197-F251 HydrophobicContact CB-CE2 4.31Å; L197-F251 HydrophobicContact CB-CZ 4.18Å; L197-F251 HydrophobicContact CD2-CE2 3.93Å; L197-F251 HydrophobicContact CD2-CZ 4.17Å; F200-F251 HydrophobicContact CB-CE1 4.13Å; F200-F251 HydrophobicContact CB-CZ 4.32Å; F200-F251 AromaticContact CD1-CD1 3.78Å; F200-F251 HydrophobicContact CD1-CD1 3.78Å; F200-F251 AromaticContact CD1-CE1 3.28Å; F200-F251 HydrophobicContact CD1-CE1 3.28Å; F200-F251 AromaticContact CD1-CZ 3.89Å; F200-F251 HydrophobicContact CD1-CZ 3.89Å; F200-F251 HydrophobicContact CE1-CD1 4.12Å; F200-F251 HydrophobicContact CE1-CE1 4.09Å; F200-F251 HydrophobicContact CG-CE1 4.11Å; S201-F251 WeakPolarHBondContact OG-CE1 3.46Å; S201-F251 WeakPolarHBondContact OG-CZ 3.48Å; V239-F251 HydrophobicContact CG1-CB 3.96Å; V239-F251 HydrophobicContact CG2-CB 4.35Å; M243-F251 HydrophobicContact CE-CD2 4.11Å; M243-F251 HydrophobicContact CE-CE2 4Å; M243-F251 HydrophobicContact CE-CZ 4.43Å; M243-F251 HydrophobicContact SD-CD2 3.37Å; M243-F251 WeakPolarHBondContact SD-CD2 3.26Å; M243-F251 HydrophobicContact SD-CE2 3.6Å; M243-F251 VanDerWaalsContact SD-CE2 3.6Å; M243-F251 HydrophobicContact SD-CG 4.19Å; E247-F251 WeakPolarHBondContact O-CD2 3.41Å; E247-F251 PolarHBondContact O-N 3.06Å; Y249-F251 VanDerWaalsContact C-N 3.31Å; Y249-F251 PolarHBondContact O-N 3.09Å; F251-V253 VanDerWaalsContact C-N 3.26Å; F251-V253 PolarHBondContact O-N 3.28Å; F251-L254 WeakPolarHBondContact O-CA 3.27Å; F251-L254 WeakPolarHBondContact O-CB 3.3Å; F251-L254 PolarHBondContact O-N 3.17Å; F251-F255 HydrophobicContact CB-CD2 4.14Å; F251-F255 HydrophobicContact CB-CE2 4.09Å; F251-F255 HydrophobicContact CD1-CE2 4.08Å; F251-F255 HydrophobicContact CG-CE2 4.48Å; F251-F255 WeakPolarHBondContact O-CD2 3.33Å; F251-F255 PolarHBondContact O-N 3.47Å
252S91.9Very high89.1Confident7 Ų730.9 Ų30.95%0.04918%0.177CC..Hα-helixtrans-56.8-42-178.2-60.40000111.5C248 Y249 F255 M256C248-S252 VanDerWaalsContact O-CB 3.22Å; C248-S252 WeakPolarHBondContact O-CB 3.26Å; C248-S252 PolarHBondContact O-N 2.8Å; C248-S252 PolarHBondContact O-OG 3Å; Y249-S252 PolarHBondContact O-N 3.38Å; S252-F255 PolarHBondContact O-N 3.32Å; S252-M256 VanDerWaalsContact O-CB 3.29Å; S252-M256 WeakPolarHBondContact O-CB 3.33Å; S252-M256 WeakPolarHBondContact O-CG 3.37Å; S252-M256 PolarHBondContact O-N 3.28Å
253V92.4Very high89.4Confident31 Ų3129.5 Ų29.519%0.18817%0.171CC..Hα-helixtrans-62.5-44.5174.7174.30000111.8Y249 F251 M256 S257 V338 L339Y249-V253 HydrophobicContact CD2-CG2 3.9Å; Y249-V253 HydrophobicContact CE2-CG2 3.39Å; Y249-V253 WeakPolarHBondContact O-CG2 3.38Å; Y249-V253 PolarHBondContact O-N 2.84Å; F251-V253 VanDerWaalsContact C-N 3.26Å; F251-V253 PolarHBondContact O-N 3.28Å; V253-M256 PolarHBondContact O-N 3.02Å; V253-S257 VanDerWaalsContact O-CB 3.32Å; V253-S257 WeakPolarHBondContact O-CB 3.32Å; V253-S257 PolarHBondContact O-N 3.39Å; V253-S257 PolarHBondContact O-OG 3.48Å; V253-V338 HydrophobicContact CG2-CG1 3.99Å; V253-L339 HydrophobicContact CG2-CD2 3.79Å
254L91.4Very high89.7Confident24 Ų2432.5 Ų32.513%0.12618%0.184CC..Hα-helixtrans-62-45.4177-76.1169000112.3R205 C208 E250 F251 S257 F258R205-L254 HydrophobicContact CG-CD1 4.36Å; R205-L254 HydrophobicContact CG-CD2 3.51Å; C208-L254 PolarHBondContact SG-O 3.49Å; C208-L254 VanDerWaalsContact SG-O 3.41Å; E250-L254 WeakPolarHBondContact O-CG 3.41Å; E250-L254 PolarHBondContact O-N 2.92Å; F251-L254 WeakPolarHBondContact O-CA 3.27Å; F251-L254 WeakPolarHBondContact O-CB 3.3Å; F251-L254 PolarHBondContact O-N 3.17Å; L254-S257 PolarHBondContact O-N 2.75Å; L254-F258 PolarHBondContact O-N 3.2Å
255F92.1Very high89.7Confident1 Ų134 Ų340%0.00419%0.189CC..Hα-helixtrans-61.9-47.5177.4-83-79.1000111.5F200 F204 C231 C234 V235 V239 F251 S252 S257 F258 L259F200-F255 AromaticContact CE1-CE2 3.78Å; F200-F255 HydrophobicContact CE1-CE2 3.78Å; F200-F255 AromaticContact CE1-CZ 3.48Å; F200-F255 HydrophobicContact CE1-CZ 3.48Å; F200-F255 VanDerWaalsContact CE1-CZ 3.48Å; F200-F255 HydrophobicContact CZ-CE2 4.34Å; F200-F255 AromaticContact CZ-CZ 3.58Å; F200-F255 HydrophobicContact CZ-CZ 3.58Å; F204-F255 HydrophobicContact CD1-CD1 4.07Å; F204-F255 HydrophobicContact CD1-CE1 4.07Å; F204-F255 HydrophobicContact CD2-CE1 4.11Å; F204-F255 HydrophobicContact CD2-CE2 4.38Å; F204-F255 AromaticContact CD2-CZ 3.85Å; F204-F255 HydrophobicContact CD2-CZ 3.85Å; F204-F255 AromaticContact CE1-CD1 3.51Å; F204-F255 HydrophobicContact CE1-CD1 3.51Å; F204-F255 AromaticContact CE1-CE1 3.33Å; F204-F255 HydrophobicContact CE1-CE1 3.33Å; F204-F255 HydrophobicContact CE1-CG 4.44Å; F204-F255 HydrophobicContact CE1-CZ 4.08Å; F204-F255 HydrophobicContact CE2-CD1 4.3Å; F204-F255 AromaticContact CE2-CE1 3.38Å; F204-F255 HydrophobicContact CE2-CE1 3.38Å; F204-F255 HydrophobicContact CE2-CE2 4.26Å; F204-F255 AromaticContact CE2-CZ 3.32Å; F204-F255 HydrophobicContact CE2-CZ 3.32Å; F204-F255 HydrophobicContact CG-CE1 4.43Å; F204-F255 HydrophobicContact CG-CZ 4.44Å; F204-F255 AromaticContact CZ-CD1 3.69Å; F204-F255 HydrophobicContact CZ-CD1 3.69Å; F204-F255 AromaticContact CZ-CE1 2.96Å; F204-F255 HydrophobicContact CZ-CE1 2.96Å; F204-F255 AromaticContact CZ-CZ 3.49Å; F204-F255 HydrophobicContact CZ-CZ 3.49Å; F204-F255 VanDerWaalsContact CZ-CZ 3.49Å; C231-F255 HydrophobicContact CB-CD1 4.27Å; C231-F255 HydrophobicContact CB-CE1 4.21Å; C234-F255 HydrophobicContact CB-CE1 3.64Å; C234-F255 HydrophobicContact CB-CE2 4.17Å; C234-F255 HydrophobicContact CB-CZ 3.45Å; C234-F255 VanDerWaalsContact CB-CZ 3.45Å; V235-F255 HydrophobicContact CB-CB 4.15Å; V235-F255 HydrophobicContact CB-CG 4.32Å; V235-F255 HydrophobicContact CG2-CB 4.27Å; V239-F255 HydrophobicContact CG2-CE2 4.11Å; F251-F255 HydrophobicContact CB-CD2 4.14Å; F251-F255 HydrophobicContact CB-CE2 4.09Å; F251-F255 HydrophobicContact CD1-CE2 4.08Å; F251-F255 HydrophobicContact CG-CE2 4.48Å; F251-F255 WeakPolarHBondContact O-CD2 3.33Å; F251-F255 PolarHBondContact O-N 3.47Å; S252-F255 PolarHBondContact O-N 3.32Å; F255-S257 VanDerWaalsContact C-N 3.33Å; F255-S257 PolarHBondContact O-N 3.38Å; F255-F258 WeakPolarHBondContact O-CB 3.29Å; F255-F258 PolarHBondContact O-N 2.94Å; F255-L259 WeakPolarHBondContact O-CG 3.07Å; F255-L259 PolarHBondContact O-N 2.96Å
256M92.7Very high89.9Confident1 Ų129.6 Ų29.61%0.00516%0.159CC..Hα-helixtrans-66.3-37.4-179.5-65.8-69.3-86.500111.4S252 V253 L259 V260 F290 L294 L297 H342 A343 I346S252-M256 VanDerWaalsContact O-CB 3.29Å; S252-M256 WeakPolarHBondContact O-CB 3.33Å; S252-M256 WeakPolarHBondContact O-CG 3.37Å; S252-M256 PolarHBondContact O-N 3.28Å; V253-M256 PolarHBondContact O-N 3.02Å; M256-L259 PolarHBondContact O-N 3.47Å; M256-L259 HydrophobicContact SD-CD1 4.08Å; M256-V260 WeakPolarHBondContact O-CG2 3.11Å; M256-V260 PolarHBondContact O-N 3Å; M256-F290 HydrophobicContact SD-CZ 4.37Å; M256-L294 HydrophobicContact CE-CD2 3.61Å; M256-L294 HydrophobicContact SD-CD2 4.37Å; M256-L297 HydrophobicContact CE-CD1 4.27Å; M256-H342 HydrophobicContact CB-CB 3.8Å; M256-H342 HydrophobicContact CE-CB 4.04Å; M256-H342 HydrophobicContact CG-CB 4.44Å; M256-A343 HydrophobicContact CE-CB 3.96Å; M256-I346 HydrophobicContact CB-CD1 4.31Å; M256-I346 HydrophobicContact CE-CD1 3.53Å; M256-I346 HydrophobicContact SD-CD1 3.64Å
257S94.1Very high90.2Very high35 Ų3533.1 Ų33.125%0.24516%0.163CC..Hα-helixtrans-61.5-44.3172.5-60.40000111.9V253 L254 F255 L259 V260 N261 H342V253-S257 VanDerWaalsContact O-CB 3.32Å; V253-S257 WeakPolarHBondContact O-CB 3.32Å; V253-S257 PolarHBondContact O-N 3.39Å; V253-S257 PolarHBondContact O-OG 3.48Å; L254-S257 PolarHBondContact O-N 2.75Å; F255-S257 VanDerWaalsContact C-N 3.33Å; F255-S257 PolarHBondContact O-N 3.38Å; S257-L259 VanDerWaalsContact C-N 3.34Å; S257-L259 PolarHBondContact O-N 2.88Å; S257-V260 PolarHBondContact O-N 2.96Å; S257-N261 PolarHBondContact O-N 3.2Å; S257-N261 VanDerWaalsContact O-N 3.16Å; S257-N261 PolarHBondContact O-OD1 2.98Å; S257-H342 PolarHBondContact OG-NE2 3.11Å
