A0A061ACE6_CAEEL Loading...

Progestin and AdipoQ Receptor family

AlphaFold DB , UniProt , Accession A0A061ACE6, Species CAEEL (Caenorhabditis elegans), Gene paqr-3, Length 282 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
1M75.9Confident91.6Very high108 Ų10883.1 Ų83.153%0.53241%0.407SS..  0141.60-164.6165.4-156.800108.3M5 C77 T78M1-M5 HydrophobicContact CE-CB 3.94Å; M1-M5 HydrophobicContact CE-CE 4.35Å; M1-M5 HydrophobicContact CG-CB 3.54Å; M1-M5 HydrophobicContact CG-CE 4.25Å; M1-M5 HydrophobicContact CG-SD 4.38Å; M1-M5 HydrophobicContact SD-CB 4.45Å; M1-C77 HydrophobicContact SD-CB 4.12Å; M1-T78 VanDerWaalsContact O-CG2 3.27Å; M1-T78 WeakPolarHBondContact O-CG2 3.34Å
2T90.6Very high91.8Very high81 Ų8186.7 Ų86.750%0.49742%0.422SS..  trans-75.5155.9176.4680000110.6K4 M5 C6T2-K4 PolarHBondContact O-N 3.1Å; T2-M5 HydrophobicContact CG2-SD 4.31Å; T2-M5 WeakPolarHBondContact O-CB 3.48Å; T2-M5 PolarHBondContact O-N 2.96Å; T2-M5 VanDerWaalsContact OG1-CG 3.28Å; T2-M5 WeakPolarHBondContact OG1-CG 3.33Å; T2-M5 PolarHBondContact OG1-N 3.32Å; T2-C6 PolarHBondContact O-N 3.35Å
3K89.8Confident92.2Very high133 Ų13391.2 Ų91.258%0.57845%0.447SS*.Hα-helixtrans-54.9-37.5176.5-65.9-179.4-177.1175.60112.5C6 A7 T78K3-C6 PolarHBondContact O-N 3.47Å; K3-A7 PolarHBondContact O-N 3.28Å; K3-T78 HydrophobicContact CG-CG2 4.4Å
4K92.9Very high92.4Very high153 Ų15387.4 Ų87.467%0.66543%0.43SS*.Hα-helixtrans-64.1-39176.1-173.3177.1-177.3176.40112.1T2 K8T2-K4 PolarHBondContact O-N 3.1Å; K4-K8 WeakPolarHBondContact O-CG 3.14Å; K4-K8 PolarHBondContact O-N 3.2Å; K4-K8 VanDerWaalsContact O-N 3.09Å
5M93.3Very high92.6Very high96 Ų9688 Ų8847%0.47344%0.435SS..Hα-helixtrans-69.9-41.3175.9-70169.774.700111.9M1 T2 K8 S9M1-M5 HydrophobicContact CE-CB 3.94Å; M1-M5 HydrophobicContact CE-CE 4.35Å; M1-M5 HydrophobicContact CG-CB 3.54Å; M1-M5 HydrophobicContact CG-CE 4.25Å; M1-M5 HydrophobicContact CG-SD 4.38Å; M1-M5 HydrophobicContact SD-CB 4.45Å; T2-M5 HydrophobicContact CG2-SD 4.31Å; T2-M5 WeakPolarHBondContact O-CB 3.48Å; T2-M5 PolarHBondContact O-N 2.96Å; T2-M5 VanDerWaalsContact OG1-CG 3.28Å; T2-M5 WeakPolarHBondContact OG1-CG 3.33Å; T2-M5 PolarHBondContact OG1-N 3.32Å; M5-K8 WeakPolarHBondContact O-CB 3.31Å; M5-K8 PolarHBondContact O-N 2.96Å; M5-S9 PolarHBondContact O-N 3.24Å
6C93.1Very high92.9Very high0 Ų085.8 Ų85.80%042%0.424CS..Hα-helixtrans-62.8-40.4174.1-78.40000111.6T2 K3 K8 S9 T74 F75 C77T2-C6 PolarHBondContact O-N 3.35Å; K3-C6 PolarHBondContact O-N 3.47Å; C6-K8 VanDerWaalsContact C-N 3.32Å; C6-K8 PolarHBondContact O-N 3.22Å; C6-S9 PolarHBondContact O-N 3.45Å; C6-S9 PolarHBondContact O-OG 2.82Å; C6-T74 VanDerWaalsContact CB-O 3.31Å; C6-T74 WeakPolarHBondContact CB-O 3.35Å; C6-T74 WeakPolarHBondContact O-CG2 3.22Å; C6-F75 HydrophobicContact CB-CD1 4.21Å; C6-C77 WeakPolarHBondContact CB-SG 3.22Å; C6-C77 WeakPolarHBondContact SG-CB 3.45Å; C6-C77 CovalentContact SG-SG 2.07Å; C6-C77 PolarHBondContact SG-SG 2.96Å
7A93.6Very high93.2Very high39 Ų3982.4 Ų82.432%0.32241%0.409SS..Hα-helixtrans-62.8-38.8172.900000112.5K3 S9 A10 F75K3-A7 PolarHBondContact O-N 3.28Å; A7-S9 VanDerWaalsContact C-N 3.34Å; A7-A10 WeakPolarHBondContact O-CB 3.41Å; A7-A10 PolarHBondContact O-N 3.07Å; A7-F75 HydrophobicContact CB-CE1 4.16Å
8K94.3Very high93.4Very high123 Ų12380.6 Ų80.654%0.53540%0.4SS..Hα-helixtrans-66.7-34.8174.7-75.6-177.4174.6-164.90112.3K4 M5 C6 A10 F11 H12K4-K8 WeakPolarHBondContact O-CG 3.14Å; K4-K8 PolarHBondContact O-N 3.2Å; K4-K8 VanDerWaalsContact O-N 3.09Å; M5-K8 WeakPolarHBondContact O-CB 3.31Å; M5-K8 PolarHBondContact O-N 2.96Å; C6-K8 VanDerWaalsContact C-N 3.32Å; C6-K8 PolarHBondContact O-N 3.22Å; K8-A10 PolarHBondContact O-N 3.13Å; K8-F11 PolarHBondContact O-N 3.33Å; K8-H12 PolarHBondContact O-CD2 2.87Å; K8-H12 VanDerWaalsContact O-CD2 3.32Å
9S93.8Very high93.7Very high19 Ų1976.6 Ų76.613%0.13338%0.38CS..Hα-helixtrans-64.8-20-178.666.40000113.4M5 C6 A7 F11 H12 N14M5-S9 PolarHBondContact O-N 3.24Å; C6-S9 PolarHBondContact O-N 3.45Å; C6-S9 PolarHBondContact O-OG 2.82Å; A7-S9 VanDerWaalsContact C-N 3.34Å; S9-F11 PolarHBondContact O-N 3.11Å; S9-H12 PolarHBondContact O-N 3.12Å; S9-H12 VanDerWaalsContact O-O 3.06Å; S9-N14 PolarHBondContact O-ND2 3.13Å
10A94.3Very high93.9Very high9 Ų972.9 Ų72.97%0.07436%0.362CS..THydrogen-bonded Turntrans-57.8-25.7169.500000112.8A7 K8 I20 W21 T74A7-A10 WeakPolarHBondContact O-CB 3.41Å; A7-A10 PolarHBondContact O-N 3.07Å; K8-A10 PolarHBondContact O-N 3.13Å; A10-I20 HydrophobicContact CB-CD1 4.36Å; A10-I20 HydrophobicContact CB-CG2 4.09Å; A10-W21 PolarHBondContact O-NE1 2.94Å; A10-T74 HydrophobicContact CB-CG2 4.48Å
11F95.8Very high94.2Very high153 Ų15373.3 Ų73.367%0.67136%0.36SS*.THydrogen-bonded Turntrans-101.49.9178.3-57.7-84.1000113.4K8 S9 W21K8-F11 PolarHBondContact O-N 3.33Å; S9-F11 PolarHBondContact O-N 3.11Å; F11-W21 HydrophobicContact CD1-CH2 4.47Å; F11-W21 AromaticContact CD1-CZ2 3.79Å; F11-W21 HydrophobicContact CD1-CZ2 3.79Å; F11-W21 AromaticContact CE1-CH2 3.85Å; F11-W21 HydrophobicContact CE1-CH2 3.85Å; F11-W21 AromaticContact CE1-CZ2 3.56Å; F11-W21 HydrophobicContact CE1-CZ2 3.56Å; F11-W21 HydrophobicContact CZ-CZ2 4.35Å
12H94.7Very high95.2Very high126 Ų12668.7 Ų68.758%0.58334%0.338SS*.SBendtrans-115148172.3-71.5-84000109.9K8 S9 N14 T17K8-H12 PolarHBondContact O-CD2 2.87Å; K8-H12 VanDerWaalsContact O-CD2 3.32Å; S9-H12 PolarHBondContact O-N 3.12Å; S9-H12 VanDerWaalsContact O-O 3.06Å; H12-N14 PolarHBondContact O-N 2.9Å; H12-N14 PolarHBondContact O-ND2 3.47Å; H12-T17 PolarHBondContact O-OG1 3.45Å
13I96.8Very high95.6Very high146 Ų14665 Ų6575%0.74932%0.315SS*.  trans-71.5122176.4-60.3175.2000109T17 V219I13-T17 WeakPolarHBondContact CA-OG1 3.47Å; I13-V219 HydrophobicContact CG2-CG1 3.61Å
14N95.3Very high96Very high38 Ų3861.1 Ų61.120%0.20330%0.3CS..SBendtrans-155.3177.7175.26070000109.4S9 H12 E16 T17S9-N14 PolarHBondContact O-ND2 3.13Å; H12-N14 PolarHBondContact O-N 2.9Å; H12-N14 PolarHBondContact O-ND2 3.47Å; N14-E16 PolarHBondContact O-N 3.22Å; N14-E16 WeakPolarHBondContact OD1-CA 3.39Å; N14-E16 WeakPolarHBondContact OD1-CB 3.46Å; N14-E16 PolarHBondContact OD1-N 2.96Å; N14-T17 PolarHBondContact N-OG1 3.26Å; N14-T17 WeakPolarHBondContact O-CB 3.43Å; N14-T17 PolarHBondContact O-N 3.33Å; N14-T17 VanDerWaalsContact O-N 3.17Å; N14-T17 PolarHBondContact O-OG1 3.13Å; N14-T17 VanDerWaalsContact O-OG1 3.05Å; N14-T17 PolarHBondContact OD1-N 3.47Å
15N95.6Very high96.3Very high96 Ų9658.6 Ų58.651%0.51329%0.293SS..THydrogen-bonded Turntrans-64.6-16.1-178.662.4-24.5000114.8D218N15-D218 VanDerWaalsContact CA-O 3.25Å; N15-D218 WeakPolarHBondContact CA-O 3.48Å; N15-D218 WeakPolarHBondContact CB-O 3.33Å
16E97Very high96.6Very high53 Ų5354 Ų5425%0.24827%0.271CS..THydrogen-bonded Turntrans-99.6-6.7177.4-61.4-66.9177.200113.2N14 I18 N19 I20 H73N14-E16 PolarHBondContact O-N 3.22Å; N14-E16 WeakPolarHBondContact OD1-CA 3.39Å; N14-E16 WeakPolarHBondContact OD1-CB 3.46Å; N14-E16 PolarHBondContact OD1-N 2.96Å; E16-I18 PolarHBondContact O-N 3.25Å; E16-N19 WeakPolarHBondContact O-CB 3.37Å; E16-N19 PolarHBondContact O-N 3.01Å; E16-N19 VanDerWaalsContact O-N 3.09Å; E16-N19 PolarHBondContact OE2-ND2 3.42Å; E16-I20 HydrophobicContact CB-CD1 4.1Å; E16-I20 HydrophobicContact CB-CG1 4.4Å; E16-I20 VanDerWaalsContact O-CG1 3.32Å; E16-I20 WeakPolarHBondContact O-CG1 3.13Å; E16-I20 PolarHBondContact O-N 2.76Å; E16-H73 IonicContact OE1-ND1 2.74Å; E16-H73 IonicContact OE2-CE1 3.78Å; E16-H73 PolarHBondContact OE2-CE1 3.09Å; E16-H73 IonicContact OE2-CG 3.98Å; E16-H73 IonicContact OE2-ND1 3.57Å; E16-H73 PolarHBondContact OE2-ND1 3.29Å
17T97.5Very high96.8Very high28 Ų2856.7 Ų56.717%0.17228%0.283CS..Hα-helixtrans-54-49.3-173.5-59.70000112.4H12 I13 N14 I20 W21H12-T17 PolarHBondContact O-OG1 3.45Å; I13-T17 WeakPolarHBondContact CA-OG1 3.47Å; N14-T17 PolarHBondContact N-OG1 3.26Å; N14-T17 WeakPolarHBondContact O-CB 3.43Å; N14-T17 PolarHBondContact O-N 3.33Å; N14-T17 VanDerWaalsContact O-N 3.17Å; N14-T17 PolarHBondContact O-OG1 3.13Å; N14-T17 VanDerWaalsContact O-OG1 3.05Å; N14-T17 PolarHBondContact OD1-N 3.47Å; T17-I20 PolarHBondContact O-N 3.1Å; T17-W21 VanDerWaalsContact O-CD1 3.28Å; T17-W21 PolarHBondContact O-N 2.69Å
18I97.9Very high97.1Very high50 Ų5059.4 Ų59.426%0.25629%0.291SS..Hα-helixtrans-71.6-35.3-179.4-67168.8000111.4E16 I20 W21 S22 V220 Q225E16-I18 PolarHBondContact O-N 3.25Å; I18-I20 VanDerWaalsContact C-N 3.31Å; I18-I20 PolarHBondContact O-N 2.77Å; I18-W21 PolarHBondContact O-N 2.9Å; I18-S22 WeakPolarHBondContact O-CB 3.49Å; I18-S22 PolarHBondContact O-N 3.31Å; I18-S22 PolarHBondContact O-OG 2.89Å; I18-V220 HydrophobicContact CD1-CB 4.09Å; I18-V220 HydrophobicContact CD1-CG1 3.84Å; I18-V220 HydrophobicContact CD1-CG2 3.86Å; I18-Q225 HydrophobicContact CB-CG 3.79Å; I18-Q225 VanDerWaalsContact CD1-OE1 3.22Å; I18-Q225 HydrophobicContact CG2-CB 3.85Å; I18-Q225 HydrophobicContact CG2-CG 3.64Å
19N98.1Very high97.3Very high4 Ų456.1 Ų56.12%0.02128%0.276CS..Hα-helixtrans-62.7-39.7175.4-59.2-31.1000111.1E16 S22 H73 Q225 H228E16-N19 WeakPolarHBondContact O-CB 3.37Å; E16-N19 PolarHBondContact O-N 3.01Å; E16-N19 VanDerWaalsContact O-N 3.09Å; E16-N19 PolarHBondContact OE2-ND2 3.42Å; N19-S22 PolarHBondContact O-OG 3.36Å; N19-H73 HydrophobicContact CB-CB 4.23Å; N19-Q225 WeakPolarHBondContact OD1-CG 3.16Å; N19-H228 PolarHBondContact O-CE1 3.3Å; N19-H228 VanDerWaalsContact O-CE1 3.29Å; N19-H228 PolarHBondContact O-ND1 3.42Å
20I98.5Very high97.5Very high3 Ų355.2 Ų55.22%0.01527%0.269CS..Hα-helixtrans-67.6-54.2176.3-64.8165.8000110.3A10 E16 T17 I18 L24 H73A10-I20 HydrophobicContact CB-CD1 4.36Å; A10-I20 HydrophobicContact CB-CG2 4.09Å; E16-I20 HydrophobicContact CB-CD1 4.1Å; E16-I20 HydrophobicContact CB-CG1 4.4Å; E16-I20 VanDerWaalsContact O-CG1 3.32Å; E16-I20 WeakPolarHBondContact O-CG1 3.13Å; E16-I20 PolarHBondContact O-N 2.76Å; T17-I20 PolarHBondContact O-N 3.1Å; I18-I20 VanDerWaalsContact C-N 3.31Å; I18-I20 PolarHBondContact O-N 2.77Å; I20-L24 VanDerWaalsContact O-CB 3.24Å; I20-L24 WeakPolarHBondContact O-CB 3.21Å; I20-L24 PolarHBondContact O-N 3.19Å; I20-H73 HydrophobicContact CG1-CB 3.68Å
21W98.5Very high97.7Very high82 Ų8257.5 Ų57.531%0.31128%0.283SS..Hα-helixtrans-74.6-34.5-170.3-81.1100.8000114A10 F11 T17 I18 H23 L24 L25A10-W21 PolarHBondContact O-NE1 2.94Å; F11-W21 HydrophobicContact CD1-CH2 4.47Å; F11-W21 AromaticContact CD1-CZ2 3.79Å; F11-W21 HydrophobicContact CD1-CZ2 3.79Å; F11-W21 AromaticContact CE1-CH2 3.85Å; F11-W21 HydrophobicContact CE1-CH2 3.85Å; F11-W21 AromaticContact CE1-CZ2 3.56Å; F11-W21 HydrophobicContact CE1-CZ2 3.56Å; F11-W21 HydrophobicContact CZ-CZ2 4.35Å; T17-W21 VanDerWaalsContact O-CD1 3.28Å; T17-W21 PolarHBondContact O-N 2.69Å; I18-W21 PolarHBondContact O-N 2.9Å; W21-H23 PolarHBondContact O-N 3.49Å; W21-L24 HydrophobicContact CE3-CD2 4.14Å; W21-L24 HydrophobicContact CH2-CD2 4.36Å; W21-L24 HydrophobicContact CZ3-CD2 3.99Å; W21-L24 PolarHBondContact O-N 3.06Å; W21-L25 HydrophobicContact CE3-CD2 4.47Å; W21-L25 HydrophobicContact CE3-CG 4.3Å; W21-L25 VanDerWaalsContact O-CB 3.27Å; W21-L25 WeakPolarHBondContact O-CB 2.96Å; W21-L25 WeakPolarHBondContact O-CG 3.39Å; W21-L25 PolarHBondContact O-N 3.26Å
22S98.6Very high97.9Very high11 Ų1156.3 Ų56.38%0.07727%0.274CS..Hα-helixtrans-57.6-50.4176.554.80000111.2I18 N19 G26 H228 L232I18-S22 WeakPolarHBondContact O-CB 3.49Å; I18-S22 PolarHBondContact O-N 3.31Å; I18-S22 PolarHBondContact O-OG 2.89Å; N19-S22 PolarHBondContact O-OG 3.36Å; S22-G26 PolarHBondContact O-N 2.99Å; S22-H228 WeakPolarHBondContact OG-CB 3.44Å; S22-H228 PolarHBondContact OG-ND1 3.45Å; S22-L232 WeakPolarHBondContact O-CD2 3.4Å
23H98.6Very high98.1Very high4 Ų451.2 Ų51.22%0.01925%0.251CS..Hα-helixtrans-77.5-30177.8-76.5-173.2000113.7W21 G26 F27 M66 S69 A70 H228W21-H23 PolarHBondContact O-N 3.49Å; H23-G26 PolarHBondContact O-N 3.43Å; H23-F27 PolarHBondContact O-N 3.26Å; H23-M66 HydrophobicContact CB-SD 4.02Å; H23-M66 PolarHBondContact CD2-SD 3Å; H23-M66 WeakPolarHBondContact O-CB 3.23Å; H23-S69 WeakPolarHBondContact ND1-CB 3.17Å; H23-S69 PolarHBondContact ND1-OG 3.33Å; H23-A70 HydrophobicContact CB-CB 4.27Å; H23-H228 AromaticContact CD2-CG 3.88Å; H23-H228 AromaticContact CD2-ND1 3.35Å; H23-H228 PolarHBondContact CD2-ND1 3.46Å; H23-H228 AromaticContact CE1-CE1 3.48Å; H23-H228 PolarHBondContact CE1-CE1 3.03Å; H23-H228 VanDerWaalsContact CE1-CE1 3.48Å; H23-H228 AromaticContact CE1-CG 3.55Å; H23-H228 AromaticContact CE1-ND1 3.2Å; H23-H228 PolarHBondContact CE1-ND1 3.38Å; H23-H228 AromaticContact CE1-NE2 3.99Å; H23-H228 AromaticContact CG-CE1 3.8Å; H23-H228 AromaticContact CG-ND1 3.28Å; H23-H228 VanDerWaalsContact CG-ND1 3.28Å; H23-H228 AromaticContact ND1-CE1 3.29Å; H23-H228 PolarHBondContact ND1-CE1 2.82Å; H23-H228 VanDerWaalsContact ND1-CE1 3.29Å; H23-H228 AromaticContact ND1-CG 4Å; H23-H228 AromaticContact ND1-ND1 3.17Å; H23-H228 PolarHBondContact ND1-ND1 3.16Å; H23-H228 VanDerWaalsContact ND1-ND1 3.17Å; H23-H228 WeakPolarHBondContact NE2-CA 3.43Å; H23-H228 AromaticContact NE2-CG 3.48Å; H23-H228 AromaticContact NE2-ND1 3.34Å; H23-H228 PolarHBondContact NE2-ND1 3.32Å; H23-H228 PolarHBondContact NE2-O 2.81Å
24L98.5Very high98.1Very high50 Ų5046 Ų4626%0.26222%0.223SC..Hα-helixtrans-65.5-41.7173-174.361.8000112I20 W21 G26 F27 I28 A70I20-L24 VanDerWaalsContact O-CB 3.24Å; I20-L24 WeakPolarHBondContact O-CB 3.21Å; I20-L24 PolarHBondContact O-N 3.19Å; W21-L24 HydrophobicContact CE3-CD2 4.14Å; W21-L24 HydrophobicContact CH2-CD2 4.36Å; W21-L24 HydrophobicContact CZ3-CD2 3.99Å; W21-L24 PolarHBondContact O-N 3.06Å; L24-G26 VanDerWaalsContact C-N 3.33Å; L24-F27 WeakPolarHBondContact O-CB 3.41Å; L24-F27 PolarHBondContact O-N 3.28Å; L24-I28 WeakPolarHBondContact O-CG1 3.25Å; L24-I28 PolarHBondContact O-N 3.24Å; L24-I28 VanDerWaalsContact O-N 3.1Å; L24-A70 HydrophobicContact CB-CB 4.28Å
25L98.6Very high98.3Very high100 Ų10050.4 Ų50.452%0.52424%0.238SC..Hα-helixtrans-65.2-38.7172-69.4173.1000111.2W21 F27 I28 Y29W21-L25 HydrophobicContact CE3-CD2 4.47Å; W21-L25 HydrophobicContact CE3-CG 4.3Å; W21-L25 VanDerWaalsContact O-CB 3.27Å; W21-L25 WeakPolarHBondContact O-CB 2.96Å; W21-L25 WeakPolarHBondContact O-CG 3.39Å; W21-L25 PolarHBondContact O-N 3.26Å; L25-F27 VanDerWaalsContact C-N 3.34Å; L25-F27 PolarHBondContact O-N 3.02Å; L25-I28 HydrophobicContact CD2-CD1 4.49Å; L25-I28 PolarHBondContact O-N 3.07Å; L25-Y29 WeakPolarHBondContact O-CB 3.44Å; L25-Y29 PolarHBondContact O-N 3.08Å
26G98.8Very high98.4Very high1 Ų147.1 Ų47.11%0.0122%0.221CC..Hα-helixtrans-57-44.5171.300000112.8S22 H23 L24 I28 Y29 F30S22-G26 PolarHBondContact O-N 2.99Å; H23-G26 PolarHBondContact O-N 3.43Å; L24-G26 VanDerWaalsContact C-N 3.33Å; G26-I28 PolarHBondContact O-N 3.45Å; G26-Y29 WeakPolarHBondContact O-CB 3.07Å; G26-Y29 PolarHBondContact O-N 2.93Å; G26-F30 WeakPolarHBondContact O-CD2 3.37Å; G26-F30 PolarHBondContact O-N 2.74Å
27F98.8Very high98.4Very high56 Ų5644.6 Ų44.625%0.24621%0.209CC..Hα-helixtrans-60.8-43.9175.4172.4-103.1000112.2H23 L24 L25 Y29 F30 T31 Q63 M66 L67H23-F27 PolarHBondContact O-N 3.26Å; L24-F27 WeakPolarHBondContact O-CB 3.41Å; L24-F27 PolarHBondContact O-N 3.28Å; L25-F27 VanDerWaalsContact C-N 3.34Å; L25-F27 PolarHBondContact O-N 3.02Å; F27-Y29 VanDerWaalsContact C-N 3.35Å; F27-F30 PolarHBondContact O-N 3.18Å; F27-T31 WeakPolarHBondContact O-CB 3.4Å; F27-T31 PolarHBondContact O-N 3.34Å; F27-T31 PolarHBondContact O-OG1 3.19Å; F27-Q63 HydrophobicContact CD2-CB 3.96Å; F27-Q63 HydrophobicContact CD2-CG 4.4Å; F27-Q63 WeakPolarHBondContact CD2-O 3.46Å; F27-Q63 HydrophobicContact CE2-CB 4Å; F27-Q63 HydrophobicContact CE2-CG 4.45Å; F27-M66 HydrophobicContact CB-CB 3.85Å; F27-L67 HydrophobicContact CD1-CD1 4.5Å; F27-L67 HydrophobicContact CD2-CB 3.77Å; F27-L67 HydrophobicContact CE2-CB 4.09Å; F27-L67 HydrophobicContact CE2-CD2 4.06Å; F27-L67 HydrophobicContact CE2-CG 4.5Å; F27-L67 HydrophobicContact CG-CB 4.25Å; F27-L67 HydrophobicContact CZ-CD2 4.29Å
28I98.8Very high98.4Very high96 Ų9644 Ų4449%0.49221%0.205SC..Hα-helixtrans-62-45.2175.7-66166.9000110.2L24 L25 G26 T31 Y32L24-I28 WeakPolarHBondContact O-CG1 3.25Å; L24-I28 PolarHBondContact O-N 3.24Å; L24-I28 VanDerWaalsContact O-N 3.1Å; L25-I28 HydrophobicContact CD2-CD1 4.49Å; L25-I28 PolarHBondContact O-N 3.07Å; G26-I28 PolarHBondContact O-N 3.45Å; I28-T31 WeakPolarHBondContact O-CB 3.27Å; I28-T31 PolarHBondContact O-N 2.83Å; I28-Y32 PolarHBondContact O-N 2.79Å
29Y98.8Very high98.4Very high53 Ų5349.5 Ų49.521%0.20822%0.223CC..Hα-helixtrans-58-51.5176.6172.5-89.9000111.7L25 G26 F27 T31 Y32 Q33 I236 Q240L25-Y29 WeakPolarHBondContact O-CB 3.44Å; L25-Y29 PolarHBondContact O-N 3.08Å; G26-Y29 WeakPolarHBondContact O-CB 3.07Å; G26-Y29 PolarHBondContact O-N 2.93Å; F27-Y29 VanDerWaalsContact C-N 3.35Å; Y29-T31 VanDerWaalsContact C-N 3.26Å; Y29-T31 PolarHBondContact O-N 3.46Å; Y29-Y32 CarbonylContact O-C 3.5Å; Y29-Y32 WeakPolarHBondContact O-CB 3.35Å; Y29-Y32 PolarHBondContact O-N 3.05Å; Y29-Y32 VanDerWaalsContact O-N 3.13Å; Y29-Q33 HydrophobicContact CD1-CG 3.96Å; Y29-Q33 HydrophobicContact CE1-CG 3.38Å; Y29-Q33 HydrophobicContact CE2-CG 4.05Å; Y29-Q33 HydrophobicContact CG-CG 4.48Å; Y29-Q33 VanDerWaalsContact CZ-CG 3.45Å; Y29-Q33 VanDerWaalsContact CZ-NE2 3.29Å; Y29-Q33 WeakPolarHBondContact O-CG 3.31Å; Y29-Q33 PolarHBondContact O-N 3.17Å; Y29-Q33 PolarHBondContact OH-NE2 3.33Å; Y29-I236 HydrophobicContact CD1-CD1 4.15Å; Y29-I236 HydrophobicContact CD1-CG1 3.85Å; Y29-I236 HydrophobicContact CE1-CB 4.26Å; Y29-I236 HydrophobicContact CE1-CD1 4.16Å; Y29-I236 HydrophobicContact CE1-CG1 3.56Å; Y29-I236 HydrophobicContact CE1-CG2 4.14Å; Y29-I236 HydrophobicContact CG-CD1 4.47Å; Y29-Q240 PolarHBondContact OH-NE2 3.01Å
30F98.8Very high98.3Very high0 Ų053.2 Ų53.20%024%0.242CC..Hα-helixtrans-67.6-27.5179.8-72.3-62.6000112.8G26 F27 Q33 Q34 I59 M62 Q63 M66 L232 M235 I236 Q239G26-F30 WeakPolarHBondContact O-CD2 3.37Å; G26-F30 PolarHBondContact O-N 2.74Å; F27-F30 PolarHBondContact O-N 3.18Å; F30-Q33 PolarHBondContact O-N 3.36Å; F30-Q34 WeakPolarHBondContact O-CB 3.48Å; F30-Q34 PolarHBondContact O-N 3.4Å; F30-I59 HydrophobicContact CB-CG2 4.2Å; F30-I59 WeakPolarHBondContact O-CG2 3.29Å; F30-M62 HydrophobicContact CD1-CB 4.03Å; F30-M62 HydrophobicContact CD1-SD 3.88Å; F30-M62 HydrophobicContact CD2-CB 3.96Å; F30-M62 HydrophobicContact CE1-CB 4.15Å; F30-M62 HydrophobicContact CE1-CG 4.41Å; F30-M62 HydrophobicContact CE1-SD 3.45Å; F30-M62 WeakPolarHBondContact CE1-SD 3.21Å; F30-M62 HydrophobicContact CE2-CB 4.08Å; F30-M62 HydrophobicContact CG-CB 3.96Å; F30-M62 HydrophobicContact CZ-CB 4.2Å; F30-M62 HydrophobicContact CZ-SD 3.98Å; F30-Q63 HydrophobicContact CB-CG 3.63Å; F30-M66 HydrophobicContact CD2-CG 3.94Å; F30-M66 HydrophobicContact CE2-CE 4.27Å; F30-M66 HydrophobicContact CE2-CG 4.12Å; F30-L232 HydrophobicContact CE2-CD1 3.76Å; F30-L232 HydrophobicContact CZ-CD1 4.37Å; F30-M235 HydrophobicContact CE1-CB 4.41Å; F30-M235 HydrophobicContact CE2-CB 4.08Å; F30-M235 HydrophobicContact CZ-CB 3.5Å; F30-I236 HydrophobicContact CE1-CG1 4.47Å; F30-I236 HydrophobicContact CZ-CG1 3.88Å; F30-Q239 HydrophobicContact CE1-CB 4.31Å
31T98.7Very high98.2Very high58 Ų5854.4 Ų54.436%0.35625%0.249SC..Hα-helixtrans-66.9-42.1170.8-56.80000111.8F27 I28 Y29 Q33 Q34 Y35 Q63F27-T31 WeakPolarHBondContact O-CB 3.4Å; F27-T31 PolarHBondContact O-N 3.34Å; F27-T31 PolarHBondContact O-OG1 3.19Å; I28-T31 WeakPolarHBondContact O-CB 3.27Å; I28-T31 PolarHBondContact O-N 2.83Å; Y29-T31 VanDerWaalsContact C-N 3.26Å; Y29-T31 PolarHBondContact O-N 3.46Å; T31-Q33 VanDerWaalsContact C-N 3.35Å; T31-Q34 WeakPolarHBondContact O-CB 3.12Å; T31-Q34 PolarHBondContact O-N 2.9Å; T31-Y35 PolarHBondContact O-N 3.07Å; T31-Q63 VanDerWaalsContact CA-NE2 3.31Å; T31-Q63 PolarHBondContact OG1-NE2 3.48Å
32Y98.6Very high98.1Very high127 Ų12750.5 Ų50.550%0.49824%0.235SC..Hα-helixtrans-62.4-42.9170169.6-100.3000111.5I28 Y29 Q34 Y35 N36I28-Y32 PolarHBondContact O-N 2.79Å; Y29-Y32 CarbonylContact O-C 3.5Å; Y29-Y32 WeakPolarHBondContact O-CB 3.35Å; Y29-Y32 PolarHBondContact O-N 3.05Å; Y29-Y32 VanDerWaalsContact O-N 3.13Å; Y32-Q34 VanDerWaalsContact C-N 3.31Å; Y32-Q34 PolarHBondContact O-N 3.49Å; Y32-Y35 WeakPolarHBondContact O-CB 3.33Å; Y32-Y35 PolarHBondContact O-N 2.77Å; Y32-Y35 VanDerWaalsContact O-N 3.16Å; Y32-N36 HydrophobicContact CE1-CB 4.1Å; Y32-N36 WeakPolarHBondContact O-CB 3.17Å; Y32-N36 PolarHBondContact O-N 2.86Å; Y32-N36 PolarHBondContact OH-ND2 3.41Å
33Q98.6Very high97.9Very high19 Ų1953.2 Ų53.29%0.08925%0.252CS..Hα-helixtrans-66.5-31.4178.7-69.1-56.8-17.800113.4Y29 F30 T31 Y35 N36 T37Y29-Q33 HydrophobicContact CD1-CG 3.96Å; Y29-Q33 HydrophobicContact CE1-CG 3.38Å; Y29-Q33 HydrophobicContact CE2-CG 4.05Å; Y29-Q33 HydrophobicContact CG-CG 4.48Å; Y29-Q33 VanDerWaalsContact CZ-CG 3.45Å; Y29-Q33 VanDerWaalsContact CZ-NE2 3.29Å; Y29-Q33 WeakPolarHBondContact O-CG 3.31Å; Y29-Q33 PolarHBondContact O-N 3.17Å; Y29-Q33 PolarHBondContact OH-NE2 3.33Å; F30-Q33 PolarHBondContact O-N 3.36Å; T31-Q33 VanDerWaalsContact C-N 3.35Å; Q33-Y35 VanDerWaalsContact C-N 3.29Å; Q33-Y35 PolarHBondContact O-N 2.97Å; Q33-N36 PolarHBondContact O-N 2.92Å; Q33-T37 WeakPolarHBondContact O-CB 3.46Å; Q33-T37 PolarHBondContact O-N 2.86Å; Q33-T37 PolarHBondContact O-OG1 2.96Å
34Q98.4Very high97.7Very high36 Ų3657.4 Ų57.417%0.16828%0.282CS..Hα-helixtrans-58.2-45.2172.3-176.961.849.300110.4F30 T31 Y32 N38 T56 I59F30-Q34 WeakPolarHBondContact O-CB 3.48Å; F30-Q34 PolarHBondContact O-N 3.4Å; T31-Q34 WeakPolarHBondContact O-CB 3.12Å; T31-Q34 PolarHBondContact O-N 2.9Å; Y32-Q34 VanDerWaalsContact C-N 3.31Å; Y32-Q34 PolarHBondContact O-N 3.49Å; Q34-N38 PolarHBondContact NE2-ND2 2.88Å; Q34-N38 WeakPolarHBondContact O-CB 3.24Å; Q34-N38 PolarHBondContact O-N 3.19Å; Q34-N38 PolarHBondContact O-ND2 3.36Å; Q34-T56 VanDerWaalsContact NE2-CG2 3.3Å; Q34-T56 PolarHBondContact NE2-OG1 3.49Å; Q34-T56 PolarHBondContact OE1-O 3.16Å; Q34-I59 HydrophobicContact CB-CG2 3.94Å; Q34-I59 VanDerWaalsContact OE1-CB 3.3Å; Q34-I59 VanDerWaalsContact OE1-CG2 3.31Å
35Y98.3Very high97.5Very high131 Ų13156.4 Ų56.451%0.51428%0.277SS..Hα-helixtrans-68.6-53.5174.4171.9-97.4000111.9T31 Y32 Q33 T37 N38 Y39 I40T31-Y35 PolarHBondContact O-N 3.07Å; Y32-Y35 WeakPolarHBondContact O-CB 3.33Å; Y32-Y35 PolarHBondContact O-N 2.77Å; Y32-Y35 VanDerWaalsContact O-N 3.16Å; Q33-Y35 VanDerWaalsContact C-N 3.29Å; Q33-Y35 PolarHBondContact O-N 2.97Å; Y35-T37 VanDerWaalsContact C-N 3.34Å; Y35-T37 PolarHBondContact O-N 3.18Å; Y35-N38 PolarHBondContact O-N 3.08Å; Y35-Y39 AromaticContact CD2-CD2 3.37Å; Y35-Y39 HydrophobicContact CD2-CD2 3.37Å; Y35-Y39 AromaticContact CD2-CE2 4Å; Y35-Y39 HydrophobicContact CD2-CE2 4Å; Y35-Y39 HydrophobicContact CD2-CG 4.01Å; Y35-Y39 AromaticContact CE2-CD2 3.76Å; Y35-Y39 HydrophobicContact CE2-CD2 3.76Å; Y35-Y39 HydrophobicContact CE2-CE2 4.5Å; Y35-Y39 AromaticContact CE2-CG 3.92Å; Y35-Y39 HydrophobicContact CE2-CG 3.92Å; Y35-Y39 HydrophobicContact CG-CD2 4.15Å; Y35-Y39 WeakPolarHBondContact O-CB 3.23Å; Y35-Y39 WeakPolarHBondContact O-CD2 3.39Å; Y35-Y39 PolarHBondContact O-N 3.47Å; Y35-I40 HydrophobicContact CE1-CD1 4.15Å