258F91.3Very high90.3Very high0 Ų033.2 Ų33.20%017%0.17CC..Hα-helixtrans-59.9-44.5173.7160.1-106.2000111.6F204 L207 L221 I228 C231 L254 F255 N261 F262F204-F258 HydrophobicContact CE1-CD1 4.34Å; L207-F258 HydrophobicContact CB-CD2 4.06Å; L207-F258 HydrophobicContact CB-CE2 4.39Å; L221-F258 HydrophobicContact CD1-CE2 3.86Å; L221-F258 HydrophobicContact CD1-CZ 4.2Å; I228-F258 HydrophobicContact CD1-CE1 4.19Å; I228-F258 HydrophobicContact CD1-CZ 3.84Å; C231-F258 HydrophobicContact CB-CE1 4.37Å; L254-F258 PolarHBondContact O-N 3.2Å; F255-F258 WeakPolarHBondContact O-CB 3.29Å; F255-F258 PolarHBondContact O-N 2.94Å; F258-N261 PolarHBondContact O-N 3.46Å; F258-F262 HydrophobicContact CE2-CB 4.3Å; F258-F262 HydrophobicContact CZ-CB 4.29Å; F258-F262 HydrophobicContact CZ-CG 4.45Å; F258-F262 WeakPolarHBondContact O-CB 3.37Å; F258-F262 PolarHBondContact O-N 3.26Å
259L93.4Very high90.3Very high2 Ų232.4 Ų32.41%0.0116%0.164CC..Hα-helixtrans-62.4-42.6179.8-72.2174.1000111.9L232 F255 M256 S257 F262 I263 V273 F290 I346L232-L259 HydrophobicContact CD2-CD1 3.63Å; L232-L259 HydrophobicContact CD2-CD2 3.66Å; L232-L259 HydrophobicContact CD2-CG 4.3Å; F255-L259 WeakPolarHBondContact O-CG 3.07Å; F255-L259 PolarHBondContact O-N 2.96Å; M256-L259 PolarHBondContact O-N 3.47Å; M256-L259 HydrophobicContact SD-CD1 4.08Å; S257-L259 VanDerWaalsContact C-N 3.34Å; S257-L259 PolarHBondContact O-N 2.88Å; L259-F262 PolarHBondContact O-N 2.91Å; L259-I263 VanDerWaalsContact O-CG1 3.28Å; L259-I263 WeakPolarHBondContact O-CG1 3.48Å; L259-I263 WeakPolarHBondContact O-CG2 3.36Å; L259-I263 PolarHBondContact O-N 2.84Å; L259-V273 HydrophobicContact CD2-CG2 4.45Å; L259-F290 HydrophobicContact CD1-CE1 4.05Å; L259-F290 HydrophobicContact CD1-CZ 3.75Å; L259-I346 HydrophobicContact CB-CD1 3.93Å; L259-I346 HydrophobicContact CD1-CD1 4.37Å
260V93.7Very high90.4Very high13 Ų1330.6 Ų30.68%0.07916%0.157CC..Hα-helixtrans-54.8-57173.51710000109.7M256 S257 F262 I263 E264 L345 I346 L349M256-V260 WeakPolarHBondContact O-CG2 3.11Å; M256-V260 PolarHBondContact O-N 3Å; S257-V260 PolarHBondContact O-N 2.96Å; V260-F262 PolarHBondContact O-N 3.42Å; V260-I263 PolarHBondContact O-N 2.86Å; V260-I263 VanDerWaalsContact O-N 3.11Å; V260-E264 WeakPolarHBondContact O-CB 3.43Å; V260-E264 PolarHBondContact O-N 3.06Å; V260-L345 HydrophobicContact CG1-CD2 3.78Å; V260-L345 HydrophobicContact CG1-CG 4.49Å; V260-L345 HydrophobicContact CG2-CD2 3.86Å; V260-L345 HydrophobicContact CG2-CG 4.29Å; V260-I346 HydrophobicContact CG2-CD1 4.16Å; V260-I346 HydrophobicContact CG2-CG1 3.65Å; V260-L349 HydrophobicContact CG1-CD1 4.32Å
261N91.3Very high90.5Very high33 Ų3334.2 Ų34.218%0.17617%0.166CC..Hα-helixtrans-57.2-36.8179.5-65.4-2.2000112.5C208 S211 S257 F258C208-N261 PolarHBondContact O-ND2 3.45Å; S211-N261 WeakPolarHBondContact OG-CB 3.21Å; S257-N261 PolarHBondContact O-N 3.2Å; S257-N261 VanDerWaalsContact O-N 3.16Å; S257-N261 PolarHBondContact O-OD1 2.98Å; F258-N261 PolarHBondContact O-N 3.46Å
262F90.8Very high90.5Very high0 Ų035.7 Ų35.70%017%0.173CC..Hα-helixtrans-68.3-35-179.3175.5-118.1000112.9C218 L221 I228 F258 L259 V260 H266 G269 V273C218-F262 HydrophobicContact CB-CD2 4.06Å; C218-F262 HydrophobicContact CB-CE2 4.46Å; C218-F262 WeakPolarHBondContact O-CE2 3.27Å; L221-F262 HydrophobicContact CB-CD2 4.05Å; L221-F262 HydrophobicContact CB-CE2 3.6Å; L221-F262 HydrophobicContact CD1-CD2 4.13Å; I228-F262 HydrophobicContact CD1-CD1 4.27Å; I228-F262 HydrophobicContact CD1-CD2 4.46Å; I228-F262 HydrophobicContact CD1-CE1 3.93Å; I228-F262 HydrophobicContact CD1-CE2 4.13Å; I228-F262 HydrophobicContact CD1-CZ 3.85Å; I228-F262 HydrophobicContact CG1-CE1 3.99Å; I228-F262 HydrophobicContact CG1-CZ 3.85Å; I228-F262 HydrophobicContact CG2-CE1 4.02Å; F258-F262 HydrophobicContact CE2-CB 4.3Å; F258-F262 HydrophobicContact CZ-CB 4.29Å; F258-F262 HydrophobicContact CZ-CG 4.45Å; F258-F262 WeakPolarHBondContact O-CB 3.37Å; F258-F262 PolarHBondContact O-N 3.26Å; L259-F262 PolarHBondContact O-N 2.91Å; V260-F262 PolarHBondContact O-N 3.42Å; F262-H266 WeakPolarHBondContact O-CB 3.21Å; F262-H266 PolarHBondContact O-CD2 3.24Å; F262-G269 VanDerWaalsContact CE1-CA 3.44Å; F262-G269 VanDerWaalsContact CZ-CA 3.49Å; F262-V273 HydrophobicContact CD1-CG2 4.33Å; F262-V273 HydrophobicContact CE1-CG2 4.23Å
263I92.3Very high90.5Very high0 Ų035.4 Ų35.40%017%0.171CC..Hα-helixtrans-105.7-16.7-172.274.2-175.6000114.4L259 V260 H265 H266 R270 V273 I346 L349 L350L259-I263 VanDerWaalsContact O-CG1 3.28Å; L259-I263 WeakPolarHBondContact O-CG1 3.48Å; L259-I263 WeakPolarHBondContact O-CG2 3.36Å; L259-I263 PolarHBondContact O-N 2.84Å; V260-I263 PolarHBondContact O-N 2.86Å; V260-I263 VanDerWaalsContact O-N 3.11Å; I263-H265 VanDerWaalsContact C-N 3.26Å; I263-H265 PolarHBondContact O-N 3.36Å; I263-H266 PolarHBondContact O-N 3.31Å; I263-R270 HydrophobicContact CB-CG 3.76Å; I263-R270 HydrophobicContact CG2-CG 4.48Å; I263-R270 WeakPolarHBondContact O-CG 3.5Å; I263-R270 PolarHBondContact O-NH1 3.31Å; I263-V273 HydrophobicContact CG2-CB 4.47Å; I263-V273 HydrophobicContact CG2-CG2 3.85Å; I263-I346 HydrophobicContact CD1-CB 4.22Å; I263-I346 HydrophobicContact CD1-CG1 4.22Å; I263-I346 HydrophobicContact CD1-CG2 3.71Å; I263-L349 HydrophobicContact CD1-CB 4.06Å; I263-L349 HydrophobicContact CD1-CD1 4.23Å; I263-L349 HydrophobicContact CG1-CB 4.15Å; I263-L349 HydrophobicContact CG1-CD1 3.92Å; I263-L350 HydrophobicContact CD1-CD2 4.09Å; I263-L350 HydrophobicContact CD1-CG 4.3Å
264E90.4Very high90.2Very high73 Ų7335 Ų3534%0.34117%0.17SC..THydrogen-bonded Turntrans-54.6-40.2-171.2-169.5174.9-174.700113.2V260 R270 L349V260-E264 WeakPolarHBondContact O-CB 3.43Å; V260-E264 PolarHBondContact O-N 3.06Å; E264-R270 VanDerWaalsContact C-NH1 3.35Å; E264-R270 PolarHBondContact O-NH1 3.33Å; E264-L349 HydrophobicContact CB-CD1 4.34Å; E264-L349 HydrophobicContact CG-CD2 4.31Å
265H85.4Confident90.1Very high105 Ų10538.6 Ų38.649%0.48619%0.189SC..THydrogen-bonded Turntrans-123.515.3-179.4-56.8-45.7000113.4I263I263-H265 VanDerWaalsContact C-N 3.26Å; I263-H265 PolarHBondContact O-N 3.36Å
266H83.4Confident90.1Very high14 Ų1439 Ų397%0.06519%0.192CC..  trans-126.1101.5-172.9-68.2-69.2000114.3D215 C218 F262 I263 S268 G269 R270D215-H266 WeakPolarHBondContact CA-CE1 3.19Å; D215-H266 WeakPolarHBondContact CA-NE2 3.42Å; D215-H266 PolarHBondContact O-CE1 3.44Å; D215-H266 VanDerWaalsContact O-CE1 3.28Å; D215-H266 IonicContact OD1-CE1 3.37Å; D215-H266 IonicContact OD1-NE2 2.76Å; D215-H266 PolarHBondContact OD1-NE2 3.27Å; C218-H266 WeakPolarHBondContact CB-CD2 3.35Å; C218-H266 WeakPolarHBondContact CB-NE2 3.17Å; F262-H266 WeakPolarHBondContact O-CB 3.21Å; F262-H266 PolarHBondContact O-CD2 3.24Å; I263-H266 PolarHBondContact O-N 3.31Å; H266-S268 VanDerWaalsContact C-N 3.29Å; H266-S268 PolarHBondContact O-N 3.07Å; H266-G269 WeakPolarHBondContact O-CA 3.42Å; H266-G269 PolarHBondContact O-N 3.21Å; H266-R270 PolarHBondContact O-N 3.35Å
267H85.5Confident90.1Very high120 Ų12043.6 Ų43.656%0.55621%0.212SC*.Hα-helixtrans-53.3-42.3172.6-63.8-69.9000113.3R270 R271 D353H267-R270 PolarHBondContact CE1-NH2 3.07Å; H267-R270 PolarHBondContact ND1-NH2 3.47Å; H267-R270 PolarHBondContact O-N 2.79Å; H267-R271 WeakPolarHBondContact O-CB 3.36Å; H267-R271 PolarHBondContact O-N 2.93Å; H267-D353 IonicContact CE1-OD1 3.6Å; H267-D353 PolarHBondContact CE1-OD1 3.03Å; H267-D353 IonicContact CE1-OD2 3.83Å; H267-D353 IonicContact CG-OD2 3.8Å; H267-D353 IonicContact ND1-OD1 3.37Å; H267-D353 PolarHBondContact ND1-OD1 2.88Å; H267-D353 VanDerWaalsContact ND1-OD1 3.09Å; H267-D353 IonicContact ND1-OD2 2.64Å; H267-D353 PolarHBondContact ND1-OD2 2.97Å
268S88Confident89.9Confident51 Ų5141.9 Ų41.936%0.35720%0.2SC..Hα-helixtrans-63.8-41.917755.60000111.8S222 H266 R271 I272S222-S268 WeakPolarHBondContact CB-OG 3.43Å; S222-S268 PolarHBondContact OG-OG 2.75Å; H266-S268 VanDerWaalsContact C-N 3.29Å; H266-S268 PolarHBondContact O-N 3.07Å; S268-R271 PolarHBondContact O-N 2.95Å; S268-I272 WeakPolarHBondContact O-CD1 3.2Å; S268-I272 VanDerWaalsContact O-CG1 3.25Å; S268-I272 WeakPolarHBondContact O-CG1 3.44Å; S268-I272 PolarHBondContact O-N 2.74Å