36N98.3Very high97.1Very high28 Ų2854.4 Ų54.415%0.1528%0.28CS..Hα-helixtrans-57-46.6-177.3179.3-87.9000111.8Y32 Q33 I40 V41Y32-N36 HydrophobicContact CE1-CB 4.1Å; Y32-N36 WeakPolarHBondContact O-CB 3.17Å; Y32-N36 PolarHBondContact O-N 2.86Å; Y32-N36 PolarHBondContact OH-ND2 3.41Å; Q33-N36 PolarHBondContact O-N 2.92Å; N36-I40 WeakPolarHBondContact O-CA 3.34Å; N36-I40 VanDerWaalsContact O-CB 3.24Å; N36-I40 WeakPolarHBondContact O-CB 3.34Å; N36-I40 PolarHBondContact O-N 2.66Å; N36-V41 PolarHBondContact O-N 3.2Å; N36-V41 WeakPolarHBondContact OD1-CG2 3.44Å
37T97.6Very high96.7Very high0 Ų055.3 Ų55.30%029%0.286CS..Iπ-helixtrans-63.8-48.3-179.6-590000110.9Q33 Y35 L42 F55 I59 Q239 N243Q33-T37 WeakPolarHBondContact O-CB 3.46Å; Q33-T37 PolarHBondContact O-N 2.86Å; Q33-T37 PolarHBondContact O-OG1 2.96Å; Y35-T37 VanDerWaalsContact C-N 3.34Å; Y35-T37 PolarHBondContact O-N 3.18Å; T37-L42 HydrophobicContact CG2-CD1 4.02Å; T37-L42 HydrophobicContact CG2-CG 3.97Å; T37-L42 VanDerWaalsContact O-CB 3.23Å; T37-L42 WeakPolarHBondContact O-CB 3.19Å; T37-L42 VanDerWaalsContact O-CG 3.26Å; T37-L42 WeakPolarHBondContact O-CG 3.41Å; T37-L42 PolarHBondContact O-N 2.88Å; T37-F55 HydrophobicContact CG2-CB 4.04Å; T37-F55 HydrophobicContact CG2-CD1 3.9Å; T37-F55 HydrophobicContact CG2-CG 4.28Å; T37-I59 HydrophobicContact CG2-CD1 4.21Å; T37-Q239 PolarHBondContact OG1-NE2 3.28Å; T37-N243 PolarHBondContact OG1-ND2 3.32Å; T37-N243 VanDerWaalsContact OG1-ND2 3.17Å
38N97.2Very high96.4Very high16 Ų1656.1 Ų56.19%0.08629%0.291CS..Iπ-helixtrans-79.8-27.5-174.4-79-82.7000115.2Q34 Y35 P43 H52 T56Q34-N38 PolarHBondContact NE2-ND2 2.88Å; Q34-N38 WeakPolarHBondContact O-CB 3.24Å; Q34-N38 PolarHBondContact O-N 3.19Å; Q34-N38 PolarHBondContact O-ND2 3.36Å; Y35-N38 PolarHBondContact O-N 3.08Å; N38-P43 VanDerWaalsContact O-CD 3.3Å; N38-P43 WeakPolarHBondContact O-CD 3.46Å; N38-P43 VanDerWaalsContact O-CG 3.31Å; N38-P43 WeakPolarHBondContact O-CG 3.38Å; N38-H52 PolarHBondContact O-CE1 2.98Å; N38-H52 PolarHBondContact OD1-ND1 3.36Å; N38-T56 PolarHBondContact ND2-OG1 3.18Å; N38-T56 PolarHBondContact OD1-OG1 3.46Å
39Y97.1Very high96.2Very high165 Ų16556.8 Ų56.865%0.64730%0.301SS*.Iπ-helixtrans-109.9-12.7-174.2-66.8-78.2000113.6Y35Y35-Y39 AromaticContact CD2-CD2 3.37Å; Y35-Y39 HydrophobicContact CD2-CD2 3.37Å; Y35-Y39 AromaticContact CD2-CE2 4Å; Y35-Y39 HydrophobicContact CD2-CE2 4Å; Y35-Y39 HydrophobicContact CD2-CG 4.01Å; Y35-Y39 AromaticContact CE2-CD2 3.76Å; Y35-Y39 HydrophobicContact CE2-CD2 3.76Å; Y35-Y39 HydrophobicContact CE2-CE2 4.5Å; Y35-Y39 AromaticContact CE2-CG 3.92Å; Y35-Y39 HydrophobicContact CE2-CG 3.92Å; Y35-Y39 HydrophobicContact CG-CD2 4.15Å; Y35-Y39 WeakPolarHBondContact O-CB 3.23Å; Y35-Y39 WeakPolarHBondContact O-CD2 3.39Å; Y35-Y39 PolarHBondContact O-N 3.47Å
40I96.6Very high96Very high82 Ų8257.1 Ų57.142%0.42131%0.311SS..Iπ-helixtrans-121.7-61.8-178.7-53.1176.9000110Y35 N36 S44Y35-I40 HydrophobicContact CE1-CD1 4.15Å; N36-I40 WeakPolarHBondContact O-CA 3.34Å; N36-I40 VanDerWaalsContact O-CB 3.24Å; N36-I40 WeakPolarHBondContact O-CB 3.34Å; N36-I40 PolarHBondContact O-N 2.66Å; I40-S44 VanDerWaalsContact O-CB 3.23Å; I40-S44 WeakPolarHBondContact O-CB 3.4Å; I40-S44 PolarHBondContact O-N 2.83Å; I40-S44 PolarHBondContact O-OG 3.22Å
41V96.3Very high95.9Very high27 Ų2757.1 Ų57.116%0.16431%0.311CS..Iπ-helixtrans-67.3-58.9-172.4179.70000111.6N36 S44 I45N36-V41 PolarHBondContact O-N 3.2Å; N36-V41 WeakPolarHBondContact OD1-CG2 3.44Å; V41-S44 PolarHBondContact O-N 2.07Å; V41-S44 VanDerWaalsContact O-N 3.13Å; V41-S44 PolarHBondContact O-OG 3.38Å; V41-I45 PolarHBondContact O-N 2.69Å
42L95.9Very high95.9Very high1 Ų156.7 Ų56.71%0.00531%0.305CS..Hα-helixtrans-61.3-45.6-174.7-73.8-176.3000113.1T37 S44 I45 S47 D51 H52 F55 L246T37-L42 HydrophobicContact CG2-CD1 4.02Å; T37-L42 HydrophobicContact CG2-CG 3.97Å; T37-L42 VanDerWaalsContact O-CB 3.23Å; T37-L42 WeakPolarHBondContact O-CB 3.19Å; T37-L42 VanDerWaalsContact O-CG 3.26Å; T37-L42 WeakPolarHBondContact O-CG 3.41Å; T37-L42 PolarHBondContact O-N 2.88Å; L42-S44 VanDerWaalsContact C-N 3.31Å; L42-S44 PolarHBondContact O-N 3.49Å; L42-I45 HydrophobicContact CD2-CD1 4.24Å; L42-I45 VanDerWaalsContact O-CG1 3.25Å; L42-I45 WeakPolarHBondContact O-CG1 3.3Å; L42-I45 PolarHBondContact O-N 3.29Å; L42-S47 VanDerWaalsContact C-OG 3.27Å; L42-S47 VanDerWaalsContact CB-OG 3.3Å; L42-S47 WeakPolarHBondContact CB-OG 3.1Å; L42-S47 VanDerWaalsContact O-CB 3.27Å; L42-S47 WeakPolarHBondContact O-CB 3.26Å; L42-S47 PolarHBondContact O-N 3.46Å; L42-S47 PolarHBondContact O-OG 3.09Å; L42-D51 HydrophobicContact CD2-CB 4.1Å; L42-H52 HydrophobicContact CD1-CB 4.24Å; L42-F55 HydrophobicContact CD1-CB 4.32Å; L42-L246 HydrophobicContact CD2-CD2 3.6Å
43P95.9Very high95.8Very high67 Ų6757.3 Ų57.344%0.43531%0.31SS..Hα-helixtrans-62.1-35.7173.6-25.336.6000113.6N38 I45 G46N38-P43 VanDerWaalsContact O-CD 3.3Å; N38-P43 WeakPolarHBondContact O-CD 3.46Å; N38-P43 VanDerWaalsContact O-CG 3.31Å; N38-P43 WeakPolarHBondContact O-CG 3.38Å; P43-I45 PolarHBondContact O-N 3.16Å; P43-G46 PolarHBondContact O-N 3.31Å
44S94.1Very high95.8Very high92 Ų9257.1 Ų57.164%0.64331%0.311SS*.Hα-helixtrans-65.4-20.9-178.573.20000114I40 V41 L42I40-S44 VanDerWaalsContact O-CB 3.23Å; I40-S44 WeakPolarHBondContact O-CB 3.4Å; I40-S44 PolarHBondContact O-N 2.83Å; I40-S44 PolarHBondContact O-OG 3.22Å; V41-S44 PolarHBondContact O-N 2.07Å; V41-S44 VanDerWaalsContact O-N 3.13Å; V41-S44 PolarHBondContact O-OG 3.38Å; L42-S44 VanDerWaalsContact C-N 3.31Å; L42-S44 PolarHBondContact O-N 3.49Å
45I92.8Very high95.8Very high30 Ų3055.4 Ų55.415%0.15430%0.303CS..THydrogen-bonded Turntrans-10711.9-179.266.2175.3000112.8V41 L42 P43 S47 L246 T247 R250V41-I45 PolarHBondContact O-N 2.69Å; L42-I45 HydrophobicContact CD2-CD1 4.24Å; L42-I45 VanDerWaalsContact O-CG1 3.25Å; L42-I45 WeakPolarHBondContact O-CG1 3.3Å; L42-I45 PolarHBondContact O-N 3.29Å; P43-I45 PolarHBondContact O-N 3.16Å; I45-S47 VanDerWaalsContact C-N 3.29Å; I45-S47 PolarHBondContact O-N 2.92Å; I45-L246 HydrophobicContact CD1-CD2 4.39Å; I45-L246 HydrophobicContact CD1-CG 4.21Å; I45-T247 HydrophobicContact CG2-CG2 3.91Å; I45-R250 HydrophobicContact CB-CB 4.03Å; I45-R250 HydrophobicContact CD1-CB 4.03Å; I45-R250 HydrophobicContact CD1-CG 3.95Å; I45-R250 HydrophobicContact CG1-CB 4.24Å; I45-R250 HydrophobicContact CG1-CG 4.4Å
46G89.9Confident95.8Very high58 Ų5851.5 Ų51.560%0.59829%0.292SS*.THydrogen-bonded Turntrans60.836-179.200000113.3P43P43-G46 PolarHBondContact O-N 3.31Å
47S91.4Very high95.8Very high20 Ų2054.1 Ų54.114%0.1431%0.306CS..  trans-65.1158.7-175.671.60000113.3L42 I45 D51 H52L42-S47 VanDerWaalsContact C-OG 3.27Å; L42-S47 VanDerWaalsContact CB-OG 3.3Å; L42-S47 WeakPolarHBondContact CB-OG 3.1Å; L42-S47 VanDerWaalsContact O-CB 3.27Å; L42-S47 WeakPolarHBondContact O-CB 3.26Å; L42-S47 PolarHBondContact O-N 3.46Å; L42-S47 PolarHBondContact O-OG 3.09Å; I45-S47 VanDerWaalsContact C-N 3.29Å; I45-S47 PolarHBondContact O-N 2.92Å; S47-D51 WeakPolarHBondContact CA-OD2 3.25Å; S47-D51 WeakPolarHBondContact CB-OD2 3.35Å; S47-H52 PolarHBondContact OG-CD2 3.43Å; S47-H52 PolarHBondContact OG-NE2 3.36Å; S47-H52 VanDerWaalsContact OG-NE2 3.11Å
48H92.4Very high95.8Very high73 Ų7354.1 Ų54.134%0.33831%0.306SS..  trans-89.2161.9176.1-66.4-99.5000112.2S50 D51 H52 R250H48-S50 PolarHBondContact O-N 3.46Å; H48-S50 VanDerWaalsContact O-N 3.08Å; H48-D51 PolarHBondContact N-OD2 3.01Å; H48-D51 WeakPolarHBondContact O-CB 3.27Å; H48-D51 PolarHBondContact O-N 3.1Å; H48-H52 PolarHBondContact O-CD2 3.1Å; H48-H52 PolarHBondContact O-N 3.46Å; H48-R250 PolarHBondContact CD2-NH1 3Å; H48-R250 PolarHBondContact CD2-NH2 3.11Å; H48-R250 PolarHBondContact NE2-NH1 3.43Å
49P95.6Very high95.9Very high110 Ų11053.4 Ų53.471%0.71430%0.302SS*.Hα-helixtrans-54.8-28.9175.1-28.136000114.6H52 F53P49-H52 PolarHBondContact O-N 3.25Å; P49-F53 PolarHBondContact O-N 3.48Å
50S94.7Very high96Very high59 Ų5950.7 Ų50.741%0.41329%0.294SS..Hα-helixtrans-66-39174.949.10000112.7H48 H52 F53 V54H48-S50 PolarHBondContact O-N 3.46Å; H48-S50 VanDerWaalsContact O-N 3.08Å; S50-H52 VanDerWaalsContact C-N 3.35Å; S50-F53 PolarHBondContact O-N 3.36Å; S50-V54 WeakPolarHBondContact O-CB 3.29Å; S50-V54 WeakPolarHBondContact O-CG2 3.44Å; S50-V54 PolarHBondContact O-N 2.93Å
51D95.9Very high96.1Very high0 Ų047 Ų470%028%0.276CS..Hα-helixtrans-61.2-46.6175.6-59.2-52.6000109.7L42 S47 H48 F53 V54 F55 Y107 L246 R250L42-D51 HydrophobicContact CD2-CB 4.1Å; S47-D51 WeakPolarHBondContact CA-OD2 3.25Å; S47-D51 WeakPolarHBondContact CB-OD2 3.35Å; H48-D51 PolarHBondContact N-OD2 3.01Å; H48-D51 WeakPolarHBondContact O-CB 3.27Å; H48-D51 PolarHBondContact O-N 3.1Å; D51-F53 PolarHBondContact O-N 2.9Å; D51-V54 PolarHBondContact O-N 3.17Å; D51-F55 WeakPolarHBondContact O-CB 3.44Å; D51-F55 WeakPolarHBondContact O-CD2 3.38Å; D51-F55 PolarHBondContact O-N 2.67Å; D51-Y107 WeakPolarHBondContact OD1-CE1 3.33Å; D51-Y107 PolarHBondContact OD1-OH 3.27Å; D51-L246 HydrophobicContact CB-CD2 4.06Å; D51-R250 IonicContact OD1-NE 2.71Å; D51-R250 IonicContact OD1-NH2 3.58Å; D51-R250 PolarHBondContact OD1-NH2 3.17Å; D51-R250 VanDerWaalsContact OD1-NH2 3.15Å; D51-R250 IonicContact OD2-CZ 2.66Å; D51-R250 IonicContact OD2-NE 2.78Å; D51-R250 PolarHBondContact OD2-NE 3.14Å; D51-R250 IonicContact OD2-NH2 3.86Å; D51-R250 PolarHBondContact OD2-NH2 3.4Å
52H97.4Very high96.2Very high49 Ų4945.7 Ų45.723%0.22727%0.269CS..Hα-helixtrans-58.4-47.4175.8-75.6-90.2000112.6N38 L42 S47 H48 P49 S50 T56N38-H52 PolarHBondContact O-CE1 2.98Å; N38-H52 PolarHBondContact OD1-ND1 3.36Å; L42-H52 HydrophobicContact CD1-CB 4.24Å; S47-H52 PolarHBondContact OG-CD2 3.43Å; S47-H52 PolarHBondContact OG-NE2 3.36Å; S47-H52 VanDerWaalsContact OG-NE2 3.11Å; H48-H52 PolarHBondContact O-CD2 3.1Å; H48-H52 PolarHBondContact O-N 3.46Å; P49-H52 PolarHBondContact O-N 3.25Å; S50-H52 VanDerWaalsContact C-N 3.35Å; H52-T56 WeakPolarHBondContact O-CB 3.21Å; H52-T56 PolarHBondContact O-N 3.47Å; H52-T56 PolarHBondContact O-OG1 2.7Å
53F98.1Very high96.3Very high140 Ų14046.7 Ų46.761%0.61427%0.273SS*.Hα-helixtrans-60.8-49.4-179.9177.3-100.7000111.4P49 S50 D51 T56 L57P49-F53 PolarHBondContact O-N 3.48Å; S50-F53 PolarHBondContact O-N 3.36Å; D51-F53 PolarHBondContact O-N 2.9Å; F53-T56 PolarHBondContact O-N 2.94Å; F53-L57 HydrophobicContact CE1-CD2 4.38Å; F53-L57 HydrophobicContact CZ-CD2 4.37Å; F53-L57 WeakPolarHBondContact O-CB 3.43Å; F53-L57 PolarHBondContact O-N 3.36Å
54V97.8Very high96.4Very high16 Ų1645.7 Ų45.710%0.09726%0.263CS..Hα-helixtrans-66.2-46.3-176.2170.80000111.8S50 D51 L57 S58 L103 Y107S50-V54 WeakPolarHBondContact O-CB 3.29Å; S50-V54 WeakPolarHBondContact O-CG2 3.44Å; S50-V54 PolarHBondContact O-N 2.93Å; D51-V54 PolarHBondContact O-N 3.17Å; V54-L57 PolarHBondContact O-N 3.36Å; V54-S58 WeakPolarHBondContact O-CB 3.31Å; V54-S58 PolarHBondContact O-N 2.88Å; V54-S58 PolarHBondContact O-OG 3.27Å; V54-L103 HydrophobicContact CG1-CD1 4.05Å; V54-L103 HydrophobicContact CG1-CD2 4.28Å; V54-L103 HydrophobicContact CG1-CG 3.84Å; V54-Y107 HydrophobicContact CB-CD1 4.28Å; V54-Y107 HydrophobicContact CB-CD2 4.27Å; V54-Y107 HydrophobicContact CB-CE1 4.37Å; V54-Y107 HydrophobicContact CB-CE2 4.37Å; V54-Y107 HydrophobicContact CB-CG 4.21Å; V54-Y107 HydrophobicContact CG1-CD1 3.78Å; V54-Y107 HydrophobicContact CG1-CD2 3.92Å; V54-Y107 HydrophobicContact CG1-CE1 4.37Å; V54-Y107 HydrophobicContact CG1-CG 3.52Å; V54-Y107 HydrophobicContact CG2-CD2 3.85Å; V54-Y107 HydrophobicContact CG2-CE2 3.83Å; V54-Y107 HydrophobicContact CG2-CG 4.3Å
55F97.9Very high96.7Very high0 Ų041.4 Ų41.40%023%0.233CC..Hα-helixtrans-68.1-37.1178.8-85.3-106.6000111.8T37 L42 D51 S58 I59 N104 Y107 T108 N243 L246T37-F55 HydrophobicContact CG2-CB 4.04Å; T37-F55 HydrophobicContact CG2-CD1 3.9Å; T37-F55 HydrophobicContact CG2-CG 4.28Å; L42-F55 HydrophobicContact CD1-CB 4.32Å; D51-F55 WeakPolarHBondContact O-CB 3.44Å; D51-F55 WeakPolarHBondContact O-CD2 3.38Å; D51-F55 PolarHBondContact O-N 2.67Å; F55-S58 PolarHBondContact O-N 3.47Å; F55-I59 WeakPolarHBondContact O-CB 3.15Å; F55-I59 VanDerWaalsContact O-CG1 3.29Å; F55-I59 WeakPolarHBondContact O-CG1 3.3Å; F55-I59 PolarHBondContact O-N 2.93Å; F55-N104 WeakPolarHBondContact CD1-ND2 3.44Å; F55-N104 WeakPolarHBondContact CE1-ND2 3.46Å; F55-N104 VanDerWaalsContact CZ-ND2 3.34Å; F55-N104 WeakPolarHBondContact CZ-ND2 3.2Å; F55-Y107 HydrophobicContact CE2-CD1 4.02Å; F55-Y107 HydrophobicContact CE2-CE1 4.29Å; F55-T108 HydrophobicContact CE2-CG2 4.12Å; F55-T108 HydrophobicContact CZ-CG2 3.77Å; F55-N243 WeakPolarHBondContact CD1-OD1 3.43Å; F55-N243 WeakPolarHBondContact CE1-OD1 3.24Å; F55-L246 HydrophobicContact CD2-CD2 4.15Å; F55-L246 HydrophobicContact CE2-CB 4.42Å; F55-L246 HydrophobicContact CE2-CD2 3.5Å; F55-L246 VanDerWaalsContact CE2-CD2 3.5Å; F55-L246 HydrophobicContact CE2-CG 4.49Å; F55-L246 HydrophobicContact CZ-CB 4.05Å; F55-L246 HydrophobicContact CZ-CD2 3.82Å
56T98.4Very high96.9Very high48 Ų4840 Ų4029%0.29423%0.226SC..Hα-helixtrans-60.2-49.3173.2-690000111.9Q34 N38 H52 F53 S58 I59 F60Q34-T56 VanDerWaalsContact NE2-CG2 3.3Å; Q34-T56 PolarHBondContact NE2-OG1 3.49Å; Q34-T56 PolarHBondContact OE1-O 3.16Å; N38-T56 PolarHBondContact ND2-OG1 3.18Å; N38-T56 PolarHBondContact OD1-OG1 3.46Å; H52-T56 WeakPolarHBondContact O-CB 3.21Å; H52-T56 PolarHBondContact O-N 3.47Å; H52-T56 PolarHBondContact O-OG1 2.7Å; F53-T56 PolarHBondContact O-N 2.94Å; T56-S58 VanDerWaalsContact C-N 3.28Å; T56-S58 PolarHBondContact O-N 3.5Å; T56-I59 PolarHBondContact O-N 2.97Å; T56-F60 VanDerWaalsContact O-CB 3.22Å; T56-F60 WeakPolarHBondContact O-CB 3.36Å; T56-F60 PolarHBondContact O-N 3.48Å
57L98.4Very high97.4Very high83 Ų8340.1 Ų40.144%0.43521%0.213SC..Hα-helixtrans-64.1-37.4179.3-175.657.9000111.6F53 V54 G61 L103F53-L57 HydrophobicContact CE1-CD2 4.38Å; F53-L57 HydrophobicContact CZ-CD2 4.37Å; F53-L57 WeakPolarHBondContact O-CB 3.43Å; F53-L57 PolarHBondContact O-N 3.36Å; V54-L57 PolarHBondContact O-N 3.36Å; L57-G61 PolarHBondContact O-N 3.23Å; L57-G61 VanDerWaalsContact O-N 3.12Å; L57-L103 HydrophobicContact CB-CD2 3.92Å; L57-L103 HydrophobicContact CD2-CD2 3.73Å; L57-L103 HydrophobicContact CG-CD2 3.82Å
58S98.5Very high97.7Very high1 Ų139.8 Ų39.81%0.00721%0.209CC..Hα-helixtrans-64.1-50.1177.7-58.80000112.4V54 F55 T56 F60 G61 M62 G100 L103 N104V54-S58 WeakPolarHBondContact O-CB 3.31Å; V54-S58 PolarHBondContact O-N 2.88Å; V54-S58 PolarHBondContact O-OG 3.27Å; F55-S58 PolarHBondContact O-N 3.47Å; T56-S58 VanDerWaalsContact C-N 3.28Å; T56-S58 PolarHBondContact O-N 3.5Å; S58-F60 VanDerWaalsContact C-N 3.34Å; S58-G61 PolarHBondContact O-N 2.96Å; S58-M62 PolarHBondContact O-N 3.5Å; S58-G100 VanDerWaalsContact CB-O 3.32Å; S58-G100 WeakPolarHBondContact CB-O 3.27Å; S58-G100 PolarHBondContact OG-O 3.45Å; S58-L103 WeakPolarHBondContact OG-CG 3.45Å; S58-N104 PolarHBondContact OG-N 2.9Å
59I98.8Very high98Very high1 Ų136.5 Ų36.51%0.00520%0.195CC..Hα-helixtrans-67.1-37.7179.2-66.5167.1000110.5F30 Q34 T37 F55 T56 G61 M62 Q63 Q239F30-I59 HydrophobicContact CB-CG2 4.2Å; F30-I59 WeakPolarHBondContact O-CG2 3.29Å; Q34-I59 HydrophobicContact CB-CG2 3.94Å; Q34-I59 VanDerWaalsContact OE1-CB 3.3Å; Q34-I59 VanDerWaalsContact OE1-CG2 3.31Å; T37-I59 HydrophobicContact CG2-CD1 4.21Å; F55-I59 WeakPolarHBondContact O-CB 3.15Å; F55-I59 VanDerWaalsContact O-CG1 3.29Å; F55-I59 WeakPolarHBondContact O-CG1 3.3Å; F55-I59 PolarHBondContact O-N 2.93Å; T56-I59 PolarHBondContact O-N 2.97Å; I59-G61 VanDerWaalsContact C-N 3.29Å; I59-G61 PolarHBondContact O-N 3.05Å; I59-M62 WeakPolarHBondContact O-CB 3.36Å; I59-M62 PolarHBondContact O-N 2.93Å; I59-Q63 HydrophobicContact CG2-CG 4.38Å; I59-Q63 WeakPolarHBondContact O-CG 3.49Å; I59-Q63 PolarHBondContact O-N 2.88Å; I59-Q239 HydrophobicContact CG1-CG 4.17Å
60F98.7Very high98.1Very high107 Ų10731.5 Ų31.547%0.46916%0.162SC..Hα-helixtrans-58-40.7174.1-179.4-106.9000112.5T56 S58 M62 Q63 M64T56-F60 VanDerWaalsContact O-CB 3.22Å; T56-F60 WeakPolarHBondContact O-CB 3.36Å; T56-F60 PolarHBondContact O-N 3.48Å; S58-F60 VanDerWaalsContact C-N 3.34Å; F60-M62 VanDerWaalsContact C-N 3.32Å; F60-M62 PolarHBondContact O-N 3.49Å; F60-Q63 WeakPolarHBondContact O-CB 3.34Å; F60-Q63 PolarHBondContact O-N 3.43Å; F60-M64 HydrophobicContact CD1-CG 4.22Å; F60-M64 HydrophobicContact CD2-CG 4.49Å; F60-M64 HydrophobicContact CE1-CG 3.76Å; F60-M64 HydrophobicContact CE1-SD 4.36Å; F60-M64 HydrophobicContact CE2-CG 4.06Å; F60-M64 HydrophobicContact CE2-SD 4.09Å; F60-M64 HydrophobicContact CZ-CG 3.67Å; F60-M64 HydrophobicContact CZ-SD 3.73Å; F60-M64 WeakPolarHBondContact O-CG 3.26Å; F60-M64 PolarHBondContact O-N 2.9Å
61G98.6Very high98.3Very high5 Ų529.6 Ų29.65%0.05215%0.149CC..Hα-helixtrans-56.9-44.1172.600000112.8L57 S58 I59 M64 C65 A96 G97L57-G61 PolarHBondContact O-N 3.23Å; L57-G61 VanDerWaalsContact O-N 3.12Å; S58-G61 PolarHBondContact O-N 2.96Å; I59-G61 VanDerWaalsContact C-N 3.29Å; I59-G61 PolarHBondContact O-N 3.05Å; G61-M64 PolarHBondContact O-N 3.36Å; G61-C65 PolarHBondContact O-N 3.26Å; G61-A96 WeakPolarHBondContact CA-O 3.36Å; G61-A96 CarbonylContact O-C 3.42Å; G61-G97 WeakPolarHBondContact O-CA 3.45Å; G61-G97 PolarHBondContact O-N 3.44Å
62M98.6Very high98.3Very high0 Ų031 Ų310%015%0.154CC..Hα-helixtrans-66.1-42.2176.8-58.6171.2-172.200111.7F30 S58 I59 F60 M64 C65 M66 M101 M235 Q239F30-M62 HydrophobicContact CD1-CB 4.03Å; F30-M62 HydrophobicContact CD1-SD 3.88Å; F30-M62 HydrophobicContact CD2-CB 3.96Å; F30-M62 HydrophobicContact CE1-CB 4.15Å; F30-M62 HydrophobicContact CE1-CG 4.41Å; F30-M62 HydrophobicContact CE1-SD 3.45Å; F30-M62 WeakPolarHBondContact CE1-SD 3.21Å; F30-M62 HydrophobicContact CE2-CB 4.08Å; F30-M62 HydrophobicContact CG-CB 3.96Å; F30-M62 HydrophobicContact CZ-CB 4.2Å; F30-M62 HydrophobicContact CZ-SD 3.98Å; S58-M62 PolarHBondContact O-N 3.5Å; I59-M62 WeakPolarHBondContact O-CB 3.36Å; I59-M62 PolarHBondContact O-N 2.93Å; F60-M62 VanDerWaalsContact C-N 3.32Å; F60-M62 PolarHBondContact O-N 3.49Å; M62-M64 VanDerWaalsContact C-N 3.35Å; M62-M64 PolarHBondContact O-N 2.96Å; M62-C65 WeakPolarHBondContact O-CB 3.44Å; M62-C65 PolarHBondContact O-N 3.01Å; M62-M66 VanDerWaalsContact O-CG 3.28Å; M62-M66 WeakPolarHBondContact O-CG 3.4Å; M62-M66 PolarHBondContact O-N 3.48Å; M62-M101 HydrophobicContact CE-CG 3.84Å; M62-M235 HydrophobicContact CB-SD 4.15Å; M62-M235 HydrophobicContact CG-SD 4.12Å; M62-M235 HydrophobicContact SD-CB 4.38Å; M62-Q239 HydrophobicContact CE-CB 4.09Å; M62-Q239 HydrophobicContact SD-CB 4.02Å; M62-Q239 HydrophobicContact SD-CG 4.42Å
63Q98.8Very high98.3Very high22 Ų2229.3 Ų29.310%0.10315%0.147CC..Hα-helixtrans-58.3-46.1174.4-70.2176.3-62.400111.7F27 F30 T31 I59 F60 C65 M66 L67F27-Q63 HydrophobicContact CD2-CB 3.96Å; F27-Q63 HydrophobicContact CD2-CG 4.4Å; F27-Q63 WeakPolarHBondContact CD2-O 3.46Å; F27-Q63 HydrophobicContact CE2-CB 4Å; F27-Q63 HydrophobicContact CE2-CG 4.45Å; F30-Q63 HydrophobicContact CB-CG 3.63Å; T31-Q63 VanDerWaalsContact CA-NE2 3.31Å; T31-Q63 PolarHBondContact OG1-NE2 3.48Å; I59-Q63 HydrophobicContact CG2-CG 4.38Å; I59-Q63 WeakPolarHBondContact O-CG 3.49Å; I59-Q63 PolarHBondContact O-N 2.88Å; F60-Q63 WeakPolarHBondContact O-CB 3.34Å; F60-Q63 PolarHBondContact O-N 3.43Å; Q63-C65 PolarHBondContact O-N 3.46Å; Q63-M66 PolarHBondContact O-N 3.47Å; Q63-L67 WeakPolarHBondContact O-CB 3.32Å; Q63-L67 PolarHBondContact O-N 2.99Å
64M98.5Very high98.3Very high45 Ų4523.3 Ų23.322%0.22212%0.121CC..Hα-helixtrans-61.7-43.2178.1-73.5-59.9-54.200111.8F60 G61 M62 M66 L68 A96F60-M64 HydrophobicContact CD1-CG 4.22Å; F60-M64 HydrophobicContact CD2-CG 4.49Å; F60-M64 HydrophobicContact CE1-CG 3.76Å; F60-M64 HydrophobicContact CE1-SD 4.36Å; F60-M64 HydrophobicContact CE2-CG 4.06Å; F60-M64 HydrophobicContact CE2-SD 4.09Å; F60-M64 HydrophobicContact CZ-CG 3.67Å; F60-M64 HydrophobicContact CZ-SD 3.73Å; F60-M64 WeakPolarHBondContact O-CG 3.26Å; F60-M64 PolarHBondContact O-N 2.9Å; G61-M64 PolarHBondContact O-N 3.36Å; M62-M64 VanDerWaalsContact C-N 3.35Å; M62-M64 PolarHBondContact O-N 2.96Å; M64-M66 PolarHBondContact O-N 3.19Å; M64-L68 HydrophobicContact CE-CD1 3.63Å; M64-L68 HydrophobicContact CE-CD2 4.32Å; M64-L68 HydrophobicContact CE-CG 3.96Å; M64-L68 VanDerWaalsContact O-CB 3.29Å; M64-L68 WeakPolarHBondContact O-CB 3.47Å; M64-L68 VanDerWaalsContact O-CG 3.24Å; M64-L68 WeakPolarHBondContact O-CG 3.49Å; M64-L68 PolarHBondContact O-N 3.34Å; M64-A96 HydrophobicContact CB-CB 4.09Å
65C98.6Very high98.2Very high3 Ų325 Ų252%0.0213%0.128CC..Hα-helixtrans-55.8-52.6174.5-173.40000111.6G61 M62 Q63 S69 G93 M235G61-C65 PolarHBondContact O-N 3.26Å; M62-C65 WeakPolarHBondContact O-CB 3.44Å; M62-C65 PolarHBondContact O-N 3.01Å; Q63-C65 PolarHBondContact O-N 3.46Å; C65-S69 VanDerWaalsContact O-CB 3.23Å; C65-S69 WeakPolarHBondContact O-CB 3.49Å; C65-S69 PolarHBondContact O-N 2.92Å; C65-S69 VanDerWaalsContact O-N 3.1Å; C65-G93 WeakPolarHBondContact CA-O 3.49Å; C65-G93 WeakPolarHBondContact CB-O 3.44Å; C65-M235 HydrophobicContact CB-CE 4.12Å
66M98.7Very high97.9Very high0 Ų025.7 Ų25.70%013%0.134CC..Hα-helixtrans-62.9-48-177.3-67.4-58.2142.200112.1H23 F27 F30 M62 Q63 M64 S69 A70 L232 M235H23-M66 HydrophobicContact CB-SD 4.02Å; H23-M66 PolarHBondContact CD2-SD 3Å; H23-M66 WeakPolarHBondContact O-CB 3.23Å; F27-M66 HydrophobicContact CB-CB 3.85Å; F30-M66 HydrophobicContact CD2-CG 3.94Å; F30-M66 HydrophobicContact CE2-CE 4.27Å; F30-M66 HydrophobicContact CE2-CG 4.12Å; M62-M66 VanDerWaalsContact O-CG 3.28Å; M62-M66 WeakPolarHBondContact O-CG 3.4Å; M62-M66 PolarHBondContact O-N 3.48Å; Q63-M66 PolarHBondContact O-N 3.47Å; M64-M66 PolarHBondContact O-N 3.19Å; M66-S69 PolarHBondContact O-N 3.36Å; M66-A70 WeakPolarHBondContact O-CB 3.31Å; M66-A70 PolarHBondContact O-N 3.23Å; M66-L232 HydrophobicContact CE-CB 4.45Å; M66-L232 HydrophobicContact CE-CD1 4.06Å; M66-L232 HydrophobicContact SD-CD1 3.97Å; M66-M235 HydrophobicContact CE-CE 4.18Å; M66-M235 HydrophobicContact CE-CG 4.4Å; M66-M235 HydrophobicContact CE-SD 3.25Å; M66-M235 WeakPolarHBondContact CE-SD 3.43Å
67L98.7Very high97.6Very high60 Ų6026.2 Ų26.231%0.31414%0.139SC..Hα-helixtrans-66.7-44.2-177-178.361.7000112.6F27 Q63 S69 S71F27-L67 HydrophobicContact CD1-CD1 4.5Å; F27-L67 HydrophobicContact CD2-CB 3.77Å; F27-L67 HydrophobicContact CE2-CB 4.09Å; F27-L67 HydrophobicContact CE2-CD2 4.06Å; F27-L67 HydrophobicContact CE2-CG 4.5Å; F27-L67 HydrophobicContact CG-CB 4.25Å; F27-L67 HydrophobicContact CZ-CD2 4.29Å; Q63-L67 WeakPolarHBondContact O-CB 3.32Å; Q63-L67 PolarHBondContact O-N 2.99Å; L67-S69 VanDerWaalsContact C-N 3.32Å; L67-S71 WeakPolarHBondContact O-CB 3.44Å; L67-S71 PolarHBondContact O-N 3.39Å; L67-S71 PolarHBondContact O-OG 3Å