269G89.2Confident89.7Confident0 Ų046.3 Ų46.30%022%0.217CC..Hα-helixtrans-63.3-46.6176.800000111.6F262 H266 R271 I272 V273F262-G269 VanDerWaalsContact CE1-CA 3.44Å; F262-G269 VanDerWaalsContact CZ-CA 3.49Å; H266-G269 WeakPolarHBondContact O-CA 3.42Å; H266-G269 PolarHBondContact O-N 3.21Å; G269-R271 PolarHBondContact O-N 3.2Å; G269-I272 PolarHBondContact O-N 2.99Å; G269-V273 WeakPolarHBondContact O-CG2 3.33Å; G269-V273 PolarHBondContact O-N 3.41Å
270R90.4Very high89.4Confident19 Ų1946.8 Ų46.87%0.07222%0.219CC..Hα-helixtrans-56.3-49.7174.3-72-171.7-82.1-124.227.7111.7I263 E264 H266 H267 I272 V273 S274 L349 L350 D353I263-R270 HydrophobicContact CB-CG 3.76Å; I263-R270 HydrophobicContact CG2-CG 4.48Å; I263-R270 WeakPolarHBondContact O-CG 3.5Å; I263-R270 PolarHBondContact O-NH1 3.31Å; E264-R270 VanDerWaalsContact C-NH1 3.35Å; E264-R270 PolarHBondContact O-NH1 3.33Å; H266-R270 PolarHBondContact O-N 3.35Å; H267-R270 PolarHBondContact CE1-NH2 3.07Å; H267-R270 PolarHBondContact ND1-NH2 3.47Å; H267-R270 PolarHBondContact O-N 2.79Å; R270-I272 VanDerWaalsContact C-N 3.32Å; R270-I272 PolarHBondContact O-N 2.98Å; R270-V273 PolarHBondContact O-N 3.09Å; R270-S274 WeakPolarHBondContact O-CB 3.2Å; R270-S274 PolarHBondContact O-N 3.47Å; R270-S274 PolarHBondContact O-OG 2.93Å; R270-S274 VanDerWaalsContact O-OG 3.12Å; R270-L349 WeakPolarHBondContact CD-O 3.28Å; R270-L350 HydrophobicContact CB-CD2 3.98Å; R270-L350 HydrophobicContact CG-CD2 4.06Å; R270-D353 WeakPolarHBondContact CD-OD2 3.5Å; R270-D353 IonicContact CZ-OD1 3.27Å; R270-D353 IonicContact CZ-OD2 3.08Å; R270-D353 IonicContact NE-OD1 3.58Å; R270-D353 PolarHBondContact NE-OD1 3.1Å; R270-D353 IonicContact NE-OD2 2.64Å; R270-D353 PolarHBondContact NE-OD2 3.18Å; R270-D353 IonicContact NH2-OD1 2.65Å; R270-D353 PolarHBondContact NH2-OD1 3.28Å; R270-D353 IonicContact NH2-OD2 3.95Å; R270-D353 PolarHBondContact NH2-OD2 3.24Å
271R89.9Confident88.6Confident187 Ų18749.6 Ų49.671%0.70623%0.233SC*.Hα-helixtrans-60.1-40178.2-172.4176.9179.6-177.31.5112.7H267 S268 G269 N275H267-R271 WeakPolarHBondContact O-CB 3.36Å; H267-R271 PolarHBondContact O-N 2.93Å; S268-R271 PolarHBondContact O-N 2.95Å; G269-R271 PolarHBondContact O-N 3.2Å; R271-N275 WeakPolarHBondContact O-CB 3.29Å; R271-N275 PolarHBondContact O-N 3.14Å; R271-N275 PolarHBondContact O-ND2 3.34Å
272I91.8Very high87.7Confident34 Ų3455.4 Ų55.417%0.17426%0.264CS..Hα-helixtrans-63.1-52.5176.8-70.2163.3000109.6S222 I228 S268 G269 R270 S274 N275 S276S222-I272 VanDerWaalsContact O-CD1 3.27Å; S222-I272 WeakPolarHBondContact O-CD1 3.5Å; I228-I272 HydrophobicContact CB-CG2 4.25Å; I228-I272 HydrophobicContact CG2-CG2 3.99Å; S268-I272 WeakPolarHBondContact O-CD1 3.2Å; S268-I272 VanDerWaalsContact O-CG1 3.25Å; S268-I272 WeakPolarHBondContact O-CG1 3.44Å; S268-I272 PolarHBondContact O-N 2.74Å; G269-I272 PolarHBondContact O-N 2.99Å; R270-I272 VanDerWaalsContact C-N 3.32Å; R270-I272 PolarHBondContact O-N 2.98Å; I272-S274 PolarHBondContact O-N 3.31Å; I272-N275 PolarHBondContact O-N 3.35Å; I272-S276 PolarHBondContact O-N 3.13Å; I272-S276 PolarHBondContact O-OG 3.38Å
273V91.1Very high86.5Confident1 Ų159.7 Ų59.71%0.00628%0.284CS..Hα-helixtrans-63.1-41.5-177.2175.90000112I228 L259 F262 I263 G269 R270 N275 S276 F290 L350I228-V273 HydrophobicContact CG2-CG2 4.33Å; L259-V273 HydrophobicContact CD2-CG2 4.45Å; F262-V273 HydrophobicContact CD1-CG2 4.33Å; F262-V273 HydrophobicContact CE1-CG2 4.23Å; I263-V273 HydrophobicContact CG2-CB 4.47Å; I263-V273 HydrophobicContact CG2-CG2 3.85Å; G269-V273 WeakPolarHBondContact O-CG2 3.33Å; G269-V273 PolarHBondContact O-N 3.41Å; R270-V273 PolarHBondContact O-N 3.09Å; V273-N275 VanDerWaalsContact C-N 3.29Å; V273-N275 PolarHBondContact O-N 2.79Å; V273-S276 PolarHBondContact O-N 3.21Å; V273-F290 HydrophobicContact CG1-CD1 3.61Å; V273-F290 HydrophobicContact CG1-CE1 4.02Å; V273-L350 HydrophobicContact CB-CD2 4.11Å; V273-L350 HydrophobicContact CG1-CD1 3.99Å; V273-L350 HydrophobicContact CG1-CD2 4.15Å
274S87.3Confident85.1Confident22 Ų2267 Ų6715%0.15432%0.323CS..Hα-helixtrans-62.9-34.4177.8-63.50000113R270 I272R270-S274 WeakPolarHBondContact O-CB 3.2Å; R270-S274 PolarHBondContact O-N 3.47Å; R270-S274 PolarHBondContact O-OG 2.93Å; R270-S274 VanDerWaalsContact O-OG 3.12Å; I272-S274 PolarHBondContact O-N 3.31Å
275N89.3Confident84Confident99 Ų9972.4 Ų72.453%0.52935%0.349SS..Hα-helixtrans-93-5.5-178.4-68.3-60.8000113.6R271 I272 V273R271-N275 WeakPolarHBondContact O-CB 3.29Å; R271-N275 PolarHBondContact O-N 3.14Å; R271-N275 PolarHBondContact O-ND2 3.34Å; I272-N275 PolarHBondContact O-N 3.35Å; V273-N275 VanDerWaalsContact C-N 3.29Å; V273-N275 PolarHBondContact O-N 2.79Å
276S92.1Very high83.8Confident9 Ų972.1 Ų72.16%0.06335%0.351CS..  trans-71.4132.1179.4-88.10000111.5Q229 L232 I272 V273 Y289 F290Q229-S276 PolarHBondContact OE1-OG 3.13Å; L232-S276 WeakPolarHBondContact CD1-OG 3.29Å; I272-S276 PolarHBondContact O-N 3.13Å; I272-S276 PolarHBondContact O-OG 3.38Å; V273-S276 PolarHBondContact O-N 3.21Å; S276-Y289 WeakPolarHBondContact O-CA 3.29Å; S276-F290 PolarHBondContact O-N 3.04Å
277K91.3Very high83.9Confident98 Ų9875.2 Ų75.243%0.42637%0.371SS..EExtended strand (participates in β ladder)trans-107.9133173.6-64.4-174.1178.2-176.10110Q229 F288 Y289Q229-K277 PolarHBondContact NE2-O 3.29Å; K277-F288 CarbonylContact C-O 3.58Å; K277-F288 WeakPolarHBondContact CA-O 3.37Å; K277-Y289 HydrophobicContact CD-CE1 4.47Å; K277-Y289 VanDerWaalsContact CE-CZ 3.45Å; K277-Y289 WeakPolarHBondContact CE-OH 3.49Å; K277-Y289 HydrophobicContact CG-CD1 3.94Å; K277-Y289 HydrophobicContact CG-CE1 3.88Å; K277-Y289 HydrophobicContact CG-CG 4.47Å
278V89.9Confident83.9Confident0 Ų071.6 Ų71.60%035%0.353CS..EExtended strand (participates in β ladder)trans-131.3157.8-173-64.70000111L232 E233 T236 L280 T287 F288 F290L232-V278 HydrophobicContact CB-CG1 3.7Å; E233-V278 HydrophobicContact CG-CG1 4.36Å; T236-V278 HydrophobicContact CG2-CB 4.29Å; T236-V278 HydrophobicContact CG2-CG2 3.85Å; V278-L280 HydrophobicContact CG2-CD2 4.2Å; V278-T287 CarbonylContact O-C 3.57Å; V278-T287 WeakPolarHBondContact O-CA 3.4Å; V278-F288 PolarHBondContact N-O 3.01Å; V278-F288 PolarHBondContact O-N 3.44Å; V278-F290 HydrophobicContact CG1-CB 4.41Å; V278-F290 HydrophobicContact CG1-CD2 4.29Å; V278-F290 HydrophobicContact CG2-CB 4.33Å; V278-F290 HydrophobicContact CG2-CD2 4.22Å
279R88.1Confident83.9Confident93 Ų9374.1 Ų74.135%0.35136%0.356SS..  trans-84.1148.3169.1-69.1178.5-70.9166.5-1.1110.1E233 T236 Y237 T287E233-R279 IonicContact OE2-NH2 2.91Å; T236-R279 VanDerWaalsContact CB-O 3.3Å; T236-R279 WeakPolarHBondContact CB-O 3.46Å; T236-R279 PolarHBondContact OG1-O 3.3Å; Y237-R279 HydrophobicContact CD2-CB 4.08Å; Y237-R279 HydrophobicContact CG-CB 4.12Å; R279-T287 HydrophobicContact CG-CG2 4.13Å
280L86.4Confident83.8Confident11 Ų1174.1 Ų74.16%0.05836%0.356CS..  trans-114.2151.1175.8-53.5-178.4000109.2T236 V278 D282 E283 F288 Y293 L296T236-L280 HydrophobicContact CG2-CD2 4.48Å; V278-L280 HydrophobicContact CG2-CD2 4.2Å; L280-D282 VanDerWaalsContact C-N 3.26Å; L280-D282 PolarHBondContact O-N 3.2Å; L280-E283 HydrophobicContact CB-CB 4.42Å; L280-E283 HydrophobicContact CB-CG 4.4Å; L280-E283 PolarHBondContact O-N 2.95Å; L280-F288 HydrophobicContact CD1-CB 4.15Å; L280-F288 HydrophobicContact CD1-CD2 3.83Å; L280-F288 HydrophobicContact CD1-CG 4.04Å; L280-F288 HydrophobicContact CG-CB 4.45Å; L280-F288 HydrophobicContact CG-CD2 3.99Å; L280-Y293 HydrophobicContact CD2-CD2 3.94Å; L280-Y293 HydrophobicContact CD2-CG 4.3Å; L280-L296 HydrophobicContact CD1-CD1 3.97Å
281L77.2Confident83.6Confident73 Ų7375.5 Ų75.538%0.38236%0.364SS..THydrogen-bonded Turntrans-59.2-32.3-171.7-170.668.7000114.1P240 M241P240-L281 HydrophobicContact CB-CD1 4.21Å; P240-L281 HydrophobicContact CB-CD2 3.97Å; M241-L281 HydrophobicContact CB-CD1 3.61Å; M241-L281 HydrophobicContact CG-CD1 4.24Å; M241-L281 HydrophobicContact SD-CD1 3.71Å
282D71.2Confident83.2Confident155 Ų15569.5 Ų69.583%0.82935%0.345SS*.THydrogen-bonded Turntrans-110.87.6-171.2-61.9-42.4000114L280L280-D282 VanDerWaalsContact C-N 3.26Å; L280-D282 PolarHBondContact O-N 3.2Å