68L98.4Very high97.2Very high14 Ų1423.8 Ų23.87%0.07313%0.128CC..Hα-helixtrans-69.1-35.3-178.8-67.1-179.1000111.4M64 S71 Y72 M89 F92M64-L68 HydrophobicContact CE-CD1 3.63Å; M64-L68 HydrophobicContact CE-CD2 4.32Å; M64-L68 HydrophobicContact CE-CG 3.96Å; M64-L68 VanDerWaalsContact O-CB 3.29Å; M64-L68 WeakPolarHBondContact O-CB 3.47Å; M64-L68 VanDerWaalsContact O-CG 3.24Å; M64-L68 WeakPolarHBondContact O-CG 3.49Å; M64-L68 PolarHBondContact O-N 3.34Å; L68-S71 PolarHBondContact O-N 2.66Å; L68-Y72 PolarHBondContact O-N 3.44Å; L68-M89 HydrophobicContact CD1-CE 4.32Å; L68-M89 VanDerWaalsContact CD1-O 3.24Å; L68-M89 WeakPolarHBondContact CD1-O 3.38Å; L68-M89 HydrophobicContact CD2-CB 4.31Å; L68-M89 HydrophobicContact CD2-CE 4.08Å; L68-F92 HydrophobicContact CD1-CD1 3.87Å
69S98.4Very high96.9Very high4 Ų426.1 Ų26.13%0.02814%0.144CC..Hα-helixtrans-66.5-49.1174.3-167.90000112.7H23 C65 M66 L67 S71 Y72 H73 D90H23-S69 WeakPolarHBondContact ND1-CB 3.17Å; H23-S69 PolarHBondContact ND1-OG 3.33Å; C65-S69 VanDerWaalsContact O-CB 3.23Å; C65-S69 WeakPolarHBondContact O-CB 3.49Å; C65-S69 PolarHBondContact O-N 2.92Å; C65-S69 VanDerWaalsContact O-N 3.1Å; M66-S69 PolarHBondContact O-N 3.36Å; L67-S69 VanDerWaalsContact C-N 3.32Å; S69-S71 PolarHBondContact O-N 3.35Å; S69-Y72 WeakPolarHBondContact O-CB 3.47Å; S69-Y72 PolarHBondContact O-N 3.17Å; S69-Y72 VanDerWaalsContact O-N 3.1Å; S69-H73 PolarHBondContact O-CD2 2.88Å; S69-H73 VanDerWaalsContact O-CD2 3.31Å; S69-H73 PolarHBondContact O-N 3.2Å; S69-H73 VanDerWaalsContact O-N 3.08Å; S69-D90 WeakPolarHBondContact CA-OD1 3.42Å; S69-D90 WeakPolarHBondContact CB-OD1 3.32Å; S69-D90 PolarHBondContact OG-OD1 3.18Å
70A98.5Very high96.6Very high4 Ų431.6 Ų31.63%0.03317%0.173CC..Hα-helixtrans-59.3-37.7174.600000111.8H23 L24 M66 H73 T74H23-A70 HydrophobicContact CB-CB 4.27Å; L24-A70 HydrophobicContact CB-CB 4.28Å; M66-A70 WeakPolarHBondContact O-CB 3.31Å; M66-A70 PolarHBondContact O-N 3.23Å; A70-H73 PolarHBondContact O-N 3.41Å; A70-T74 WeakPolarHBondContact O-CB 3.28Å; A70-T74 PolarHBondContact O-N 2.89Å; A70-T74 PolarHBondContact O-OG1 3.49Å
71S98Very high96.2Very high19 Ų1932.4 Ų32.413%0.13318%0.178CC..Hα-helixtrans-65-40.1175.4-600000112.4L67 L68 S69 T74 F75 W86L67-S71 WeakPolarHBondContact O-CB 3.44Å; L67-S71 PolarHBondContact O-N 3.39Å; L67-S71 PolarHBondContact O-OG 3Å; L68-S71 PolarHBondContact O-N 2.66Å; S69-S71 PolarHBondContact O-N 3.35Å; S71-T74 PolarHBondContact O-N 3.47Å; S71-F75 WeakPolarHBondContact O-CB 3.48Å; S71-F75 VanDerWaalsContact O-CD2 3.25Å; S71-F75 WeakPolarHBondContact O-CD2 3.45Å; S71-F75 PolarHBondContact O-N 3.18Å; S71-W86 VanDerWaalsContact CB-CZ3 3.5Å
72Y97.4Very high95.8Very high29 Ų2934 Ų3411%0.11419%0.185CC..Hα-helixtrans-60.7-50.6175.1167.1-106.4000112.1L68 S69 T74 F75 G76 R83 W86 L87 D90L68-Y72 PolarHBondContact O-N 3.44Å; S69-Y72 WeakPolarHBondContact O-CB 3.47Å; S69-Y72 PolarHBondContact O-N 3.17Å; S69-Y72 VanDerWaalsContact O-N 3.1Å; Y72-T74 PolarHBondContact O-N 2.98Å; Y72-F75 PolarHBondContact O-N 3.18Å; Y72-G76 WeakPolarHBondContact O-CA 3.36Å; Y72-G76 PolarHBondContact O-N 3.32Å; Y72-R83 HydrophobicContact CE2-CG 3.94Å; Y72-R83 PolarHBondContact OH-NE 3.41Å; Y72-W86 HydrophobicContact CD2-CB 3.7Å; Y72-W86 HydrophobicContact CG-CB 4.41Å; Y72-L87 HydrophobicContact CD2-CB 4.1Å; Y72-L87 HydrophobicContact CE1-CD1 4.41Å; Y72-L87 HydrophobicContact CE2-CB 3.67Å; Y72-L87 HydrophobicContact CE2-CD1 4.05Å; Y72-L87 HydrophobicContact CE2-CG 4.42Å; Y72-D90 HydrophobicContact CG-CB 4.21Å
73H97.4Very high95.5Very high15 Ų1540.4 Ų40.47%0.06921%0.209CC..Hα-helixtrans-66.8-26.3179.9-73.9-73.4000112.7E16 N19 I20 S69 A70 H224 H228E16-H73 IonicContact OE1-ND1 2.74Å; E16-H73 IonicContact OE2-CE1 3.78Å; E16-H73 PolarHBondContact OE2-CE1 3.09Å; E16-H73 IonicContact OE2-CG 3.98Å; E16-H73 IonicContact OE2-ND1 3.57Å; E16-H73 PolarHBondContact OE2-ND1 3.29Å; N19-H73 HydrophobicContact CB-CB 4.23Å; I20-H73 HydrophobicContact CG1-CB 3.68Å; S69-H73 PolarHBondContact O-CD2 2.88Å; S69-H73 VanDerWaalsContact O-CD2 3.31Å; S69-H73 PolarHBondContact O-N 3.2Å; S69-H73 VanDerWaalsContact O-N 3.08Å; A70-H73 PolarHBondContact O-N 3.41Å; H73-H224 AromaticContact CE1-CD2 3.5Å; H73-H224 AromaticContact CE1-NE2 3.18Å; H73-H224 PolarHBondContact CE1-NE2 2.96Å; H73-H224 AromaticContact NE2-CD2 3.71Å; H73-H224 AromaticContact NE2-NE2 3.08Å; H73-H224 PolarHBondContact NE2-NE2 3.41Å; H73-H228 AromaticContact CD2-CE1 3.53Å; H73-H228 AromaticContact CD2-NE2 3.73Å; H73-H228 AromaticContact NE2-CE1 3.52Å; H73-H228 AromaticContact NE2-NE2 3.19Å; H73-H228 PolarHBondContact NE2-NE2 3.43Å; H73-H228 VanDerWaalsContact NE2-NE2 3.19Å
74T97.3Very high95.1Very high13 Ų1343.9 Ų43.98%0.0823%0.225CC..Hα-helixtrans-79.1-48.6174.8-570000112.5C6 A10 A70 S71 Y72 C77C6-T74 VanDerWaalsContact CB-O 3.31Å; C6-T74 WeakPolarHBondContact CB-O 3.35Å; C6-T74 WeakPolarHBondContact O-CG2 3.22Å; A10-T74 HydrophobicContact CB-CG2 4.48Å; A70-T74 WeakPolarHBondContact O-CB 3.28Å; A70-T74 PolarHBondContact O-N 2.89Å; A70-T74 PolarHBondContact O-OG1 3.49Å; S71-T74 PolarHBondContact O-N 3.47Å; Y72-T74 PolarHBondContact O-N 2.98Å; T74-C77 PolarHBondContact O-SG 3.19Å
75F96.1Very high94.8Very high52 Ų5248.2 Ų48.223%0.22824%0.242CC..Hα-helixtrans-101.7-5.8-167.7-61.9-64000114.6C6 A7 S71 Y72 C77 T78 W86C6-F75 HydrophobicContact CB-CD1 4.21Å; A7-F75 HydrophobicContact CB-CE1 4.16Å; S71-F75 WeakPolarHBondContact O-CB 3.48Å; S71-F75 VanDerWaalsContact O-CD2 3.25Å; S71-F75 WeakPolarHBondContact O-CD2 3.45Å; S71-F75 PolarHBondContact O-N 3.18Å; Y72-F75 PolarHBondContact O-N 3.18Å; F75-C77 PolarHBondContact O-N 3.2Å; F75-C77 VanDerWaalsContact O-N 3.16Å; F75-T78 PolarHBondContact O-N 3.48Å; F75-T78 PolarHBondContact O-OG1 3.29Å; F75-W86 HydrophobicContact CB-CG 4.44Å; F75-W86 HydrophobicContact CB-CZ2 4.4Å; F75-W86 VanDerWaalsContact CB-NE1 3.29Å; F75-W86 HydrophobicContact CD2-CH2 4.42Å; F75-W86 AromaticContact CD2-CZ2 3.87Å; F75-W86 HydrophobicContact CD2-CZ2 3.87Å; F75-W86 HydrophobicContact CG-CZ2 4.37Å
76G91.8Very high94.6Very high14 Ų1450.8 Ų50.814%0.14425%0.252CS..THydrogen-bonded Turntrans-62.6-16.3177.600000114.7Y72 T78 R83Y72-G76 WeakPolarHBondContact O-CA 3.36Å; Y72-G76 PolarHBondContact O-N 3.32Å; G76-T78 VanDerWaalsContact C-N 3.27Å; G76-T78 PolarHBondContact O-N 2.91Å; G76-R83 WeakPolarHBondContact O-CB 3.39Å
77C91.1Very high94.3Very high59 Ų5953.3 Ų53.340%0.39927%0.265SS..THydrogen-bonded Turntrans-75.4-6.1176.844.40000115.5M1 C6 T74 F75M1-C77 HydrophobicContact SD-CB 4.12Å; C6-C77 WeakPolarHBondContact CB-SG 3.22Å; C6-C77 WeakPolarHBondContact SG-CB 3.45Å; C6-C77 CovalentContact SG-SG 2.07Å; C6-C77 PolarHBondContact SG-SG 2.96Å; T74-C77 PolarHBondContact O-SG 3.19Å; F75-C77 PolarHBondContact O-N 3.2Å; F75-C77 VanDerWaalsContact O-N 3.16Å
78T91Very high94Very high33 Ų3353.3 Ų53.320%0.20226%0.262CS..SBendtrans-75-55.6-167.9-45.70000112.3M1 K3 F75 G76M1-T78 VanDerWaalsContact O-CG2 3.27Å; M1-T78 WeakPolarHBondContact O-CG2 3.34Å; K3-T78 HydrophobicContact CG-CG2 4.4Å; F75-T78 PolarHBondContact O-N 3.48Å; F75-T78 PolarHBondContact O-OG1 3.29Å; G76-T78 VanDerWaalsContact C-N 3.27Å; G76-T78 PolarHBondContact O-N 2.91Å
79S92.5Very high93.9Very high49 Ų4956 Ų5634%0.34328%0.276SS..  trans-159.7167.8178.382.50000109.6E81 M82 R83S79-E81 VanDerWaalsContact C-N 3.33Å; S79-E81 WeakPolarHBondContact CB-OE2 3.44Å; S79-E81 PolarHBondContact O-N 2.89Å; S79-E81 PolarHBondContact OG-N 3.15Å; S79-E81 PolarHBondContact OG-OE2 3.31Å; S79-M82 PolarHBondContact O-N 3.1Å; S79-M82 PolarHBondContact OG-N 3.08Å; S79-R83 WeakPolarHBondContact O-CB 3.49Å; S79-R83 PolarHBondContact O-N 3.32Å
80I90.9Very high93.8Very high117 Ų11756.5 Ų56.560%0.628%0.278SS*.Hα-helixtrans-66-37.1-179.9-159.8157.8000111.9R83 Q84I80-R83 PolarHBondContact O-N 3.36Å; I80-Q84 WeakPolarHBondContact O-CG 3.06Å; I80-Q84 PolarHBondContact O-N 3.39Å
81E90.9Very high93.5Very high123 Ų12356.9 Ų56.958%0.57528%0.279SS*.Hα-helixtrans-66.2-43.5176.9-53.573.3-158.100110.6S79 R83 Q84 K85S79-E81 VanDerWaalsContact C-N 3.33Å; S79-E81 WeakPolarHBondContact CB-OE2 3.44Å; S79-E81 PolarHBondContact O-N 2.89Å; S79-E81 PolarHBondContact OG-N 3.15Å; S79-E81 PolarHBondContact OG-OE2 3.31Å; E81-R83 VanDerWaalsContact C-N 3.34Å; E81-Q84 PolarHBondContact O-N 2.99Å; E81-K85 WeakPolarHBondContact O-CB 3.28Å; E81-K85 PolarHBondContact O-N 3.29Å
82M90.1Very high93.4Very high40 Ų4059.3 Ų59.320%0.19729%0.288CS..Hα-helixtrans-65.3-40.6177.4-170.356.661.200111S79 K85 W86S79-M82 PolarHBondContact O-N 3.1Å; S79-M82 PolarHBondContact OG-N 3.08Å; M82-K85 PolarHBondContact O-N 2.95Å; M82-W86 PolarHBondContact O-N 3.3Å; M82-W86 VanDerWaalsContact SD-CD1 3.59Å; M82-W86 PolarHBondContact SD-NE1 3.49Å
83R92Very high93.4Very high134 Ų13458 Ų5851%0.50628%0.282SS..Hα-helixtrans-60.5-45.6175.1-170.1176-177.5-177.42.6111.6Y72 G76 S79 I80 E81 W86 L87Y72-R83 HydrophobicContact CE2-CG 3.94Å; Y72-R83 PolarHBondContact OH-NE 3.41Å; G76-R83 WeakPolarHBondContact O-CB 3.39Å; S79-R83 WeakPolarHBondContact O-CB 3.49Å; S79-R83 PolarHBondContact O-N 3.32Å; I80-R83 PolarHBondContact O-N 3.36Å; E81-R83 VanDerWaalsContact C-N 3.34Å; R83-W86 PolarHBondContact O-N 3.49Å; R83-L87 VanDerWaalsContact O-CB 3.29Å; R83-L87 WeakPolarHBondContact O-CB 3.34Å; R83-L87 PolarHBondContact O-N 2.76Å
84Q90.9Very high93.3Very high94 Ų9459.7 Ų59.744%0.43929%0.292SS..Hα-helixtrans-63.6-42.3176.8-73.3178.3-700111.9I80 E81 L87 K88I80-Q84 WeakPolarHBondContact O-CG 3.06Å; I80-Q84 PolarHBondContact O-N 3.39Å; E81-Q84 PolarHBondContact O-N 2.99Å; Q84-L87 PolarHBondContact O-N 3.2Å; Q84-K88 WeakPolarHBondContact O-CG 3.25Å; Q84-K88 PolarHBondContact O-N 2.98Å; Q84-K88 VanDerWaalsContact O-N 3.1Å
85K91.9Very high93.3Very high136 Ų13659.2 Ų59.259%0.59129%0.288SS*.Hα-helixtrans-60.2-50.7176.7-178.2174.8178.9173.70111.4E81 M82 L87 K88 M89E81-K85 WeakPolarHBondContact O-CB 3.28Å; E81-K85 PolarHBondContact O-N 3.29Å; M82-K85 PolarHBondContact O-N 2.95Å; K85-L87 VanDerWaalsContact C-N 3.31Å; K85-L87 PolarHBondContact O-N 2.93Å; K85-K88 PolarHBondContact O-N 3.1Å; K85-M89 WeakPolarHBondContact O-CG 3.44Å; K85-M89 PolarHBondContact O-N 3.15Å
86W94.6Very high93.3Very high58 Ų5857.6 Ų57.622%0.2229%0.285CS..Hα-helixtrans-66.9-32.6178.8-76.6116.2000113S71 Y72 F75 M82 R83 K88 M89 D90S71-W86 VanDerWaalsContact CB-CZ3 3.5Å; Y72-W86 HydrophobicContact CD2-CB 3.7Å; Y72-W86 HydrophobicContact CG-CB 4.41Å; F75-W86 HydrophobicContact CB-CG 4.44Å; F75-W86 HydrophobicContact CB-CZ2 4.4Å; F75-W86 VanDerWaalsContact CB-NE1 3.29Å; F75-W86 HydrophobicContact CD2-CH2 4.42Å; F75-W86 AromaticContact CD2-CZ2 3.87Å; F75-W86 HydrophobicContact CD2-CZ2 3.87Å; F75-W86 HydrophobicContact CG-CZ2 4.37Å; M82-W86 PolarHBondContact O-N 3.3Å; M82-W86 VanDerWaalsContact SD-CD1 3.59Å; M82-W86 PolarHBondContact SD-NE1 3.49Å; R83-W86 PolarHBondContact O-N 3.49Å; W86-K88 VanDerWaalsContact C-N 3.32Å; W86-K88 PolarHBondContact O-N 3.32Å; W86-M89 HydrophobicContact CE3-CB 4.18Å; W86-M89 HydrophobicContact CE3-CG 4.35Å; W86-M89 CarbonylContact O-C 3.55Å; W86-M89 WeakPolarHBondContact O-CB 3.38Å; W86-M89 PolarHBondContact O-N 2.8Å; W86-M89 VanDerWaalsContact O-N 3.15Å; W86-D90 WeakPolarHBondContact O-CB 3.5Å; W86-D90 PolarHBondContact O-N 3.44Å
87L92.8Very high93.6Very high53 Ų5357 Ų5728%0.27728%0.278SS..Hα-helixtrans-61.9-41.7174.6-178.463.4000111.3Y72 R83 Q84 K85 M89 D90 I91 F141Y72-L87 HydrophobicContact CD2-CB 4.1Å; Y72-L87 HydrophobicContact CE1-CD1 4.41Å; Y72-L87 HydrophobicContact CE2-CB 3.67Å; Y72-L87 HydrophobicContact CE2-CD1 4.05Å; Y72-L87 HydrophobicContact CE2-CG 4.42Å; R83-L87 VanDerWaalsContact O-CB 3.29Å; R83-L87 WeakPolarHBondContact O-CB 3.34Å; R83-L87 PolarHBondContact O-N 2.76Å; Q84-L87 PolarHBondContact O-N 3.2Å; K85-L87 VanDerWaalsContact C-N 3.31Å; K85-L87 PolarHBondContact O-N 2.93Å; L87-M89 VanDerWaalsContact C-N 3.29Å; L87-M89 PolarHBondContact O-N 3.31Å; L87-D90 PolarHBondContact O-N 3.04Å; L87-I91 HydrophobicContact CD1-CD1 4.21Å; L87-I91 HydrophobicContact CG-CD1 4.07Å; L87-I91 WeakPolarHBondContact O-CD1 3.1Å; L87-I91 WeakPolarHBondContact O-CG1 3.26Å; L87-I91 PolarHBondContact O-N 3.47Å; L87-F141 HydrophobicContact CD2-CD1 4.01Å; L87-F141 HydrophobicContact CD2-CE1 3.94Å; L87-F141 HydrophobicContact CG-CE1 4.01Å
88K93Very high93.9Very high59 Ų5955.2 Ų55.226%0.25727%0.265SS..Hα-helixtrans-61.4-40173.9-67.9178.9-177.6-175.60111.6Q84 K85 W86 F92 P135 F141Q84-K88 WeakPolarHBondContact O-CG 3.25Å; Q84-K88 PolarHBondContact O-N 2.98Å; Q84-K88 VanDerWaalsContact O-N 3.1Å; K85-K88 PolarHBondContact O-N 3.1Å; W86-K88 VanDerWaalsContact C-N 3.32Å; W86-K88 PolarHBondContact O-N 3.32Å; K88-F92 WeakPolarHBondContact O-CB 3.2Å; K88-F92 PolarHBondContact O-N 3.06Å; K88-P135 WeakPolarHBondContact CD-O 3.37Å; K88-P135 WeakPolarHBondContact CG-O 3.4Å; K88-F141 HydrophobicContact CG-CE2 4.48Å; K88-F141 HydrophobicContact CG-CZ 3.96Å
89M94.9Very high94.3Very high72 Ų7254.6 Ų54.636%0.35526%0.26SS..Hα-helixtrans-67.5-42.1176.6-61.6-61.1-60.600112L68 K85 W86 L87 I91 F92 G93L68-M89 HydrophobicContact CD1-CE 4.32Å; L68-M89 VanDerWaalsContact CD1-O 3.24Å; L68-M89 WeakPolarHBondContact CD1-O 3.38Å; L68-M89 HydrophobicContact CD2-CB 4.31Å; L68-M89 HydrophobicContact CD2-CE 4.08Å; K85-M89 WeakPolarHBondContact O-CG 3.44Å; K85-M89 PolarHBondContact O-N 3.15Å; W86-M89 HydrophobicContact CE3-CB 4.18Å; W86-M89 HydrophobicContact CE3-CG 4.35Å; W86-M89 CarbonylContact O-C 3.55Å; W86-M89 WeakPolarHBondContact O-CB 3.38Å; W86-M89 PolarHBondContact O-N 2.8Å; W86-M89 VanDerWaalsContact O-N 3.15Å; L87-M89 VanDerWaalsContact C-N 3.29Å; L87-M89 PolarHBondContact O-N 3.31Å; M89-I91 VanDerWaalsContact C-N 3.32Å; M89-I91 PolarHBondContact O-N 2.87Å; M89-F92 CarbonylContact O-C 3.6Å; M89-F92 WeakPolarHBondContact O-CB 3.5Å; M89-F92 PolarHBondContact O-N 2.93Å; M89-G93 PolarHBondContact O-N 2.76Å
90D96.3Very high94.5Very high14 Ų1452.4 Ų52.48%0.07525%0.246CC..Hα-helixtrans-58.7-45176.2-176.127.3000111.1S69 Y72 W86 L87 F92 G93 I94S69-D90 WeakPolarHBondContact CA-OD1 3.42Å; S69-D90 WeakPolarHBondContact CB-OD1 3.32Å; S69-D90 PolarHBondContact OG-OD1 3.18Å; Y72-D90 HydrophobicContact CG-CB 4.21Å; W86-D90 WeakPolarHBondContact O-CB 3.5Å; W86-D90 PolarHBondContact O-N 3.44Å; L87-D90 PolarHBondContact O-N 3.04Å; D90-F92 PolarHBondContact O-N 3.27Å; D90-G93 CarbonylContact O-C 3.47Å; D90-G93 VanDerWaalsContact O-CA 3.28Å; D90-G93 WeakPolarHBondContact O-CA 3.47Å; D90-G93 PolarHBondContact O-N 3.46Å; D90-I94 PolarHBondContact O-N 2.99Å
91I93.4Very high94.9Very high11 Ų1147.7 Ų47.76%0.05622%0.221CC..Hα-helixtrans-66.7-38.2176.4-66.9160.2000112L87 M89 G93 I94 S95 P135 F141 L153 Y157L87-I91 HydrophobicContact CD1-CD1 4.21Å; L87-I91 HydrophobicContact CG-CD1 4.07Å; L87-I91 WeakPolarHBondContact O-CD1 3.1Å; L87-I91 WeakPolarHBondContact O-CG1 3.26Å; L87-I91 PolarHBondContact O-N 3.47Å; M89-I91 VanDerWaalsContact C-N 3.32Å; M89-I91 PolarHBondContact O-N 2.87Å; I91-G93 PolarHBondContact O-N 2.88Å; I91-I94 WeakPolarHBondContact O-CB 3.49Å; I91-I94 PolarHBondContact O-N 2.7Å; I91-S95 PolarHBondContact O-N 3.45Å; I91-S95 PolarHBondContact O-OG 2.86Å; I91-P135 HydrophobicContact CG2-CB 4.47Å; I91-P135 HydrophobicContact CG2-CG 4.1Å; I91-F141 HydrophobicContact CD1-CD1 4.11Å; I91-F141 HydrophobicContact CD1-CE1 3.09Å; I91-F141 HydrophobicContact CD1-CZ 3.45Å; I91-F141 VanDerWaalsContact CD1-CZ 3.45Å; I91-L153 HydrophobicContact CD1-CD2 3.71Å; I91-L153 HydrophobicContact CG1-CD2 4.33Å; I91-L153 HydrophobicContact CG2-CD1 4.22Å; I91-L153 HydrophobicContact CG2-CD2 4.36Å; I91-Y157 HydrophobicContact CG2-CE2 3.96Å; I91-Y157 WeakPolarHBondContact CG2-OH 3.47Å; I91-Y157 PolarHBondContact O-OH 2.89Å
92F95Very high95.2Very high71 Ų7142.8 Ų42.831%0.31120%0.198SC..Hα-helixtrans-60.2-37.9169.2175.8-93.5000111.6L68 K88 M89 D90 S95 A96 P135L68-F92 HydrophobicContact CD1-CD1 3.87Å; K88-F92 WeakPolarHBondContact O-CB 3.2Å; K88-F92 PolarHBondContact O-N 3.06Å; M89-F92 CarbonylContact O-C 3.6Å; M89-F92 WeakPolarHBondContact O-CB 3.5Å; M89-F92 PolarHBondContact O-N 2.93Å; D90-F92 PolarHBondContact O-N 3.27Å; F92-S95 VanDerWaalsContact O-CB 3.32Å; F92-S95 WeakPolarHBondContact O-CB 3.33Å; F92-S95 PolarHBondContact O-N 2.97Å; F92-A96 PolarHBondContact O-N 3.06Å; F92-P135 HydrophobicContact CB-CB 4.47Å; F92-P135 HydrophobicContact CB-CG 4.2Å
93G97.3Very high95.6Very high0 Ų041.8 Ų41.80%019%0.193CC..Hα-helixtrans-59.1-46.1171.200000112.4C65 M89 D90 I91 S95 A96 G97C65-G93 WeakPolarHBondContact CA-O 3.49Å; C65-G93 WeakPolarHBondContact CB-O 3.44Å; M89-G93 PolarHBondContact O-N 2.76Å; D90-G93 CarbonylContact O-C 3.47Å; D90-G93 VanDerWaalsContact O-CA 3.28Å; D90-G93 WeakPolarHBondContact O-CA 3.47Å; D90-G93 PolarHBondContact O-N 3.46Å; I91-G93 PolarHBondContact O-N 2.88Å; G93-S95 VanDerWaalsContact C-N 3.3Å; G93-S95 PolarHBondContact O-N 3.2Å; G93-A96 PolarHBondContact O-N 2.99Å; G93-A96 VanDerWaalsContact O-N 3.15Å; G93-G97 PolarHBondContact O-N 3.29Å
94I96.4Very high95.9Very high52 Ų5235.5 Ų35.527%0.26717%0.169SC..Hα-helixtrans-57.3-44174.1-66.7166.6000110.6D90 I91 G97 L98 Y157D90-I94 PolarHBondContact O-N 2.99Å; I91-I94 WeakPolarHBondContact O-CB 3.49Å; I91-I94 PolarHBondContact O-N 2.7Å; I94-G97 PolarHBondContact O-N 3.29Å; I94-L98 VanDerWaalsContact O-CB 3.3Å; I94-L98 WeakPolarHBondContact O-CB 3.39Å; I94-L98 PolarHBondContact O-N 3.34Å; I94-Y157 HydrophobicContact CG2-CD1 4.4Å; I94-Y157 HydrophobicContact CG2-CE1 4.09Å
95S95.9Very high96.2Very high2 Ų231.5 Ų31.51%0.01415%0.153CC..Hα-helixtrans-57.9-49.1173.9-61.20000112.1I91 F92 G93 G97 L98 L99 T131 Y157I91-S95 PolarHBondContact O-N 3.45Å; I91-S95 PolarHBondContact O-OG 2.86Å; F92-S95 VanDerWaalsContact O-CB 3.32Å; F92-S95 WeakPolarHBondContact O-CB 3.33Å; F92-S95 PolarHBondContact O-N 2.97Å; G93-S95 VanDerWaalsContact C-N 3.3Å; G93-S95 PolarHBondContact O-N 3.2Å; S95-G97 PolarHBondContact O-N 2.98Å; S95-L98 PolarHBondContact O-N 3.45Å; S95-L99 WeakPolarHBondContact O-CB 3.37Å; S95-L99 VanDerWaalsContact O-CG 3.25Å; S95-L99 WeakPolarHBondContact O-CG 3.45Å; S95-L99 PolarHBondContact O-N 2.81Å; S95-T131 WeakPolarHBondContact OG-CB 3.4Å; S95-T131 PolarHBondContact OG-O 3.42Å; S95-Y157 PolarHBondContact OG-OH 2.97Å
96A97.6Very high96.5Very high19 Ų1925.3 Ų25.316%0.15713%0.126CC..Hα-helixtrans-62.2-43.418000000112.1G61 M64 F92 G93 L99 G100G61-A96 WeakPolarHBondContact CA-O 3.36Å; G61-A96 CarbonylContact O-C 3.42Å; M64-A96 HydrophobicContact CB-CB 4.09Å; F92-A96 PolarHBondContact O-N 3.06Å; G93-A96 PolarHBondContact O-N 2.99Å; G93-A96 VanDerWaalsContact O-N 3.15Å; A96-L99 PolarHBondContact O-N 3.15Å; A96-G100 PolarHBondContact O-N 3.46Å
97G98.2Very high96.7Very high0 Ų023.6 Ų23.60%012%0.12CC..Hα-helixtrans-62.3-46.5176.100000112.4G61 G93 I94 S95 L99 G100 M101G61-G97 WeakPolarHBondContact O-CA 3.45Å; G61-G97 PolarHBondContact O-N 3.44Å; G93-G97 PolarHBondContact O-N 3.29Å; I94-G97 PolarHBondContact O-N 3.29Å; S95-G97 PolarHBondContact O-N 2.98Å; G97-L99 PolarHBondContact O-N 3.18Å; G97-G100 PolarHBondContact O-N 3.28Å; G97-M101 WeakPolarHBondContact O-CG 3.27Å; G97-M101 PolarHBondContact O-N 2.94Å
98L97.4Very high96.8Very high22 Ų2221.2 Ų21.212%0.11511%0.108CC..Hα-helixtrans-60-45.9177.9179.660.2000112.1I94 S95 G100 M101 Y102 Y157 I160 I161I94-L98 VanDerWaalsContact O-CB 3.3Å; I94-L98 WeakPolarHBondContact O-CB 3.39Å; I94-L98 PolarHBondContact O-N 3.34Å; S95-L98 PolarHBondContact O-N 3.45Å; L98-G100 VanDerWaalsContact C-N 3.34Å; L98-M101 PolarHBondContact O-N 3.32Å; L98-Y102 HydrophobicContact CD1-CD2 3.98Å; L98-Y102 HydrophobicContact CD1-CE2 3.77Å; L98-Y102 HydrophobicContact CG-CD2 4.05Å; L98-Y102 HydrophobicContact CG-CE2 4.09Å; L98-Y102 WeakPolarHBondContact O-CD2 3.44Å; L98-Y102 PolarHBondContact O-N 3.39Å; L98-Y157 HydrophobicContact CD2-CD1 3.95Å; L98-Y157 HydrophobicContact CD2-CE1 4.38Å; L98-I160 HydrophobicContact CD2-CB 4.34Å; L98-I160 HydrophobicContact CD2-CG2 3.64Å; L98-I160 HydrophobicContact CG-CG2 4.44Å; L98-I161 HydrophobicContact CD1-CG1 3.82Å; L98-I161 HydrophobicContact CD2-CG1 4.22Å
99L97.7Very high97Very high20 Ų2019.2 Ų19.211%0.10510%0.103CC..Hα-helixtrans-64.6-38.8176.7-68.7168000111.9S95 A96 G97 Y102 L103 L124 I127 F128S95-L99 WeakPolarHBondContact O-CB 3.37Å; S95-L99 VanDerWaalsContact O-CG 3.25Å; S95-L99 WeakPolarHBondContact O-CG 3.45Å; S95-L99 PolarHBondContact O-N 2.81Å; A96-L99 PolarHBondContact O-N 3.15Å; G97-L99 PolarHBondContact O-N 3.18Å; L99-Y102 PolarHBondContact O-N 3.16Å; L99-L103 VanDerWaalsContact O-CB 3.28Å; L99-L103 WeakPolarHBondContact O-CB 3.42Å; L99-L103 PolarHBondContact O-N 2.95Å; L99-L124 HydrophobicContact CD2-CD1 3.43Å; L99-L124 VanDerWaalsContact CD2-CD1 3.43Å; L99-L124 HydrophobicContact CD2-CG 4.07Å; L99-I127 HydrophobicContact CD2-CB 4.34Å; L99-I127 HydrophobicContact CD2-CG2 3.9Å; L99-F128 HydrophobicContact CD1-CB 3.84Å; L99-F128 HydrophobicContact CD1-CD2 3.49Å; L99-F128 VanDerWaalsContact CD1-CD2 3.49Å; L99-F128 HydrophobicContact CD1-CG 4.15Å; L99-F128 HydrophobicContact CD2-CB 4.21Å
100G98.2Very high97Very high4 Ų415.9 Ų15.94%0.0419%0.086CC..Hα-helixtrans-63.3-41.6175.200000112.6S58 A96 G97 L98 L103 N104S58-G100 VanDerWaalsContact CB-O 3.32Å; S58-G100 WeakPolarHBondContact CB-O 3.27Å; S58-G100 PolarHBondContact OG-O 3.45Å; A96-G100 PolarHBondContact O-N 3.46Å; G97-G100 PolarHBondContact O-N 3.28Å; L98-G100 VanDerWaalsContact C-N 3.34Å; G100-L103 PolarHBondContact O-N 2.63Å; G100-N104 WeakPolarHBondContact O-CB 3.39Å; G100-N104 PolarHBondContact O-N 3.28Å
101M98.4Very high97Very high18 Ų1816.3 Ų16.39%0.0899%0.087CC..Hα-helixtrans-63.8-43.4174-68176.380.500112M62 G97 L98 G105 L193 M235 W238M62-M101 HydrophobicContact CE-CG 3.84Å; G97-M101 WeakPolarHBondContact O-CG 3.27Å; G97-M101 PolarHBondContact O-N 2.94Å; L98-M101 PolarHBondContact O-N 3.32Å; M101-G105 PolarHBondContact O-N 3.44Å; M101-L193 HydrophobicContact CE-CD1 3.47Å; M101-L193 VanDerWaalsContact CE-CD1 3.47Å; M101-M235 HydrophobicContact CE-CG 4.28Å; M101-M235 HydrophobicContact CG-CG 4.41Å; M101-M235 HydrophobicContact SD-CE 4.17Å; M101-M235 HydrophobicContact SD-CG 3.68Å; M101-W238 HydrophobicContact CE-CB 4Å; M101-W238 HydrophobicContact CE-CG 4.21Å; M101-W238 PolarHBondContact O-NE1 2.99Å