283E66.3Low83Confident89 Ų8969.2 Ų69.242%0.41634%0.343SS..SBendtrans-116.3118.3-176.9-62.8-129.6-16000111.5L280 E285 F288L280-E283 HydrophobicContact CB-CB 4.42Å; L280-E283 HydrophobicContact CB-CG 4.4Å; L280-E283 PolarHBondContact O-N 2.95Å; E283-E285 PolarHBondContact O-N 3.41Å; E283-F288 HydrophobicContact CB-CD2 4.49Å; E283-F288 HydrophobicContact CB-CE2 3.64Å; E283-F288 HydrophobicContact CB-CZ 4.28Å; E283-F288 VanDerWaalsContact CD-CZ 3.49Å; E283-F288 HydrophobicContact CG-CE2 4.01Å; E283-F288 HydrophobicContact CG-CZ 4.38Å; E283-F288 VanDerWaalsContact OE2-CE2 3.3Å; E283-F288 WeakPolarHBondContact OE2-CE2 3.48Å; E283-F288 WeakPolarHBondContact OE2-CZ 3.47Å
284D62.3Low82.7Confident153 Ų15369.2 Ų69.282%0.81834%0.342SS*.SBendtrans-61.3113.4-175.3-80.3-32.1000112.4N286D284-N286 PolarHBondContact O-N 3.25Å
285E68.6Low82.4Confident187 Ų18772.6 Ų72.687%0.87436%0.356SS*.SBendtrans45.5-5.3175.5-66.8-151.6157.100118.4E283E283-E285 PolarHBondContact O-N 3.41Å
286N80Confident82Confident100 Ų10071.3 Ų71.354%0.53535%0.348SS..  trans-76.8146.1-177.1-75.5-33.8000110.5D284 F288D284-N286 PolarHBondContact O-N 3.25Å; N286-F288 HydrophobicContact CB-CE2 3.55Å; N286-F288 HydrophobicContact CB-CZ 3.74Å
287T86.3Confident81.6Confident79 Ų7972.2 Ų72.249%0.48535%0.352SS..  trans-108.5130.5176.358.50000109.6V278 R279V278-T287 CarbonylContact O-C 3.57Å; V278-T287 WeakPolarHBondContact O-CA 3.4Å; R279-T287 HydrophobicContact CG-CG2 4.13Å
288F86.2Confident80.9Confident43 Ų4369.9 Ų69.919%0.18935%0.345CS..EExtended strand (participates in β ladder)trans-116.2150.3-177.5-65.2-84.8000109.7K277 V278 L280 E283 N286 F290 I292K277-F288 CarbonylContact C-O 3.58Å; K277-F288 WeakPolarHBondContact CA-O 3.37Å; V278-F288 PolarHBondContact N-O 3.01Å; V278-F288 PolarHBondContact O-N 3.44Å; L280-F288 HydrophobicContact CD1-CB 4.15Å; L280-F288 HydrophobicContact CD1-CD2 3.83Å; L280-F288 HydrophobicContact CD1-CG 4.04Å; L280-F288 HydrophobicContact CG-CB 4.45Å; L280-F288 HydrophobicContact CG-CD2 3.99Å; E283-F288 HydrophobicContact CB-CD2 4.49Å; E283-F288 HydrophobicContact CB-CE2 3.64Å; E283-F288 HydrophobicContact CB-CZ 4.28Å; E283-F288 VanDerWaalsContact CD-CZ 3.49Å; E283-F288 HydrophobicContact CG-CE2 4.01Å; E283-F288 HydrophobicContact CG-CZ 4.38Å; E283-F288 VanDerWaalsContact OE2-CE2 3.3Å; E283-F288 WeakPolarHBondContact OE2-CE2 3.48Å; E283-F288 WeakPolarHBondContact OE2-CZ 3.47Å; N286-F288 HydrophobicContact CB-CE2 3.55Å; N286-F288 HydrophobicContact CB-CZ 3.74Å; F288-F290 PolarHBondContact O-N 2.92Å; F288-I292 HydrophobicContact CB-CB 4.45Å; F288-I292 HydrophobicContact CB-CD1 4.11Å; F288-I292 HydrophobicContact CD1-CD1 4.04Å
289Y87.3Confident80.1Confident105 Ų10574.4 Ų74.441%0.41237%0.368SS..EExtended strand (participates in β ladder)trans-59.8138.5171.2-73.1-74.1000110.2S276 K277 I291 I292S276-Y289 WeakPolarHBondContact O-CA 3.29Å; K277-Y289 HydrophobicContact CD-CE1 4.47Å; K277-Y289 VanDerWaalsContact CE-CZ 3.45Å; K277-Y289 WeakPolarHBondContact CE-OH 3.49Å; K277-Y289 HydrophobicContact CG-CD1 3.94Å; K277-Y289 HydrophobicContact CG-CE1 3.88Å; K277-Y289 HydrophobicContact CG-CG 4.47Å; Y289-I291 PolarHBondContact O-N 3.49Å; Y289-I291 VanDerWaalsContact O-N 3.08Å; Y289-I292 VanDerWaalsContact O-CB 3.3Å; Y289-I292 WeakPolarHBondContact O-CB 3.4Å; Y289-I292 PolarHBondContact O-N 2.89Å
290F87.7Confident79.4Confident0 Ų074.3 Ų74.30%038%0.375CS..Hα-helixtrans-55.8-29.9180-179.6-109000112.6L232 V235 T236 M256 L259 V273 S276 V278 F288 I292 Y293 L294L232-F290 HydrophobicContact CB-CD2 4.26Å; L232-F290 HydrophobicContact CB-CE2 4.49Å; L232-F290 HydrophobicContact CD1-CB 4.5Å; L232-F290 HydrophobicContact CD1-CG 4.38Å; L232-F290 HydrophobicContact CD2-CD1 3.93Å; L232-F290 HydrophobicContact CD2-CD2 3.89Å; L232-F290 HydrophobicContact CD2-CE1 3.75Å; L232-F290 HydrophobicContact CD2-CE2 3.74Å; L232-F290 HydrophobicContact CD2-CG 3.99Å; L232-F290 HydrophobicContact CD2-CZ 3.66Å; L232-F290 HydrophobicContact CG-CD2 4.49Å; V235-F290 HydrophobicContact CG1-CE2 3.91Å; V235-F290 HydrophobicContact CG1-CZ 4.39Å; T236-F290 HydrophobicContact CG2-CD2 3.74Å; T236-F290 HydrophobicContact CG2-CE2 3.66Å; M256-F290 HydrophobicContact SD-CZ 4.37Å; L259-F290 HydrophobicContact CD1-CE1 4.05Å; L259-F290 HydrophobicContact CD1-CZ 3.75Å; V273-F290 HydrophobicContact CG1-CD1 3.61Å; V273-F290 HydrophobicContact CG1-CE1 4.02Å; S276-F290 PolarHBondContact O-N 3.04Å; V278-F290 HydrophobicContact CG1-CB 4.41Å; V278-F290 HydrophobicContact CG1-CD2 4.29Å; V278-F290 HydrophobicContact CG2-CB 4.33Å; V278-F290 HydrophobicContact CG2-CD2 4.22Å; F288-F290 PolarHBondContact O-N 2.92Å; F290-I292 PolarHBondContact O-N 3.4Å; F290-Y293 HydrophobicContact CD2-CD1 4.16Å; F290-Y293 AromaticContact CE2-CD1 3.59Å; F290-Y293 HydrophobicContact CE2-CD1 3.59Å; F290-Y293 HydrophobicContact CE2-CE1 4.13Å; F290-Y293 HydrophobicContact CE2-CG 4.46Å; F290-Y293 HydrophobicContact CZ-CD1 4.15Å; F290-Y293 WeakPolarHBondContact O-CB 3.22Å; F290-Y293 PolarHBondContact O-N 2.9Å; F290-L294 HydrophobicContact CD1-CD1 3.93Å; F290-L294 HydrophobicContact CD1-CG 4.12Å; F290-L294 HydrophobicContact CE1-CD1 3.74Å; F290-L294 HydrophobicContact CE1-CD2 3.71Å; F290-L294 HydrophobicContact CE1-CG 3.8Å; F290-L294 HydrophobicContact CZ-CD2 3.78Å; F290-L294 HydrophobicContact CZ-CG 4.21Å; F290-L294 PolarHBondContact O-N 3.3Å
291I85Confident78.6Confident47 Ų4774.6 Ų74.624%0.24138%0.376CS..Hα-helixtrans-54.6-35.9172.5-66.8176000112.4Y289 L294 Q295 L347 L350Y289-I291 PolarHBondContact O-N 3.49Å; Y289-I291 VanDerWaalsContact O-N 3.08Å; I291-L294 WeakPolarHBondContact O-CB 3.4Å; I291-L294 PolarHBondContact O-N 3.05Å; I291-Q295 WeakPolarHBondContact O-CG 3.33Å; I291-Q295 PolarHBondContact O-N 2.88Å; I291-L347 HydrophobicContact CB-CD2 4.45Å; I291-L347 HydrophobicContact CG2-CD2 3.77Å; I291-L350 HydrophobicContact CD1-CD1 4.49Å; I291-L350 HydrophobicContact CG1-CD1 4.1Å
292I82Confident77.7Confident61 Ų6177.2 Ų77.231%0.31339%0.386SS..Hα-helixtrans-65.4-41.7177.9-61.4175.7000110.3F288 Y289 F290 L294 Q295 L296F288-I292 HydrophobicContact CB-CB 4.45Å; F288-I292 HydrophobicContact CB-CD1 4.11Å; F288-I292 HydrophobicContact CD1-CD1 4.04Å; Y289-I292 VanDerWaalsContact O-CB 3.3Å; Y289-I292 WeakPolarHBondContact O-CB 3.4Å; Y289-I292 PolarHBondContact O-N 2.89Å; F290-I292 PolarHBondContact O-N 3.4Å; I292-L294 VanDerWaalsContact C-N 3.32Å; I292-L294 PolarHBondContact O-N 3.2Å; I292-Q295 PolarHBondContact O-N 3.48Å; I292-L296 HydrophobicContact CG2-CD1 4.35Å; I292-L296 WeakPolarHBondContact O-CG 3.45Å; I292-L296 PolarHBondContact O-N 3.11Å
293Y86.5Confident77.1Confident29 Ų2972 Ų7211%0.11437%0.365CS..Hα-helixtrans-59.5-43.5174.3171.4-101.9000111.8V235 T236 L280 F290 Q295 L296 L297V235-Y293 HydrophobicContact CG1-CE1 4.46Å; T236-Y293 HydrophobicContact CG2-CD1 3.62Å; T236-Y293 HydrophobicContact CG2-CD2 3.8Å; T236-Y293 HydrophobicContact CG2-CE1 3.94Å; T236-Y293 HydrophobicContact CG2-CE2 4.1Å; T236-Y293 HydrophobicContact CG2-CG 3.53Å; L280-Y293 HydrophobicContact CD2-CD2 3.94Å; L280-Y293 HydrophobicContact CD2-CG 4.3Å; F290-Y293 HydrophobicContact CD2-CD1 4.16Å; F290-Y293 AromaticContact CE2-CD1 3.59Å; F290-Y293 HydrophobicContact CE2-CD1 3.59Å; F290-Y293 HydrophobicContact CE2-CE1 4.13Å; F290-Y293 HydrophobicContact CE2-CG 4.46Å; F290-Y293 HydrophobicContact CZ-CD1 4.15Å; F290-Y293 WeakPolarHBondContact O-CB 3.22Å; F290-Y293 PolarHBondContact O-N 2.9Å; Y293-Q295 VanDerWaalsContact C-N 3.34Å; Y293-Q295 PolarHBondContact O-N 2.85Å; Y293-L296 WeakPolarHBondContact O-CB 3.44Å; Y293-L296 PolarHBondContact O-N 3.48Å; Y293-L297 HydrophobicContact CD1-CD1 4.21Å; Y293-L297 HydrophobicContact CE1-CD1 3.54Å; Y293-L297 HydrophobicContact CE1-CG 4.24Å; Y293-L297 HydrophobicContact CE2-CG 4.45Å; Y293-L297 PolarHBondContact O-N 3.35Å; Y293-L297 VanDerWaalsContact O-N 3.08Å
294L85.6Confident76.7Confident0 Ų069.2 Ų69.20%035%0.354CS..Hα-helixtrans-62.6-40.9177.2-59.9175000112M256 F290 I291 I292 L297 L298 A343 I346 L347 L350M256-L294 HydrophobicContact CE-CD2 3.61Å; M256-L294 HydrophobicContact SD-CD2 4.37Å; F290-L294 HydrophobicContact CD1-CD1 3.93Å; F290-L294 HydrophobicContact CD1-CG 4.12Å; F290-L294 HydrophobicContact CE1-CD1 3.74Å; F290-L294 HydrophobicContact CE1-CD2 3.71Å; F290-L294 HydrophobicContact CE1-CG 3.8Å; F290-L294 HydrophobicContact CZ-CD2 3.78Å; F290-L294 HydrophobicContact CZ-CG 4.21Å; F290-L294 PolarHBondContact O-N 3.3Å; I291-L294 WeakPolarHBondContact O-CB 3.4Å; I291-L294 PolarHBondContact O-N 3.05Å; I292-L294 VanDerWaalsContact C-N 3.32Å; I292-L294 PolarHBondContact O-N 3.2Å; L294-L297 PolarHBondContact O-N 3.17Å; L294-L298 PolarHBondContact O-N 3.45Å; L294-A343 HydrophobicContact CB-CB 4.3Å; L294-A343 HydrophobicContact CD2-CB 3.95Å; L294-I346 HydrophobicContact CD1-CB 4.26Å; L294-I346 HydrophobicContact CD1-CG2 3.5Å; L294-I346 HydrophobicContact CD2-CG2 4.38Å; L294-L347 HydrophobicContact CB-CD1 3.67Å; L294-L347 HydrophobicContact CB-CD2 3.92Å; L294-L347 HydrophobicContact CB-CG 3.68Å; L294-L347 HydrophobicContact CD1-CD2 3.82Å; L294-L347 HydrophobicContact CD1-CG 3.81Å; L294-L347 HydrophobicContact CG-CG 4.39Å; L294-L350 HydrophobicContact CD1-CD1 4.24Å
295Q80.8Confident76.5Confident93 Ų9369.1 Ų69.144%0.43534%0.342SS..Hα-helixtrans-64.8-38.8175.6-71.5172.3-1300112I291 I292 Y293 L297 L298 N299 L347I291-Q295 WeakPolarHBondContact O-CG 3.33Å; I291-Q295 PolarHBondContact O-N 2.88Å; I292-Q295 PolarHBondContact O-N 3.48Å; Y293-Q295 VanDerWaalsContact C-N 3.34Å; Y293-Q295 PolarHBondContact O-N 2.85Å; Q295-L297 VanDerWaalsContact C-N 3.34Å; Q295-L297 PolarHBondContact O-N 3.33Å; Q295-L298 PolarHBondContact O-N 3.29Å; Q295-N299 WeakPolarHBondContact O-CB 3.32Å; Q295-N299 PolarHBondContact O-N 2.92Å; Q295-N299 PolarHBondContact O-ND2 3.27Å; Q295-L347 HydrophobicContact CG-CD1 4.32Å
296L82.2Confident76Confident72 Ų7264.3 Ų64.338%0.37733%0.325SS..Hα-helixtrans-62.2-40.8175-72.8169.8000112L280 I292 Y293 L298 N299 N300L280-L296 HydrophobicContact CD1-CD1 3.97Å; I292-L296 HydrophobicContact CG2-CD1 4.35Å; I292-L296 WeakPolarHBondContact O-CG 3.45Å; I292-L296 PolarHBondContact O-N 3.11Å; Y293-L296 WeakPolarHBondContact O-CB 3.44Å; Y293-L296 PolarHBondContact O-N 3.48Å; L296-L298 PolarHBondContact O-N 2.67Å; L296-N299 PolarHBondContact O-N 2.96Å; L296-N300 WeakPolarHBondContact O-CB 3.3Å; L296-N300 VanDerWaalsContact O-CG 3.27Å; L296-N300 PolarHBondContact O-N 2.85Å; L296-N300 PolarHBondContact O-ND2 3.46Å
297L83Confident74.7Confident28 Ų2865 Ų6515%0.14733%0.325CS..Hα-helixtrans-60.9-43.5175-72.3177.5000112.1M256 Y293 L294 Q295 N300 E301 A343M256-L297 HydrophobicContact CE-CD1 4.27Å; Y293-L297 HydrophobicContact CD1-CD1 4.21Å; Y293-L297 HydrophobicContact CE1-CD1 3.54Å; Y293-L297 HydrophobicContact CE1-CG 4.24Å; Y293-L297 HydrophobicContact CE2-CG 4.45Å; Y293-L297 PolarHBondContact O-N 3.35Å; Y293-L297 VanDerWaalsContact O-N 3.08Å; L294-L297 PolarHBondContact O-N 3.17Å; Q295-L297 VanDerWaalsContact C-N 3.34Å; Q295-L297 PolarHBondContact O-N 3.33Å; L297-N300 PolarHBondContact O-N 3.22Å; L297-E301 PolarHBondContact O-N 3.44Å; L297-A343 HydrophobicContact CB-CB 4.03Å; L297-A343 HydrophobicContact CD1-CB 4.03Å
298L75.3Confident73.1Confident50 Ų5063.3 Ų63.326%0.26232%0.315SS..Hα-helixtrans-64.5-44.9176.6-71.7177.6000112.3L294 Q295 L296 N300 E301 E302 A340 A343 L347L294-L298 PolarHBondContact O-N 3.45Å; Q295-L298 PolarHBondContact O-N 3.29Å; L296-L298 PolarHBondContact O-N 2.67Å; L298-N300 VanDerWaalsContact C-N 3.31Å; L298-N300 PolarHBondContact O-N 3.16Å; L298-E301 WeakPolarHBondContact O-CB 3.3Å; L298-E301 PolarHBondContact O-N 3.32Å; L298-E301 VanDerWaalsContact O-N 3.17Å; L298-E302 PolarHBondContact O-N 3.26Å; L298-A340 HydrophobicContact CD2-CB 4.32Å; L298-A340 VanDerWaalsContact CD2-O 3.31Å; L298-A340 WeakPolarHBondContact CD2-O 3.47Å; L298-A343 HydrophobicContact CG-CB 4.47Å; L298-L347 HydrophobicContact CD1-CD1 3.4Å; L298-L347 VanDerWaalsContact CD1-CD1 3.4Å; L298-L347 HydrophobicContact CG-CD1 4.36Å
299N73.8Confident71.3Confident94 Ų9463.6 Ų63.650%0.50333%0.33SS..Hα-helixtrans-64.3-37.2179.6-69.6-17.7000111.9Q295 L296 E301 E302 A303Q295-N299 WeakPolarHBondContact O-CB 3.32Å; Q295-N299 PolarHBondContact O-N 2.92Å; Q295-N299 PolarHBondContact O-ND2 3.27Å; L296-N299 PolarHBondContact O-N 2.96Å; N299-E301 VanDerWaalsContact C-N 3.32Å; N299-E301 PolarHBondContact O-N 3.27Å; N299-E302 PolarHBondContact O-N 3.35Å; N299-A303 PolarHBondContact O-N 3.12Å
300N74.3Confident69.3Low92 Ų9265.6 Ų65.649%0.49234%0.341SS..Hα-helixtrans-63.4-38.9175-76.6-19.6000111.5L296 L297 L298 E302 A303 V304L296-N300 WeakPolarHBondContact O-CB 3.3Å; L296-N300 VanDerWaalsContact O-CG 3.27Å; L296-N300 PolarHBondContact O-N 2.85Å; L296-N300 PolarHBondContact O-ND2 3.46Å; L297-N300 PolarHBondContact O-N 3.22Å; L298-N300 VanDerWaalsContact C-N 3.31Å; L298-N300 PolarHBondContact O-N 3.16Å; N300-E302 PolarHBondContact O-N 3.21Å; N300-A303 PolarHBondContact O-N 3.08Å; N300-V304 WeakPolarHBondContact O-CB 3.38Å; N300-V304 WeakPolarHBondContact O-CG2 3.37Å; N300-V304 PolarHBondContact O-N 3.17Å
301E68.1Low67.3Low17 Ų1768.9 Ų68.98%0.07936%0.357CS..Hα-helixtrans-61.7-43.4174.7-160.7-157.5161.400112L297 L298 N299 A303 V304 R305 A340L297-E301 PolarHBondContact O-N 3.44Å; L298-E301 WeakPolarHBondContact O-CB 3.3Å; L298-E301 PolarHBondContact O-N 3.32Å; L298-E301 VanDerWaalsContact O-N 3.17Å; N299-E301 VanDerWaalsContact C-N 3.32Å; N299-E301 PolarHBondContact O-N 3.27Å; E301-A303 PolarHBondContact O-N 3.06Å; E301-V304 PolarHBondContact O-N 3.34Å; E301-R305 WeakPolarHBondContact O-CG 3.23Å; E301-R305 PolarHBondContact O-N 3.23Å; E301-R305 IonicContact OE1-CZ 3.35Å; E301-R305 IonicContact OE1-NE 3.72Å; E301-R305 PolarHBondContact OE1-NE 2.66Å; E301-R305 IonicContact OE1-NH2 2.81Å; E301-R305 PolarHBondContact OE1-NH2 2.65Å; E301-R305 IonicContact OE2-NH2 3Å; E301-A340 HydrophobicContact CB-CB 3.6Å; E301-A340 HydrophobicContact CG-CB 3.82Å; E301-A340 WeakPolarHBondContact OE2-CB 3.38Å
302E59.5Low65.4Low128 Ų12877.3 Ų77.360%0.59839%0.386SS*.Hα-helixtrans-62.3-42.6176.5-69.2-167.816300112L298 N299 N300 V304 R305 T306L298-E302 PolarHBondContact O-N 3.26Å; N299-E302 PolarHBondContact O-N 3.35Å; N300-E302 PolarHBondContact O-N 3.21Å; E302-V304 VanDerWaalsContact C-N 3.29Å; E302-V304 PolarHBondContact O-N 2.99Å; E302-R305 PolarHBondContact O-N 3.41Å; E302-T306 WeakPolarHBondContact O-CG2 3.08Å; E302-T306 PolarHBondContact O-N 3.09Å; E302-T306 VanDerWaalsContact O-N 3.11Å; E302-T306 PolarHBondContact O-OG1 3.41Å
303A58.2Low63.5Low46 Ų4682.2 Ų82.238%0.3841%0.409SS..Hα-helixtrans-62.1-37.9174.600000111.9N299 N300 E301 T306 H307N299-A303 PolarHBondContact O-N 3.12Å; N300-A303 PolarHBondContact O-N 3.08Å; E301-A303 PolarHBondContact O-N 3.06Å; A303-T306 PolarHBondContact O-OG1 2.83Å; A303-H307 PolarHBondContact O-N 2.75Å; A303-H307 VanDerWaalsContact O-N 3.1Å
304V57.5Low61.5Low29 Ų2989.9 Ų89.918%0.17644%0.443CS..Hα-helixtrans-72.5-39.9179.6167.10000111.9N300 E301 E302 T306 H307 T308 H333 E336N300-V304 WeakPolarHBondContact O-CB 3.38Å; N300-V304 WeakPolarHBondContact O-CG2 3.37Å; N300-V304 PolarHBondContact O-N 3.17Å; E301-V304 PolarHBondContact O-N 3.34Å; E302-V304 VanDerWaalsContact C-N 3.29Å; E302-V304 PolarHBondContact O-N 2.99Å; V304-T306 VanDerWaalsContact C-N 3.34Å; V304-T306 PolarHBondContact O-N 2.96Å; V304-H307 PolarHBondContact O-N 3.2Å; V304-T308 PolarHBondContact O-N 3.48Å; V304-T308 PolarHBondContact O-OG1 2.92Å; V304-H333 HydrophobicContact CG1-CB 4.42Å; V304-H333 WeakPolarHBondContact CG1-CD2 3.37Å; V304-E336 WeakPolarHBondContact CG1-OE2 3.35Å; V304-E336 WeakPolarHBondContact CG2-OE2 3.18Å
305R58.4Low59.7Low151 Ų15193 Ų9357%0.5747%0.468SS*.Hα-helixtrans-59.8-42.1172.7-75.5177.3179.1-169.20.8111.8E301 E302 T308 G309E301-R305 WeakPolarHBondContact O-CG 3.23Å; E301-R305 PolarHBondContact O-N 3.23Å; E301-R305 IonicContact OE1-CZ 3.35Å; E301-R305 IonicContact OE1-NE 3.72Å; E301-R305 PolarHBondContact OE1-NE 2.66Å; E301-R305 IonicContact OE1-NH2 2.81Å; E301-R305 PolarHBondContact OE1-NH2 2.65Å; E301-R305 IonicContact OE2-NH2 3Å; E302-R305 PolarHBondContact O-N 3.41Å; R305-T308 PolarHBondContact O-OG1 3.46Å; R305-G309 PolarHBondContact O-N 2.79Å