102Y98.1Very high96.9Very high20 Ų2016 Ų168%0.0789%0.086CC..Hα-helixtrans-61.4-47.1175.1-95.2-58.5000112.5L98 L99 N104 G105 I106 L124 I160 I161 G164L98-Y102 HydrophobicContact CD1-CD2 3.98Å; L98-Y102 HydrophobicContact CD1-CE2 3.77Å; L98-Y102 HydrophobicContact CG-CD2 4.05Å; L98-Y102 HydrophobicContact CG-CE2 4.09Å; L98-Y102 WeakPolarHBondContact O-CD2 3.44Å; L98-Y102 PolarHBondContact O-N 3.39Å; L99-Y102 PolarHBondContact O-N 3.16Å; Y102-N104 VanDerWaalsContact C-N 3.34Å; Y102-N104 PolarHBondContact O-N 2.96Å; Y102-G105 PolarHBondContact O-N 3.12Å; Y102-I106 HydrophobicContact CD1-CD1 3.94Å; Y102-I106 HydrophobicContact CD1-CG1 4.5Å; Y102-I106 VanDerWaalsContact O-CB 3.28Å; Y102-I106 WeakPolarHBondContact O-CB 3.4Å; Y102-I106 VanDerWaalsContact O-CG1 3.3Å; Y102-I106 WeakPolarHBondContact O-CG1 3.25Å; Y102-I106 PolarHBondContact O-N 3.2Å; Y102-L124 HydrophobicContact CD2-CD1 4.26Å; Y102-L124 HydrophobicContact CG-CD1 4Å; Y102-I160 HydrophobicContact CE2-CG2 4.06Å; Y102-I160 PolarHBondContact OH-O 3.12Å; Y102-I161 PolarHBondContact OH-O 3.39Å; Y102-I161 VanDerWaalsContact OH-O 3.06Å; Y102-G164 VanDerWaalsContact OH-CA 3.26Å; Y102-G164 WeakPolarHBondContact OH-CA 3.47Å; Y102-G164 PolarHBondContact OH-N 3.45Å
103L98.2Very high96.9Very high19 Ų1913.3 Ų13.310%0.0997%0.074CC..Hα-helixtrans-58.8-48.3-179.3178.460.6000110.7V54 L57 S58 L99 G100 G105 Y107 I121 L124V54-L103 HydrophobicContact CG1-CD1 4.05Å; V54-L103 HydrophobicContact CG1-CD2 4.28Å; V54-L103 HydrophobicContact CG1-CG 3.84Å; L57-L103 HydrophobicContact CB-CD2 3.92Å; L57-L103 HydrophobicContact CD2-CD2 3.73Å; L57-L103 HydrophobicContact CG-CD2 3.82Å; S58-L103 WeakPolarHBondContact OG-CG 3.45Å; L99-L103 VanDerWaalsContact O-CB 3.28Å; L99-L103 WeakPolarHBondContact O-CB 3.42Å; L99-L103 PolarHBondContact O-N 2.95Å; G100-L103 PolarHBondContact O-N 2.63Å; L103-G105 PolarHBondContact O-N 3.37Å; L103-Y107 WeakPolarHBondContact O-CB 3.24Å; L103-Y107 PolarHBondContact O-N 2.79Å; L103-I121 HydrophobicContact CD1-CD1 3.57Å; L103-L124 HydrophobicContact CB-CD2 3.89Å; L103-L124 HydrophobicContact CD1-CD2 4.3Å
104N97.8Very high96.7Very high1 Ų116.7 Ų16.71%0.0059%0.09CC..Hα-helixtrans-59.5-47.1176.5-175.8-102.6000112.6F55 S58 G100 Y102 T108 G242F55-N104 WeakPolarHBondContact CD1-ND2 3.44Å; F55-N104 WeakPolarHBondContact CE1-ND2 3.46Å; F55-N104 VanDerWaalsContact CZ-ND2 3.34Å; F55-N104 WeakPolarHBondContact CZ-ND2 3.2Å; S58-N104 PolarHBondContact OG-N 2.9Å; G100-N104 WeakPolarHBondContact O-CB 3.39Å; G100-N104 PolarHBondContact O-N 3.28Å; Y102-N104 VanDerWaalsContact C-N 3.34Å; Y102-N104 PolarHBondContact O-N 2.96Å; N104-T108 WeakPolarHBondContact O-CG2 3.5Å; N104-T108 PolarHBondContact O-N 3.27Å; N104-T108 PolarHBondContact O-OG1 2.97Å; N104-G242 WeakPolarHBondContact OD1-CA 3.39Å
105G97.7Very high96.5Very high10 Ų1018.5 Ų18.510%0.10310%0.1CC..Hα-helixtrans-66-49.1-179.300000113.5M101 Y102 L103 T108 A109M101-G105 PolarHBondContact O-N 3.44Å; Y102-G105 PolarHBondContact O-N 3.12Å; L103-G105 PolarHBondContact O-N 3.37Å; G105-T108 PolarHBondContact O-N 3.25Å; G105-T108 PolarHBondContact O-OG1 2.95Å; G105-A109 WeakPolarHBondContact O-CB 3.14Å; G105-A109 PolarHBondContact O-N 3.42Å
106I98.1Very high96.5Very high6 Ų620.8 Ų20.83%0.03111%0.111CC..Hα-helixtrans-64.2-44.3179.9-71.3164.1000110.3Y102 T108 A109 F110 L117 Y120 I121Y102-I106 HydrophobicContact CD1-CD1 3.94Å; Y102-I106 HydrophobicContact CD1-CG1 4.5Å; Y102-I106 VanDerWaalsContact O-CB 3.28Å; Y102-I106 WeakPolarHBondContact O-CB 3.4Å; Y102-I106 VanDerWaalsContact O-CG1 3.3Å; Y102-I106 WeakPolarHBondContact O-CG1 3.25Å; Y102-I106 PolarHBondContact O-N 3.2Å; I106-T108 VanDerWaalsContact C-N 3.34Å; I106-T108 PolarHBondContact O-N 3Å; I106-A109 PolarHBondContact O-N 3.29Å; I106-F110 HydrophobicContact CG2-CD2 4.15Å; I106-F110 WeakPolarHBondContact O-CD2 3.23Å; I106-F110 PolarHBondContact O-N 2.92Å; I106-L117 HydrophobicContact CG2-CD1 3.77Å; I106-Y120 HydrophobicContact CG2-CG 4.44Å; I106-I121 HydrophobicContact CG2-CD1 4.41Å
107Y97.7Very high96.5Very high22 Ų2220.4 Ų20.49%0.08611%0.106CC..Hα-helixtrans-60.7-44.8-179.5-176.1-105.1000112.4D51 V54 F55 L103 F111 L117D51-Y107 WeakPolarHBondContact OD1-CE1 3.33Å; D51-Y107 PolarHBondContact OD1-OH 3.27Å; V54-Y107 HydrophobicContact CB-CD1 4.28Å; V54-Y107 HydrophobicContact CB-CD2 4.27Å; V54-Y107 HydrophobicContact CB-CE1 4.37Å; V54-Y107 HydrophobicContact CB-CE2 4.37Å; V54-Y107 HydrophobicContact CB-CG 4.21Å; V54-Y107 HydrophobicContact CG1-CD1 3.78Å; V54-Y107 HydrophobicContact CG1-CD2 3.92Å; V54-Y107 HydrophobicContact CG1-CE1 4.37Å; V54-Y107 HydrophobicContact CG1-CG 3.52Å; V54-Y107 HydrophobicContact CG2-CD2 3.85Å; V54-Y107 HydrophobicContact CG2-CE2 3.83Å; V54-Y107 HydrophobicContact CG2-CG 4.3Å; F55-Y107 HydrophobicContact CE2-CD1 4.02Å; F55-Y107 HydrophobicContact CE2-CE1 4.29Å; L103-Y107 WeakPolarHBondContact O-CB 3.24Å; L103-Y107 PolarHBondContact O-N 2.79Å; Y107-F111 PolarHBondContact O-N 3.42Å; Y107-L117 HydrophobicContact CD2-CD1 4.34Å; Y107-L117 HydrophobicContact CD2-CD2 4.04Å; Y107-L117 HydrophobicContact CE2-CD2 4.31Å
108T96.3Very high96.4Very high4 Ų423.6 Ų23.63%0.02513%0.125CC..Hα-helixtrans-75.2-41.4179.652.50000111.9F55 N104 G105 I106 F110 F111 L246 Y249F55-T108 HydrophobicContact CE2-CG2 4.12Å; F55-T108 HydrophobicContact CZ-CG2 3.77Å; N104-T108 WeakPolarHBondContact O-CG2 3.5Å; N104-T108 PolarHBondContact O-N 3.27Å; N104-T108 PolarHBondContact O-OG1 2.97Å; G105-T108 PolarHBondContact O-N 3.25Å; G105-T108 PolarHBondContact O-OG1 2.95Å; I106-T108 VanDerWaalsContact C-N 3.34Å; I106-T108 PolarHBondContact O-N 3Å; T108-F110 PolarHBondContact O-N 2.99Å; T108-F111 WeakPolarHBondContact O-CB 3.04Å; T108-F111 PolarHBondContact O-N 3.24Å; T108-L246 HydrophobicContact CG2-CB 4.22Å; T108-Y249 WeakPolarHBondContact O-CE2 3.26Å
109A96.1Very high96.3Very high17 Ų1725.7 Ų25.714%0.1414%0.142CC..Hα-helixtrans-61.8-44.8179.100000112.7G105 I106 W171G105-A109 WeakPolarHBondContact O-CB 3.14Å; G105-A109 PolarHBondContact O-N 3.42Å; I106-A109 PolarHBondContact O-N 3.29Å; A109-W171 HydrophobicContact CB-CB 4.47Å; A109-W171 HydrophobicContact CB-CG 4.08Å; A109-W171 PolarHBondContact O-NE1 3.49Å
110F96.5Very high96.3Very high1 Ų125.6 Ų25.60%0.00414%0.141CC..THydrogen-bonded Turntrans-100.122.1-176.4-61.3-83000113I106 T108 C112 F113 H116 L117 Y120 P167 H170 W171 L174I106-F110 HydrophobicContact CG2-CD2 4.15Å; I106-F110 WeakPolarHBondContact O-CD2 3.23Å; I106-F110 PolarHBondContact O-N 2.92Å; T108-F110 PolarHBondContact O-N 2.99Å; F110-C112 PolarHBondContact O-N 2.92Å; F110-C112 VanDerWaalsContact O-N 3.16Å; F110-F113 HydrophobicContact CB-CB 4.38Å; F110-F113 HydrophobicContact CD1-CB 4.21Å; F110-F113 CarbonylContact O-C 3.59Å; F110-F113 PolarHBondContact O-N 3Å; F110-H116 HydrophobicContact CD1-CB 3.79Å; F110-H116 HydrophobicContact CE1-CB 4.25Å; F110-H116 HydrophobicContact CG-CB 4.49Å; F110-L117 HydrophobicContact CB-CB 3.76Å; F110-L117 HydrophobicContact CB-CD1 4.45Å; F110-Y120 HydrophobicContact CD1-CE2 4.48Å; F110-Y120 AromaticContact CD2-CD2 3.95Å; F110-Y120 HydrophobicContact CD2-CD2 3.95Å; F110-Y120 HydrophobicContact CD2-CE2 4.38Å; F110-Y120 HydrophobicContact CE1-CD2 4.18Å; F110-Y120 AromaticContact CE1-CE2 3.75Å; F110-Y120 HydrophobicContact CE1-CE2 3.75Å; F110-Y120 AromaticContact CE2-CD2 3.59Å; F110-Y120 HydrophobicContact CE2-CD2 3.59Å; F110-Y120 AromaticContact CE2-CE2 3.64Å; F110-Y120 HydrophobicContact CE2-CE2 3.64Å; F110-Y120 HydrophobicContact CE2-CG 4.41Å; F110-Y120 HydrophobicContact CG-CD2 4.41Å; F110-Y120 AromaticContact CZ-CD2 3.71Å; F110-Y120 HydrophobicContact CZ-CD2 3.71Å; F110-Y120 AromaticContact CZ-CE2 3.28Å; F110-Y120 HydrophobicContact CZ-CE2 3.28Å; F110-P167 HydrophobicContact CE2-CB 3.76Å; F110-P167 HydrophobicContact CZ-CB 4.02Å; F110-P167 WeakPolarHBondContact CZ-O 3.41Å; F110-H170 HydrophobicContact CZ-CB 4.41Å; F110-W171 HydrophobicContact CE1-CB 4.48Å; F110-W171 HydrophobicContact CZ-CB 4.19Å; F110-L174 HydrophobicContact CD1-CD1 4.05Å; F110-L174 HydrophobicContact CE1-CD1 3.74Å
111F94.4Very high96.3Very high23 Ų2327.9 Ų27.910%0.10115%0.151CC..THydrogen-bonded Turntrans-51.2-40.6179-179-91.3000112.6Y107 T108 Q114 L246 Y249 R250Y107-F111 PolarHBondContact O-N 3.42Å; T108-F111 WeakPolarHBondContact O-CB 3.04Å; T108-F111 PolarHBondContact O-N 3.24Å; F111-Q114 PolarHBondContact O-NE2 3.48Å; F111-L246 HydrophobicContact CD2-CD1 4Å; F111-L246 HydrophobicContact CE2-CD1 3.86Å; F111-Y249 HydrophobicContact CB-CD2 4.09Å; F111-Y249 HydrophobicContact CB-CE2 4.12Å; F111-Y249 HydrophobicContact CD1-CD1 4.3Å; F111-Y249 HydrophobicContact CD1-CD2 4.32Å; F111-Y249 AromaticContact CD1-CG 3.98Å; F111-Y249 HydrophobicContact CD1-CG 3.98Å; F111-Y249 HydrophobicContact CG-CD2 4.21Å; F111-Y249 HydrophobicContact CG-CG 4.33Å; F111-R250 VanDerWaalsContact CZ-CZ 3.47Å
112C93.1Very high96.2Very high6 Ų634.9 Ų34.94%0.04118%0.178CC..THydrogen-bonded Turntrans-90.31.1178.3-64.60000114.8F110 C256 I260F110-C112 PolarHBondContact O-N 2.92Å; F110-C112 VanDerWaalsContact O-N 3.16Å; C112-C256 WeakPolarHBondContact CA-SG 3.24Å; C112-C256 HydrophobicContact CB-CB 3.6Å; C112-C256 WeakPolarHBondContact CB-SG 3.45Å; C112-C256 WeakPolarHBondContact SG-CA 3.32Å; C112-C256 WeakPolarHBondContact SG-CB 3.35Å; C112-C256 CovalentContact SG-SG 2.04Å; C112-C256 PolarHBondContact SG-SG 3.48Å; C112-I260 HydrophobicContact CB-CD1 3.56Å; C112-I260 HydrophobicContact CB-CG1 4.43Å
113F94.4Very high96.1Very high14 Ų1437.4 Ų37.46%0.06119%0.192CC..  trans-128.869.6-173.3-59.3-81.6000110.4F110 D115 H116 L117 L174 H175 I260F110-F113 HydrophobicContact CB-CB 4.38Å; F110-F113 HydrophobicContact CD1-CB 4.21Å; F110-F113 CarbonylContact O-C 3.59Å; F110-F113 PolarHBondContact O-N 3Å; F113-D115 PolarHBondContact O-N 2.93Å; F113-H116 HydrophobicContact CB-CB 4.12Å; F113-H116 WeakPolarHBondContact O-CB 3.42Å; F113-H116 PolarHBondContact O-N 2.88Å; F113-L117 PolarHBondContact O-N 3.05Å; F113-L174 HydrophobicContact CB-CD1 4.46Å; F113-L174 HydrophobicContact CD1-CD1 4.08Å; F113-L174 HydrophobicContact CD1-CD2 4.47Å; F113-L174 HydrophobicContact CD2-CD1 4.19Å; F113-L174 HydrophobicContact CE1-CB 3.93Å; F113-L174 HydrophobicContact CE1-CD1 4.32Å; F113-L174 HydrophobicContact CE1-CD2 4.31Å; F113-L174 HydrophobicContact CE1-CG 4.42Å; F113-L174 HydrophobicContact CE2-CB 4.05Å; F113-L174 HydrophobicContact CE2-CD1 4.44Å; F113-L174 HydrophobicContact CG-CD1 3.99Å; F113-L174 HydrophobicContact CZ-CB 3.65Å; F113-L174 HydrophobicContact CZ-CD1 4.48Å; F113-H175 AromaticContact CE2-CE1 3.45Å; F113-H175 VanDerWaalsContact CE2-CE1 3.45Å; F113-H175 WeakPolarHBondContact CE2-CE1 3.42Å; F113-H175 AromaticContact CE2-ND1 3.99Å; F113-H175 AromaticContact CE2-NE2 3.87Å; F113-I260 HydrophobicContact CD1-CD1 4.46Å; F113-I260 HydrophobicContact CE1-CD1 3.73Å; F113-I260 HydrophobicContact CE1-CG1 4.24Å; F113-I260 HydrophobicContact CE1-CG2 4.36Å; F113-I260 HydrophobicContact CE2-CD1 3.93Å; F113-I260 HydrophobicContact CE2-CG1 4.09Å; F113-I260 HydrophobicContact CZ-CB 4.5Å; F113-I260 HydrophobicContact CZ-CD1 3.44Å; F113-I260 VanDerWaalsContact CZ-CD1 3.44Å; F113-I260 HydrophobicContact CZ-CG1 3.55Å; F113-I260 HydrophobicContact CZ-CG2 4.2Å
114Q92.2Very high95.9Very high70 Ų7037.2 Ų37.233%0.32719%0.191SC..Hα-helixtrans-57.8-41.2-168.4-67-61.4-42.900113.9F111 H116 L117 T118F111-Q114 PolarHBondContact O-NE2 3.48Å; Q114-H116 PolarHBondContact O-N 3.26Å; Q114-L117 WeakPolarHBondContact O-CB 3.36Å; Q114-L117 PolarHBondContact O-N 3.5Å; Q114-T118 PolarHBondContact O-N 3.48Å; Q114-T118 PolarHBondContact O-OG1 3.4Å; Q114-T118 VanDerWaalsContact O-OG1 3.12Å