306T57.5Low58.1Low86 Ų8696 Ų9653%0.52849%0.486SS..Hα-helixtrans-71.1-32.2178.361.10000112.9E302 A303 V304E302-T306 WeakPolarHBondContact O-CG2 3.08Å; E302-T306 PolarHBondContact O-N 3.09Å; E302-T306 VanDerWaalsContact O-N 3.11Å; E302-T306 PolarHBondContact O-OG1 3.41Å; A303-T306 PolarHBondContact O-OG1 2.83Å; V304-T306 VanDerWaalsContact C-N 3.34Å; V304-T306 PolarHBondContact O-N 2.96Å
307H54Low56Low116 Ų116101 Ų10154%0.53751%0.507SS..Hα-helixtrans-76.5-38.3176.4-97.6-66.5000114.2A303 V304 K310 M311A303-H307 PolarHBondContact O-N 2.75Å; A303-H307 VanDerWaalsContact O-N 3.1Å; V304-H307 PolarHBondContact O-N 3.2Å; H307-K310 PolarHBondContact O-N 3Å; H307-M311 HydrophobicContact CB-CE 4.49Å; H307-M311 PolarHBondContact O-N 3.29Å
308T51.3Low54.1Low42 Ų42107.8 Ų107.826%0.25854%0.538SS..Hα-helixtrans-69.8-34.917846.50000112.6V304 R305 K310 M311 R312 H333V304-T308 PolarHBondContact O-N 3.48Å; V304-T308 PolarHBondContact O-OG1 2.92Å; R305-T308 PolarHBondContact O-OG1 3.46Å; T308-K310 PolarHBondContact O-N 3.48Å; T308-M311 PolarHBondContact O-N 2.83Å; T308-M311 VanDerWaalsContact O-N 3.16Å; T308-R312 PolarHBondContact O-N 2.91Å; T308-H333 VanDerWaalsContact CG2-CD2 3.47Å; T308-H333 WeakPolarHBondContact CG2-CD2 3.48Å
309G49.6Very low53Low49 Ų49110.5 Ų110.551%0.50556%0.557SS.*Hα-helixtrans-55.6-36.4169.800000113R305R305-G309 PolarHBondContact O-N 2.79Å
310K45.1Very low52.1Low148 Ų148111.8 Ų111.864%0.64357%0.568SS**Hα-helixtrans-78.1-29.8177.2-69.6175.5-178.31710113.6H307 T308H307-K310 PolarHBondContact O-N 3Å; T308-K310 PolarHBondContact O-N 3.48Å
311M45.6Very low51Low68 Ų68113.9 Ų113.934%0.33558%0.575SS.*Hα-helixtrans-82.3-33.1-179.3-98.9179.8-7500114.1H307 T308 M313 K314 A315 K329H307-M311 HydrophobicContact CB-CE 4.49Å; H307-M311 PolarHBondContact O-N 3.29Å; T308-M311 PolarHBondContact O-N 2.83Å; T308-M311 VanDerWaalsContact O-N 3.16Å; M311-M313 PolarHBondContact O-N 3.5Å; M311-M313 VanDerWaalsContact O-N 3.08Å; M311-K314 PolarHBondContact O-N 3.26Å; M311-A315 PolarHBondContact O-N 3.44Å; M311-K329 HydrophobicContact CE-CD 4.23Å; M311-K329 HydrophobicContact SD-CD 3.95Å; M311-K329 PolarHBondContact SD-NZ 3.04Å
312R46Very low50.6Low224 Ų224116.2 Ų116.285%0.84559%0.59SS**THydrogen-bonded Turntrans-55.8-26.2173-101.8-178.2164.5170.8-3.1112.8T308T308-R312 PolarHBondContact O-N 2.91Å
313M41.5Very low50.4Low165 Ų165112.8 Ų112.881%0.81358%0.583SS**THydrogen-bonded Turntrans-82.6-13.2178.6-140.6148.765.100114M311M311-M313 PolarHBondContact O-N 3.5Å; M311-M313 VanDerWaalsContact O-N 3.08Å
314K45Very low50.3Low190 Ų190115.4 Ų115.483%0.82659%0.591SS**THydrogen-bonded Turntrans-108-9-178.8-81.5-170.9176.6-174.50114.9M311 I316M311-K314 PolarHBondContact O-N 3.26Å; K314-I316 PolarHBondContact O-N 3.02Å
315A46.4Very low50.5Low64 Ų64119.2 Ų119.253%0.52961%0.609SS.*THydrogen-bonded Turntrans-95.927-167.900000116M311M311-A315 PolarHBondContact O-N 3.44Å
316I48Very low50.6Low156 Ų156114.5 Ų114.580%0.860%0.603SS**THydrogen-bonded Turntrans-92.1-2.1-179.1-69.7179.1000114.1K314K314-I316 PolarHBondContact O-N 3.02Å
317E39.1Very low51Low178 Ų178116.1 Ų116.183%0.83261%0.608SS**SBendtrans-118107.5-180-77.6-179.3156.700114.6
318Q42.6Very low51.6Low170 Ų170115 Ų11579%0.79461%0.609SS**  trans53.7137.7155.3-73.1-177.8-10.600123.5
319T51.6Low52.4Low108 Ų108118.2 Ų118.266%0.66362%0.619SS**  trans97.4136154.6-190000117.7H321 V322 A323T319-H321 PolarHBondContact O-N 3.49Å; T319-V322 WeakPolarHBondContact O-CB 3.31Å; T319-V322 PolarHBondContact O-N 3.02Å; T319-A323 PolarHBondContact O-N 3.19Å
320V55.2Low53.4Low121 Ų121118.5 Ų118.573%0.73362%0.617SS**Hα-helixtrans-47.7-34.4-177.91770000113.4V322 A323 L324V320-V322 PolarHBondContact O-N 3.34Å; V320-A323 PolarHBondContact O-N 2.96Å; V320-L324 PolarHBondContact O-N 3.49Å
321H51.9Low54.4Low135 Ų135115.8 Ų115.863%0.62561%0.609SS**Hα-helixtrans-67.6-34.1179-141.5-58.4000113T319 L325T319-H321 PolarHBondContact O-N 3.49Å; H321-L325 WeakPolarHBondContact O-CB 3.11Å; H321-L325 WeakPolarHBondContact O-CD1 3.25Å; H321-L325 VanDerWaalsContact O-CG 3.29Å; H321-L325 WeakPolarHBondContact O-CG 3.37Å; H321-L325 PolarHBondContact O-N 3.34Å
322V58.4Low55.8Low67 Ų67118.5 Ų118.541%0.40662%0.619SS.*Hα-helixtrans-72.1-38.3173.7-179.80000110.1T319 V320 L325 A326T319-V322 WeakPolarHBondContact O-CB 3.31Å; T319-V322 PolarHBondContact O-N 3.02Å; V320-V322 PolarHBondContact O-N 3.34Å; V322-L325 PolarHBondContact O-N 3.49Å; V322-A326 WeakPolarHBondContact O-CB 3.38Å; V322-A326 PolarHBondContact O-N 3.08Å
323A55.6Low57.2Low55 Ų55110.2 Ų110.246%0.45559%0.59SS.*Hα-helixtrans-63.8-42.1174.200000111.9T319 V320 A326 L327T319-A323 PolarHBondContact O-N 3.19Å; V320-A323 PolarHBondContact O-N 2.96Å; A323-A326 PolarHBondContact O-N 3.29Å; A323-L327 WeakPolarHBondContact O-CB 3.49Å; A323-L327 WeakPolarHBondContact O-CG 3.49Å; A323-L327 PolarHBondContact O-N 3.24Å
324L57.1Low59.2Low102 Ų102107.8 Ų107.853%0.53458%0.578SS.*Hα-helixtrans-63.9-45.3174.8-165.480.3000111.3V320 A326 L327 V328V320-L324 PolarHBondContact O-N 3.49Å; L324-A326 VanDerWaalsContact C-N 3.32Å; L324-A326 PolarHBondContact O-N 3.45Å; L324-L327 WeakPolarHBondContact O-CB 2.87Å; L324-L327 PolarHBondContact O-N 2.94Å; L324-V328 WeakPolarHBondContact O-CG2 3.38Å; L324-V328 PolarHBondContact O-N 3.25Å
325L60.9Low61.1Low108 Ų108100.7 Ų100.757%0.56555%0.548SS*.Hα-helixtrans-62.4-39174.7-78.2166.1000112.1H321 V322 K329H321-L325 WeakPolarHBondContact O-CB 3.11Å; H321-L325 WeakPolarHBondContact O-CD1 3.25Å; H321-L325 VanDerWaalsContact O-CG 3.29Å; H321-L325 WeakPolarHBondContact O-CG 3.37Å; H321-L325 PolarHBondContact O-N 3.34Å; V322-L325 PolarHBondContact O-N 3.49Å; L325-K329 WeakPolarHBondContact O-CB 3.47Å; L325-K329 PolarHBondContact O-N 2.82Å
326A60.7Low62.8Low53 Ų53100.5 Ų100.544%0.43854%0.536SS..Hα-helixtrans-66-39175.500000111.4V322 A323 L324 K329 A330V322-A326 WeakPolarHBondContact O-CB 3.38Å; V322-A326 PolarHBondContact O-N 3.08Å; A323-A326 PolarHBondContact O-N 3.29Å; L324-A326 VanDerWaalsContact C-N 3.32Å; L324-A326 PolarHBondContact O-N 3.45Å; A326-K329 PolarHBondContact O-N 3.25Å; A326-A330 VanDerWaalsContact O-CB 3.23Å; A326-A330 WeakPolarHBondContact O-CB 3.39Å; A326-A330 PolarHBondContact O-N 3Å
327L64.6Low64.6Low119 Ų11994.3 Ų94.362%0.62351%0.506SS*.Hα-helixtrans-63.7-51.7173.7-81163.6000111.5A323 L324 K329 A330 D331A323-L327 WeakPolarHBondContact O-CB 3.49Å; A323-L327 WeakPolarHBondContact O-CG 3.49Å; A323-L327 PolarHBondContact O-N 3.24Å; L324-L327 WeakPolarHBondContact O-CB 2.87Å; L324-L327 PolarHBondContact O-N 2.94Å; L327-K329 PolarHBondContact O-N 2.64Å; L327-A330 PolarHBondContact O-N 3.12Å; L327-A330 VanDerWaalsContact O-N 3.09Å; L327-D331 WeakPolarHBondContact O-CB 3.3Å; L327-D331 PolarHBondContact O-N 3.26Å
328V66.5Low67Low93 Ų9387.9 Ų87.956%0.56448%0.479SS*.Hα-helixtrans-57.3-39.2176.9171.70000111.1L324 K332L324-V328 WeakPolarHBondContact O-CG2 3.38Å; L324-V328 PolarHBondContact O-N 3.25Å; V328-K332 PolarHBondContact O-N 3.09Å
329K68.8Low69.2Low110 Ų11080.9 Ų80.948%0.47845%0.447SS..Hα-helixtrans-71.8-36.4177.8-165.8163.4-162.5160.10113.1M311 L325 A326 L327 D331 H333M311-K329 HydrophobicContact CE-CD 4.23Å; M311-K329 HydrophobicContact SD-CD 3.95Å; M311-K329 PolarHBondContact SD-NZ 3.04Å; L325-K329 WeakPolarHBondContact O-CB 3.47Å; L325-K329 PolarHBondContact O-N 2.82Å; A326-K329 PolarHBondContact O-N 3.25Å; L327-K329 PolarHBondContact O-N 2.64Å; K329-D331 VanDerWaalsContact C-N 3.35Å; K329-H333 VanDerWaalsContact O-CB 3.31Å; K329-H333 WeakPolarHBondContact O-CB 3.36Å; K329-H333 PolarHBondContact O-N 3.46Å
330A70.4Confident70.9Confident54 Ų5475.8 Ų75.845%0.44642%0.416SS..Hα-helixtrans-68.8-36.3174.600000111.6A326 L327 H333 M334A326-A330 VanDerWaalsContact O-CB 3.23Å; A326-A330 WeakPolarHBondContact O-CB 3.39Å; A326-A330 PolarHBondContact O-N 3Å; L327-A330 PolarHBondContact O-N 3.12Å; L327-A330 VanDerWaalsContact O-N 3.09Å; A330-H333 WeakPolarHBondContact O-CB 3.39Å; A330-H333 PolarHBondContact O-N 3.45Å; A330-M334 PolarHBondContact O-N 2.95Å
331D67.4Low72.6Confident92 Ų9273.7 Ų73.749%0.49241%0.406SS..Hα-helixtrans-64.1-53.6175.4-162.142.2000110.4L327 K329 H333 M334 E335L327-D331 WeakPolarHBondContact O-CB 3.3Å; L327-D331 PolarHBondContact O-N 3.26Å; K329-D331 VanDerWaalsContact C-N 3.35Å; D331-H333 VanDerWaalsContact C-N 3.27Å; D331-H333 PolarHBondContact O-N 2.89Å; D331-M334 WeakPolarHBondContact O-CA 3.1Å; D331-M334 VanDerWaalsContact O-CB 3.23Å; D331-M334 WeakPolarHBondContact O-CB 3.41Å; D331-M334 PolarHBondContact O-N 3.24Å; D331-E335 PolarHBondContact O-N 3.39Å
332K73.6Confident74.5Confident124 Ų12469.1 Ų69.154%0.53939%0.385SS..Hα-helixtrans-56.7-39.8174.4-174.7171.8179.9175.10113V328 M334 E335 E336V328-K332 PolarHBondContact O-N 3.09Å; K332-M334 VanDerWaalsContact C-N 3.3Å; K332-M334 PolarHBondContact O-N 3.02Å; K332-E335 PolarHBondContact O-N 3.17Å; K332-E336 WeakPolarHBondContact CE-OE1 3.1Å; K332-E336 WeakPolarHBondContact O-CG 3.31Å; K332-E336 PolarHBondContact O-N 3.41Å
333H76.8Confident76Confident50 Ų5065.9 Ų65.923%0.23137%0.366CS..Hα-helixtrans-61.5-40.2173.6172.7-72.2000111.8V304 T308 K329 A330 D331 E336 C337V304-H333 HydrophobicContact CG1-CB 4.42Å; V304-H333 WeakPolarHBondContact CG1-CD2 3.37Å; T308-H333 VanDerWaalsContact CG2-CD2 3.47Å; T308-H333 WeakPolarHBondContact CG2-CD2 3.48Å; K329-H333 VanDerWaalsContact O-CB 3.31Å; K329-H333 WeakPolarHBondContact O-CB 3.36Å; K329-H333 PolarHBondContact O-N 3.46Å; A330-H333 WeakPolarHBondContact O-CB 3.39Å; A330-H333 PolarHBondContact O-N 3.45Å; D331-H333 VanDerWaalsContact C-N 3.27Å; D331-H333 PolarHBondContact O-N 2.89Å; H333-E336 PolarHBondContact O-N 3.39Å; H333-C337 PolarHBondContact CE1-SG 3.48Å; H333-C337 WeakPolarHBondContact O-CB 3.23Å; H333-C337 PolarHBondContact O-N 3.49Å; H333-C337 PolarHBondContact O-SG 3.33Å
334M82.7Confident77.5Confident114 Ų11464.7 Ų64.756%0.56236%0.358SS*.Hα-helixtrans-63.8-44.6177.2-164.9-178.6-5000110.7A330 D331 K332 E336 C337 V338A330-M334 PolarHBondContact O-N 2.95Å; D331-M334 WeakPolarHBondContact O-CA 3.1Å; D331-M334 VanDerWaalsContact O-CB 3.23Å; D331-M334 WeakPolarHBondContact O-CB 3.41Å; D331-M334 PolarHBondContact O-N 3.24Å; K332-M334 VanDerWaalsContact C-N 3.3Å; K332-M334 PolarHBondContact O-N 3.02Å; M334-E336 PolarHBondContact O-N 3.03Å; M334-C337 PolarHBondContact O-N 2.9Å; M334-V338 WeakPolarHBondContact O-CG2 3.39Å; M334-V338 PolarHBondContact O-N 2.93Å
335E85Confident79.1Confident42 Ų4264 Ų6420%0.19636%0.355CS..Hα-helixtrans-57.3-49.1175.9-64.4-176.4157.800111.8Y249 D331 K332 C337 V338 L339Y249-E335 HydrophobicContact CD1-CB 4.47Å; Y249-E335 HydrophobicContact CD1-CG 3.72Å; Y249-E335 WeakPolarHBondContact CD1-OE1 3.42Å; Y249-E335 HydrophobicContact CD2-CB 3.49Å; Y249-E335 VanDerWaalsContact CD2-CB 3.49Å; Y249-E335 HydrophobicContact CD2-CG 3.68Å; Y249-E335 HydrophobicContact CE1-CG 3.84Å; Y249-E335 VanDerWaalsContact CE2-CA 3.47Å; Y249-E335 HydrophobicContact CE2-CB 3.62Å; Y249-E335 HydrophobicContact CE2-CG 3.8Å; Y249-E335 HydrophobicContact CG-CB 3.95Å; Y249-E335 HydrophobicContact CG-CG 3.63Å; D331-E335 PolarHBondContact O-N 3.39Å; K332-E335 PolarHBondContact O-N 3.17Å; E335-C337 PolarHBondContact O-N 2.93Å; E335-V338 PolarHBondContact O-N 2.96Å; E335-L339 WeakPolarHBondContact O-CG 3.45Å; E335-L339 PolarHBondContact O-N 2.91Å
336E82.4Confident80.6Confident60 Ų6058.9 Ų58.928%0.2833%0.328SS..Hα-helixtrans-60.9-42.3178.4-72.3167.717400111.8V304 K332 H333 M334 V338 L339 A340V304-E336 WeakPolarHBondContact CG1-OE2 3.35Å; V304-E336 WeakPolarHBondContact CG2-OE2 3.18Å; K332-E336 WeakPolarHBondContact CE-OE1 3.1Å; K332-E336 WeakPolarHBondContact O-CG 3.31Å; K332-E336 PolarHBondContact O-N 3.41Å; H333-E336 PolarHBondContact O-N 3.39Å; M334-E336 PolarHBondContact O-N 3.03Å; E336-V338 PolarHBondContact O-N 3.21Å; E336-L339 PolarHBondContact O-N 3.24Å; E336-A340 VanDerWaalsContact O-CB 3.25Å; E336-A340 WeakPolarHBondContact O-CB 3.39Å; E336-A340 PolarHBondContact O-N 3.45Å
337C85.7Confident81.9Confident25 Ų2557.2 Ų57.217%0.16931%0.312CS..Hα-helixtrans-64.6-39.7176.9-68.80000112.7H333 M334 E335 S341H333-C337 PolarHBondContact CE1-SG 3.48Å; H333-C337 WeakPolarHBondContact O-CB 3.23Å; H333-C337 PolarHBondContact O-N 3.49Å; H333-C337 PolarHBondContact O-SG 3.33Å; M334-C337 PolarHBondContact O-N 2.9Å; E335-C337 PolarHBondContact O-N 2.93Å; C337-S341 WeakPolarHBondContact O-CB 3.23Å; C337-S341 PolarHBondContact O-N 2.83Å; C337-S341 PolarHBondContact O-OG 3.33Å
338V88.5Confident83Confident44 Ų4453 Ų5327%0.26730%0.297SS..Hα-helixtrans-66.4-44.6178.9170.60000110.5Y249 V253 M334 E335 E336 S341 H342Y249-V338 HydrophobicContact CE2-CB 4.32Å; Y249-V338 HydrophobicContact CE2-CG1 4.39Å; V253-V338 HydrophobicContact CG2-CG1 3.99Å; M334-V338 WeakPolarHBondContact O-CG2 3.39Å; M334-V338 PolarHBondContact O-N 2.93Å; E335-V338 PolarHBondContact O-N 2.96Å; E336-V338 PolarHBondContact O-N 3.21Å; V338-S341 PolarHBondContact O-N 3.4Å; V338-H342 PolarHBondContact O-N 3.27Å; V338-H342 VanDerWaalsContact O-N 3.11Å; V338-H342 PolarHBondContact O-ND1 2.85Å
339L89.6Confident84.1Confident23 Ų2349.2 Ų49.212%0.1227%0.274CS..Hα-helixtrans-66-41.6177.5-68.6178.3000111.9Y249 V253 E335 E336 S341 H342 A343Y249-L339 HydrophobicContact CD2-CD1 4.21Å; Y249-L339 HydrophobicContact CD2-CG 4.22Å; Y249-L339 HydrophobicContact CE2-CG 4.33Å; V253-L339 HydrophobicContact CG2-CD2 3.79Å; E335-L339 WeakPolarHBondContact O-CG 3.45Å; E335-L339 PolarHBondContact O-N 2.91Å; E336-L339 PolarHBondContact O-N 3.24Å; L339-S341 VanDerWaalsContact C-N 3.32Å; L339-S341 PolarHBondContact O-N 2.85Å; L339-H342 PolarHBondContact O-N 3.49Å; L339-A343 WeakPolarHBondContact O-CB 3.47Å; L339-A343 PolarHBondContact O-N 3.37Å
340A86.7Confident84.9Confident1 Ų144.3 Ų44.31%0.00825%0.253CS..Hα-helixtrans-63.6-37.6175.400000112.1L298 E301 E336 H342 A343 G344L298-A340 HydrophobicContact CD2-CB 4.32Å; L298-A340 VanDerWaalsContact CD2-O 3.31Å; L298-A340 WeakPolarHBondContact CD2-O 3.47Å; E301-A340 HydrophobicContact CB-CB 3.6Å; E301-A340 HydrophobicContact CG-CB 3.82Å; E301-A340 WeakPolarHBondContact OE2-CB 3.38Å; E336-A340 VanDerWaalsContact O-CB 3.25Å; E336-A340 WeakPolarHBondContact O-CB 3.39Å; E336-A340 PolarHBondContact O-N 3.45Å; A340-H342 PolarHBondContact O-N 3.43Å; A340-A343 PolarHBondContact O-N 3.41Å; A340-G344 PolarHBondContact O-N 3.49Å
341S90.3Very high85.4Confident76 Ų7646.6 Ų46.653%0.53126%0.256SS..Hα-helixtrans-61.6-44.2174-60.30000112.1C337 V338 L339 G344 L345C337-S341 WeakPolarHBondContact O-CB 3.23Å; C337-S341 PolarHBondContact O-N 2.83Å; C337-S341 PolarHBondContact O-OG 3.33Å; V338-S341 PolarHBondContact O-N 3.4Å; L339-S341 VanDerWaalsContact C-N 3.32Å; L339-S341 PolarHBondContact O-N 2.85Å; S341-G344 PolarHBondContact O-N 2.88Å; S341-L345 PolarHBondContact O-N 3.31Å
342H92.3Very high85.7Confident39 Ų3948.1 Ų48.118%0.18126%0.261CS..Hα-helixtrans-64.4-41173.8-74.579.2000111.8M256 S257 V338 L339 A340 L345 I346M256-H342 HydrophobicContact CB-CB 3.8Å; M256-H342 HydrophobicContact CE-CB 4.04Å; M256-H342 HydrophobicContact CG-CB 4.44Å; S257-H342 PolarHBondContact OG-NE2 3.11Å; V338-H342 PolarHBondContact O-N 3.27Å; V338-H342 VanDerWaalsContact O-N 3.11Å; V338-H342 PolarHBondContact O-ND1 2.85Å; L339-H342 PolarHBondContact O-N 3.49Å; A340-H342 PolarHBondContact O-N 3.43Å; H342-L345 PolarHBondContact O-N 3.17Å; H342-I346 WeakPolarHBondContact O-CG1 3.29Å; H342-I346 PolarHBondContact O-N 3.19Å
343A89.9Confident84.9Confident0 Ų043.6 Ų43.60%024%0.242CC..Hα-helixtrans-62.7-43.3178.500000111.9M256 L294 L297 L298 L339 A340 I346 L347M256-A343 HydrophobicContact CE-CB 3.96Å; L294-A343 HydrophobicContact CB-CB 4.3Å; L294-A343 HydrophobicContact CD2-CB 3.95Å; L297-A343 HydrophobicContact CB-CB 4.03Å; L297-A343 HydrophobicContact CD1-CB 4.03Å; L298-A343 HydrophobicContact CG-CB 4.47Å; L339-A343 WeakPolarHBondContact O-CB 3.47Å; L339-A343 PolarHBondContact O-N 3.37Å; A340-A343 PolarHBondContact O-N 3.41Å; A343-I346 PolarHBondContact O-N 3.48Å; A343-L347 WeakPolarHBondContact O-CB 3.46Å; A343-L347 WeakPolarHBondContact O-CG 3.35Å; A343-L347 PolarHBondContact O-N 2.88Å
344G87Confident83.7Confident29 Ų2947.7 Ų47.730%0.29926%0.261SS..Hα-helixtrans-62.1-41.7174.600000112.6A340 S341 G348A340-G344 PolarHBondContact O-N 3.49Å; S341-G344 PolarHBondContact O-N 2.88Å; G344-G348 PolarHBondContact O-N 3.29Å
345L92.4Very high81.8Confident89 Ų8949.5 Ų49.547%0.46627%0.269SS..Hα-helixtrans-63.3-48.2175.3-179.460.4000111.7V260 S341 H342 L347 G348 L349V260-L345 HydrophobicContact CG1-CD2 3.78Å; V260-L345 HydrophobicContact CG1-CG 4.49Å; V260-L345 HydrophobicContact CG2-CD2 3.86Å; V260-L345 HydrophobicContact CG2-CG 4.29Å; S341-L345 PolarHBondContact O-N 3.31Å; H342-L345 PolarHBondContact O-N 3.17Å; L345-L347 PolarHBondContact O-N 3.2Å; L345-G348 PolarHBondContact O-N 3.46Å; L345-L349 HydrophobicContact CD1-CD1 4.34Å; L345-L349 HydrophobicContact CD1-CG 4.41Å; L345-L349 HydrophobicContact CG-CD1 4.17Å; L345-L349 WeakPolarHBondContact O-CG 3.21Å; L345-L349 PolarHBondContact O-N 2.78Å
346I91.2Very high79.5Confident0 Ų052 Ų520%029%0.286CS..Hα-helixtrans-60-48.3178.2-70.7166.3000110.2M256 L259 V260 I263 L294 H342 A343 G348 L349 L350M256-I346 HydrophobicContact CB-CD1 4.31Å; M256-I346 HydrophobicContact CE-CD1 3.53Å; M256-I346 HydrophobicContact SD-CD1 3.64Å; L259-I346 HydrophobicContact CB-CD1 3.93Å; L259-I346 HydrophobicContact CD1-CD1 4.37Å; V260-I346 HydrophobicContact CG2-CD1 4.16Å; V260-I346 HydrophobicContact CG2-CG1 3.65Å; I263-I346 HydrophobicContact CD1-CB 4.22Å; I263-I346 HydrophobicContact CD1-CG1 4.22Å; I263-I346 HydrophobicContact CD1-CG2 3.71Å; L294-I346 HydrophobicContact CD1-CB 4.26Å; L294-I346 HydrophobicContact CD1-CG2 3.5Å; L294-I346 HydrophobicContact CD2-CG2 4.38Å; H342-I346 WeakPolarHBondContact O-CG1 3.29Å; H342-I346 PolarHBondContact O-N 3.19Å; A343-I346 PolarHBondContact O-N 3.48Å; I346-G348 VanDerWaalsContact C-N 3.33Å; I346-G348 PolarHBondContact O-N 2.94Å; I346-L349 PolarHBondContact O-N 3.46Å; I346-L350 HydrophobicContact CG2-CD1 4Å; I346-L350 HydrophobicContact CG2-CG 4.34Å; I346-L350 VanDerWaalsContact O-CG 3.29Å; I346-L350 WeakPolarHBondContact O-CG 3.21Å; I346-L350 PolarHBondContact O-N 3.4Å
347L88.9Confident77.3Confident17 Ų1755.9 Ų55.99%0.08931%0.308CS..Hα-helixtrans-58.3-44.4176.6-78.1168.1000112I291 L294 Q295 L298 A343 L345 L349 L350 I351I291-L347 HydrophobicContact CB-CD2 4.45Å; I291-L347 HydrophobicContact CG2-CD2 3.77Å; L294-L347 HydrophobicContact CB-CD1 3.67Å; L294-L347 HydrophobicContact CB-CD2 3.92Å; L294-L347 HydrophobicContact CB-CG 3.68Å; L294-L347 HydrophobicContact CD1-CD2 3.82Å; L294-L347 HydrophobicContact CD1-CG 3.81Å; L294-L347 HydrophobicContact CG-CG 4.39Å; Q295-L347 HydrophobicContact CG-CD1 4.32Å; L298-L347 HydrophobicContact CD1-CD1 3.4Å; L298-L347 VanDerWaalsContact CD1-CD1 3.4Å; L298-L347 HydrophobicContact CG-CD1 4.36Å; A343-L347 WeakPolarHBondContact O-CB 3.46Å; A343-L347 WeakPolarHBondContact O-CG 3.35Å; A343-L347 PolarHBondContact O-N 2.88Å; L345-L347 PolarHBondContact O-N 3.2Å; L347-L349 VanDerWaalsContact C-N 3.33Å; L347-L349 PolarHBondContact O-N 2.93Å; L347-L350 PolarHBondContact O-N 2.98Å; L347-I351 VanDerWaalsContact O-CG1 3.29Å; L347-I351 WeakPolarHBondContact O-CG1 3.39Å; L347-I351 PolarHBondContact O-N 2.87Å
348G86.2Confident74.6Confident31 Ų3163.6 Ų63.632%0.3234%0.338SS..Hα-helixtrans-57.9-45.217600000112.4G344 L345 I346 L350 I351 Q352G344-G348 PolarHBondContact O-N 3.29Å; L345-G348 PolarHBondContact O-N 3.46Å; I346-G348 VanDerWaalsContact C-N 3.33Å; I346-G348 PolarHBondContact O-N 2.94Å; G348-L350 PolarHBondContact O-N 3.04Å; G348-I351 PolarHBondContact O-N 3.16Å; G348-Q352 WeakPolarHBondContact O-CG 3.41Å; G348-Q352 PolarHBondContact O-N 3.03Å; G348-Q352 VanDerWaalsContact O-N 3.13Å
349L90.1Very high71.8Confident14 Ų1470 Ų707%0.07338%0.378CS..Hα-helixtrans-64.7-37.2176.8-68.2169.4000112.4V260 I263 E264 R270 L345 I346 L347V260-L349 HydrophobicContact CG1-CD1 4.32Å; I263-L349 HydrophobicContact CD1-CB 4.06Å; I263-L349 HydrophobicContact CD1-CD1 4.23Å; I263-L349 HydrophobicContact CG1-CB 4.15Å; I263-L349 HydrophobicContact CG1-CD1 3.92Å; E264-L349 HydrophobicContact CB-CD1 4.34Å; E264-L349 HydrophobicContact CG-CD2 4.31Å; R270-L349 WeakPolarHBondContact CD-O 3.28Å; L345-L349 HydrophobicContact CD1-CD1 4.34Å; L345-L349 HydrophobicContact CD1-CG 4.41Å; L345-L349 HydrophobicContact CG-CD1 4.17Å; L345-L349 WeakPolarHBondContact O-CG 3.21Å; L345-L349 PolarHBondContact O-N 2.78Å; I346-L349 PolarHBondContact O-N 3.46Å; L347-L349 VanDerWaalsContact C-N 3.33Å; L347-L349 PolarHBondContact O-N 2.93Å
350L86.6Confident70.9Confident7 Ų772.4 Ų72.44%0.03739%0.391CS..Hα-helixtrans-69.8-34.5178.1-65.1175.8000112.6I263 R270 V273 I291 L294 I346 L347 G348I263-L350 HydrophobicContact CD1-CD2 4.09Å; I263-L350 HydrophobicContact CD1-CG 4.3Å; R270-L350 HydrophobicContact CB-CD2 3.98Å; R270-L350 HydrophobicContact CG-CD2 4.06Å; V273-L350 HydrophobicContact CB-CD2 4.11Å; V273-L350 HydrophobicContact CG1-CD1 3.99Å; V273-L350 HydrophobicContact CG1-CD2 4.15Å; I291-L350 HydrophobicContact CD1-CD1 4.49Å; I291-L350 HydrophobicContact CG1-CD1 4.1Å; L294-L350 HydrophobicContact CD1-CD1 4.24Å; I346-L350 HydrophobicContact CG2-CD1 4Å; I346-L350 HydrophobicContact CG2-CG 4.34Å; I346-L350 VanDerWaalsContact O-CG 3.29Å; I346-L350 WeakPolarHBondContact O-CG 3.21Å; I346-L350 PolarHBondContact O-N 3.4Å; L347-L350 PolarHBondContact O-N 2.98Å; G348-L350 PolarHBondContact O-N 3.04Å
351I81Confident70Confident102 Ų10276.1 Ų76.152%0.52341%0.411SS..Hα-helixtrans-77.4-35.9-178.7-66.1164.7000112L347 G348 D353 E354L347-I351 VanDerWaalsContact O-CG1 3.29Å; L347-I351 WeakPolarHBondContact O-CG1 3.39Å; L347-I351 PolarHBondContact O-N 2.87Å; G348-I351 PolarHBondContact O-N 3.16Å; I351-D353 PolarHBondContact O-N 3.32Å; I351-E354 PolarHBondContact O-N 3.28Å
352Q72.5Confident68.9Low124 Ų12476.1 Ų76.158%0.57940%0.404SS*.THydrogen-bonded Turntrans-53.6-24.5-178-84.1176.7-9.500114.3G348G348-Q352 WeakPolarHBondContact O-CG 3.41Å; G348-Q352 PolarHBondContact O-N 3.03Å; G348-Q352 VanDerWaalsContact O-N 3.13Å
353D58.1Low67.5Low29 Ų2978.3 Ų78.316%0.15542%0.418CS..THydrogen-bonded Turntrans-89-23.5-179.6-959000114.8H267 R270 I351 E355 V356H267-D353 IonicContact CE1-OD1 3.6Å; H267-D353 PolarHBondContact CE1-OD1 3.03Å; H267-D353 IonicContact CE1-OD2 3.83Å; H267-D353 IonicContact CG-OD2 3.8Å; H267-D353 IonicContact ND1-OD1 3.37Å; H267-D353 PolarHBondContact ND1-OD1 2.88Å; H267-D353 VanDerWaalsContact ND1-OD1 3.09Å; H267-D353 IonicContact ND1-OD2 2.64Å; H267-D353 PolarHBondContact ND1-OD2 2.97Å; R270-D353 WeakPolarHBondContact CD-OD2 3.5Å; R270-D353 IonicContact CZ-OD1 3.27Å; R270-D353 IonicContact CZ-OD2 3.08Å; R270-D353 IonicContact NE-OD1 3.58Å; R270-D353 PolarHBondContact NE-OD1 3.1Å; R270-D353 IonicContact NE-OD2 2.64Å; R270-D353 PolarHBondContact NE-OD2 3.18Å; R270-D353 IonicContact NH2-OD1 2.65Å; R270-D353 PolarHBondContact NH2-OD1 3.28Å; R270-D353 IonicContact NH2-OD2 3.95Å; R270-D353 PolarHBondContact NH2-OD2 3.24Å; I351-D353 PolarHBondContact O-N 3.32Å; D353-E355 PolarHBondContact O-N 3.11Å; D353-V356 PolarHBondContact O-N 3.08Å
354E51.3Low66.1Low136 Ų13683.2 Ų83.264%0.63644%0.444SS*.G310 helixtrans-69.4-25.2179.7-73.9-164.116500111.8I351 V356I351-E354 PolarHBondContact O-N 3.28Å; E354-V356 VanDerWaalsContact C-N 3.34Å; E354-V356 PolarHBondContact O-N 3.46Å
355E41.6Very low64.7Low152 Ų15286.8 Ų86.871%0.7145%0.453SS*.G310 helixtrans-74.5-19177.2-70-168.315700113.7D353 I357 F358D353-E355 PolarHBondContact O-N 3.11Å; E355-I357 PolarHBondContact O-N 3.36Å; E355-F358 PolarHBondContact O-N 2.95Å
356V38.1Very low62.8Low94 Ų9486.6 Ų86.657%0.5745%0.452SS*.G310 helixtrans-77.6-6.2-179.1-173.80000112.5D353 E354D353-V356 PolarHBondContact O-N 3.08Å; E354-V356 VanDerWaalsContact C-N 3.34Å; E354-V356 PolarHBondContact O-N 3.46Å
357I35.5Very low60.6Low142 Ų14293.3 Ų93.373%0.72849%0.487SS*.G310 helixtrans-93.6-3.8177.2-58177.8000112.1E355E355-I357 PolarHBondContact O-N 3.36Å
358F28.4Very low58.2Low186 Ų18699.7 Ų99.782%0.81652%0.52SS*.  trans-109.918179.6-71.7-73.8000115.4E355E355-F358 PolarHBondContact O-N 2.95Å
359T29.2Very low55.7Low179 Ų179105.9 Ų105.9100%1.09854%0.539SS*.  trans-118.20164.755.50000110.1

Retrieved 359 of 359 residues in 75.5 ms (Link to these results)

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