115D93.8Very high95.8Very high91 Ų9141.8 Ų41.849%0.48722%0.215SC..Hα-helixtrans-62.1-35.9178.4-60.5-33000112.3F113 S119F113-D115 PolarHBondContact O-N 2.93Å; D115-S119 PolarHBondContact O-N 3.48Å; D115-S119 VanDerWaalsContact O-N 3.1Å; D115-S119 PolarHBondContact O-OG 3.41Å
116H95.8Very high95.6Very high50 Ų5043 Ų4323%0.23123%0.228CC..Hα-helixtrans-78.7-41-178.4-61.844.1000109.9F110 F113 Q114 T118 S119 Y120 H170F110-H116 HydrophobicContact CD1-CB 3.79Å; F110-H116 HydrophobicContact CE1-CB 4.25Å; F110-H116 HydrophobicContact CG-CB 4.49Å; F113-H116 HydrophobicContact CB-CB 4.12Å; F113-H116 WeakPolarHBondContact O-CB 3.42Å; F113-H116 PolarHBondContact O-N 2.88Å; Q114-H116 PolarHBondContact O-N 3.26Å; H116-T118 PolarHBondContact O-N 3.2Å; H116-S119 WeakPolarHBondContact O-CB 3.07Å; H116-S119 PolarHBondContact O-N 2.74Å; H116-Y120 WeakPolarHBondContact O-CD2 3.42Å; H116-Y120 PolarHBondContact O-N 3.32Å; H116-H170 AromaticContact CD2-CE1 3.28Å; H116-H170 PolarHBondContact CD2-CE1 3.22Å; H116-H170 AromaticContact CD2-NE2 3.43Å; H116-H170 PolarHBondContact CD2-NE2 2.96Å; H116-H170 AromaticContact NE2-CE1 3.96Å; H116-H170 AromaticContact NE2-NE2 3.79Å
117L96.6Very high95.4Very high10 Ų1043.6 Ų43.65%0.05223%0.23CC..Hα-helixtrans-52.7-54.517017455.2000110.4I106 Y107 F110 F113 Q114 S119 Y120 I121I106-L117 HydrophobicContact CG2-CD1 3.77Å; Y107-L117 HydrophobicContact CD2-CD1 4.34Å; Y107-L117 HydrophobicContact CD2-CD2 4.04Å; Y107-L117 HydrophobicContact CE2-CD2 4.31Å; F110-L117 HydrophobicContact CB-CB 3.76Å; F110-L117 HydrophobicContact CB-CD1 4.45Å; F113-L117 PolarHBondContact O-N 3.05Å; Q114-L117 WeakPolarHBondContact O-CB 3.36Å; Q114-L117 PolarHBondContact O-N 3.5Å; L117-S119 VanDerWaalsContact C-N 3.31Å; L117-S119 PolarHBondContact O-N 3Å; L117-Y120 PolarHBondContact O-N 2.93Å; L117-I121 HydrophobicContact CD1-CD1 4.34Å; L117-I121 HydrophobicContact CD1-CG1 4Å; L117-I121 WeakPolarHBondContact O-CG1 3.45Å; L117-I121 PolarHBondContact O-N 3.31Å
118T95.6Very high95.2Very high67 Ų6747.3 Ų47.341%0.41125%0.247SC..Hα-helixtrans-56.9-44.1178.7-63.60000112Q114 H116 Y120 I121 Y122Q114-T118 PolarHBondContact O-N 3.48Å; Q114-T118 PolarHBondContact O-OG1 3.4Å; Q114-T118 VanDerWaalsContact O-OG1 3.12Å; H116-T118 PolarHBondContact O-N 3.2Å; T118-Y120 PolarHBondContact O-N 2.91Å; T118-I121 PolarHBondContact O-N 2.87Å; T118-Y122 HydrophobicContact CG2-CD2 3.93Å; T118-Y122 HydrophobicContact CG2-CE2 3.45Å; T118-Y122 VanDerWaalsContact CG2-CE2 3.45Å; T118-Y122 WeakPolarHBondContact O-CD2 3.26Å; T118-Y122 PolarHBondContact O-N 3.27Å
119S96.8Very high95Very high67 Ų6751.8 Ų51.847%0.46928%0.275SS..Hα-helixtrans-59.6-46.5177-61.10000112.2D115 H116 L117 I121 Y122 I123D115-S119 PolarHBondContact O-N 3.48Å; D115-S119 VanDerWaalsContact O-N 3.1Å; D115-S119 PolarHBondContact O-OG 3.41Å; H116-S119 WeakPolarHBondContact O-CB 3.07Å; H116-S119 PolarHBondContact O-N 2.74Å; L117-S119 VanDerWaalsContact C-N 3.31Å; L117-S119 PolarHBondContact O-N 3Å; S119-I121 VanDerWaalsContact C-N 3.35Å; S119-I121 PolarHBondContact O-N 3.28Å; S119-Y122 PolarHBondContact O-N 2.74Å; S119-I123 WeakPolarHBondContact O-CG1 3.21Å; S119-I123 PolarHBondContact O-N 3.31Å; S119-I123 VanDerWaalsContact O-N 3.12Å
120Y97.8Very high94.7Very high18 Ų1855.3 Ų55.37%0.07129%0.29CS..Hα-helixtrans-69.2-30.6177.9-78.7-65.3000113.2I106 F110 H116 L117 T118 I123 L124 F163 P167 H170I106-Y120 HydrophobicContact CG2-CG 4.44Å; F110-Y120 HydrophobicContact CD1-CE2 4.48Å; F110-Y120 AromaticContact CD2-CD2 3.95Å; F110-Y120 HydrophobicContact CD2-CD2 3.95Å; F110-Y120 HydrophobicContact CD2-CE2 4.38Å; F110-Y120 HydrophobicContact CE1-CD2 4.18Å; F110-Y120 AromaticContact CE1-CE2 3.75Å; F110-Y120 HydrophobicContact CE1-CE2 3.75Å; F110-Y120 AromaticContact CE2-CD2 3.59Å; F110-Y120 HydrophobicContact CE2-CD2 3.59Å; F110-Y120 AromaticContact CE2-CE2 3.64Å; F110-Y120 HydrophobicContact CE2-CE2 3.64Å; F110-Y120 HydrophobicContact CE2-CG 4.41Å; F110-Y120 HydrophobicContact CG-CD2 4.41Å; F110-Y120 AromaticContact CZ-CD2 3.71Å; F110-Y120 HydrophobicContact CZ-CD2 3.71Å; F110-Y120 AromaticContact CZ-CE2 3.28Å; F110-Y120 HydrophobicContact CZ-CE2 3.28Å; H116-Y120 WeakPolarHBondContact O-CD2 3.42Å; H116-Y120 PolarHBondContact O-N 3.32Å; L117-Y120 PolarHBondContact O-N 2.93Å; T118-Y120 PolarHBondContact O-N 2.91Å; Y120-I123 HydrophobicContact CD1-CD1 4.06Å; Y120-I123 HydrophobicContact CE1-CD1 4.39Å; Y120-I123 PolarHBondContact O-N 3.09Å; Y120-L124 WeakPolarHBondContact O-CB 3.22Å; Y120-L124 PolarHBondContact O-N 2.95Å; Y120-F163 HydrophobicContact CD1-CZ 4.36Å; Y120-F163 HydrophobicContact CE1-CZ 4.18Å; Y120-P167 HydrophobicContact CD1-CB 4.19Å; Y120-P167 HydrophobicContact CE1-CB 3.76Å; Y120-P167 HydrophobicContact CE1-CG 4.28Å; Y120-P167 HydrophobicContact CE2-CB 4.23Å; Y120-H170 AromaticContact CE2-ND1 3.59Å; Y120-H170 AromaticContact CZ-ND1 3.68Å; Y120-H170 PolarHBondContact OH-ND1 3.06Å
121I96.5Very high94.4Very high51 Ų5155.3 Ų55.326%0.26229%0.29SS..Hα-helixtrans-64.8-42.1172-67.4-59.8000111L103 I106 L117 T118 S119 I123 L124 L125L103-I121 HydrophobicContact CD1-CD1 3.57Å; I106-I121 HydrophobicContact CG2-CD1 4.41Å; L117-I121 HydrophobicContact CD1-CD1 4.34Å; L117-I121 HydrophobicContact CD1-CG1 4Å; L117-I121 WeakPolarHBondContact O-CG1 3.45Å; L117-I121 PolarHBondContact O-N 3.31Å; T118-I121 PolarHBondContact O-N 2.87Å; S119-I121 VanDerWaalsContact C-N 3.35Å; S119-I121 PolarHBondContact O-N 3.28Å; I121-I123 VanDerWaalsContact C-N 3.33Å; I121-I123 PolarHBondContact O-N 2.89Å; I121-L124 WeakPolarHBondContact O-CB 3.39Å; I121-L124 PolarHBondContact O-N 3.09Å; I121-L125 WeakPolarHBondContact O-CG 3.24Å; I121-L125 PolarHBondContact O-N 3.38Å
122Y96.3Very high94Very high165 Ų16555.8 Ų55.865%0.64730%0.298SS*.Hα-helixtrans-62.1-40.3173.9-74.1-58.7000112.6T118 S119 L124 L125 G126T118-Y122 HydrophobicContact CG2-CD2 3.93Å; T118-Y122 HydrophobicContact CG2-CE2 3.45Å; T118-Y122 VanDerWaalsContact CG2-CE2 3.45Å; T118-Y122 WeakPolarHBondContact O-CD2 3.26Å; T118-Y122 PolarHBondContact O-N 3.27Å; S119-Y122 PolarHBondContact O-N 2.74Å; Y122-L124 VanDerWaalsContact C-N 3.32Å; Y122-L124 PolarHBondContact O-N 2.84Å; Y122-L125 HydrophobicContact CD1-CD1 4.26Å; Y122-L125 PolarHBondContact O-N 2.94Å; Y122-G126 PolarHBondContact O-N 3.19Å; Y122-G126 VanDerWaalsContact O-N 3.12Å
123I96Very high93.8Very high73 Ų7361.2 Ų61.237%0.37432%0.318SS..Hα-helixtrans-62-43.2173.7-64.6167.9000110.5S119 Y120 I121 L125 G126 I127 F163S119-I123 WeakPolarHBondContact O-CG1 3.21Å; S119-I123 PolarHBondContact O-N 3.31Å; S119-I123 VanDerWaalsContact O-N 3.12Å; Y120-I123 HydrophobicContact CD1-CD1 4.06Å; Y120-I123 HydrophobicContact CE1-CD1 4.39Å; Y120-I123 PolarHBondContact O-N 3.09Å; I121-I123 VanDerWaalsContact C-N 3.33Å; I121-I123 PolarHBondContact O-N 2.89Å; I123-L125 VanDerWaalsContact C-N 3.31Å; I123-L125 PolarHBondContact O-N 3.44Å; I123-G126 WeakPolarHBondContact O-CA 3.3Å; I123-G126 PolarHBondContact O-N 2.88Å; I123-I127 HydrophobicContact CG2-CD1 4.11Å; I123-I127 WeakPolarHBondContact O-CG1 3.29Å; I123-I127 PolarHBondContact O-N 3.01Å; I123-F163 HydrophobicContact CD1-CZ 4.3Å; I123-F163 HydrophobicContact CG2-CE1 3.85Å; I123-F163 HydrophobicContact CG2-CE2 4.48Å; I123-F163 HydrophobicContact CG2-CZ 3.66Å
124L95.5Very high93.4Very high15 Ų1560.7 Ų60.78%0.07932%0.316CS..Hα-helixtrans-63.1-36.6178.7-170.761.1000112.3L99 Y102 L103 Y120 I121 Y122 G126 I127 F128L99-L124 HydrophobicContact CD2-CD1 3.43Å; L99-L124 VanDerWaalsContact CD2-CD1 3.43Å; L99-L124 HydrophobicContact CD2-CG 4.07Å; Y102-L124 HydrophobicContact CD2-CD1 4.26Å; Y102-L124 HydrophobicContact CG-CD1 4Å; L103-L124 HydrophobicContact CB-CD2 3.89Å; L103-L124 HydrophobicContact CD1-CD2 4.3Å; Y120-L124 WeakPolarHBondContact O-CB 3.22Å; Y120-L124 PolarHBondContact O-N 2.95Å; I121-L124 WeakPolarHBondContact O-CB 3.39Å; I121-L124 PolarHBondContact O-N 3.09Å; Y122-L124 VanDerWaalsContact C-N 3.32Å; Y122-L124 PolarHBondContact O-N 2.84Å; L124-G126 VanDerWaalsContact C-N 3.34Å; L124-I127 PolarHBondContact O-N 2.74Å; L124-F128 PolarHBondContact O-N 2.54Å
125L93.9Very high93Very high97 Ų9757.8 Ų57.851%0.50830%0.304SS..Hα-helixtrans-62.8-40.1171.5-69.9173.8000111.9I121 Y122 I123 F128 V129I121-L125 WeakPolarHBondContact O-CG 3.24Å; I121-L125 PolarHBondContact O-N 3.38Å; Y122-L125 HydrophobicContact CD1-CD1 4.26Å; Y122-L125 PolarHBondContact O-N 2.94Å; I123-L125 VanDerWaalsContact C-N 3.31Å; I123-L125 PolarHBondContact O-N 3.44Å; L125-F128 WeakPolarHBondContact O-CB 3.32Å; L125-F128 PolarHBondContact O-N 2.9Å; L125-V129 PolarHBondContact O-N 3.21Å; L125-V129 VanDerWaalsContact O-N 3.11Å
126G94.6Very high92.5Very high36 Ų3657.5 Ų57.537%0.37131%0.305SS..Hα-helixtrans-61.4-44.2172.400000112.5Y122 I123 L124 F128 V129 I130Y122-G126 PolarHBondContact O-N 3.19Å; Y122-G126 VanDerWaalsContact O-N 3.12Å; I123-G126 WeakPolarHBondContact O-CA 3.3Å; I123-G126 PolarHBondContact O-N 2.88Å; L124-G126 VanDerWaalsContact C-N 3.34Å; G126-F128 VanDerWaalsContact C-N 3.29Å; G126-F128 PolarHBondContact O-N 3.15Å; G126-V129 PolarHBondContact O-N 3.4Å; G126-I130 PolarHBondContact O-N 3.1Å
127I94.1Very high91.8Very high18 Ų1859.7 Ų59.79%0.09231%0.311CS..Hα-helixtrans-62.2-38.2174.5-64.9169.5000110.7L99 I123 L124 V129 I130 T131 I160 F163L99-I127 HydrophobicContact CD2-CB 4.34Å; L99-I127 HydrophobicContact CD2-CG2 3.9Å; I123-I127 HydrophobicContact CG2-CD1 4.11Å; I123-I127 WeakPolarHBondContact O-CG1 3.29Å; I123-I127 PolarHBondContact O-N 3.01Å; L124-I127 PolarHBondContact O-N 2.74Å; I127-V129 PolarHBondContact O-N 3.28Å; I127-I130 PolarHBondContact O-N 2.94Å; I127-T131 HydrophobicContact CG2-CG2 3.93Å; I127-T131 WeakPolarHBondContact O-CB 3.25Å; I127-T131 VanDerWaalsContact O-CG2 3.32Å; I127-T131 WeakPolarHBondContact O-CG2 3.5Å; I127-T131 PolarHBondContact O-N 3.22Å; I127-T131 PolarHBondContact O-OG1 3.31Å; I127-I160 HydrophobicContact CD1-CG2 4.48Å; I127-I160 HydrophobicContact CG2-CD1 4.33Å; I127-I160 HydrophobicContact CG2-CG1 4.35Å; I127-I160 HydrophobicContact CG2-CG2 3.57Å; I127-F163 HydrophobicContact CD1-CD1 4.02Å; I127-F163 HydrophobicContact CD1-CE1 4.24Å
128F92.3Very high90.7Very high101 Ų10163.6 Ų63.644%0.44333%0.329SS..Hα-helixtrans-59-45.9174.7168-104.3000111.8L99 L124 L125 G126 I130 T131 A132L99-F128 HydrophobicContact CD1-CB 3.84Å; L99-F128 HydrophobicContact CD1-CD2 3.49Å; L99-F128 VanDerWaalsContact CD1-CD2 3.49Å; L99-F128 HydrophobicContact CD1-CG 4.15Å; L99-F128 HydrophobicContact CD2-CB 4.21Å; L124-F128 PolarHBondContact O-N 2.54Å; L125-F128 WeakPolarHBondContact O-CB 3.32Å; L125-F128 PolarHBondContact O-N 2.9Å; G126-F128 VanDerWaalsContact C-N 3.29Å; G126-F128 PolarHBondContact O-N 3.15Å; F128-I130 VanDerWaalsContact C-N 3.32Å; F128-I130 PolarHBondContact O-N 3.25Å; F128-T131 WeakPolarHBondContact CA-OG1 3.32Å; F128-T131 PolarHBondContact O-N 2.75Å; F128-T131 PolarHBondContact O-OG1 2.85Å; F128-A132 HydrophobicContact CE2-CB 4.37Å; F128-A132 HydrophobicContact CZ-CB 4.45Å; F128-A132 WeakPolarHBondContact O-CB 3.32Å; F128-A132 PolarHBondContact O-N 2.82Å
129V92Very high89.5Confident98 Ų9863.6 Ų63.659%0.59433%0.327SS*.Hα-helixtrans-58.9-45.2177.7174.90000111.1L125 G126 I127 Y133L125-V129 PolarHBondContact O-N 3.21Å; L125-V129 VanDerWaalsContact O-N 3.11Å; G126-V129 PolarHBondContact O-N 3.4Å; I127-V129 PolarHBondContact O-N 3.28Å; V129-Y133 WeakPolarHBondContact O-CB 3.41Å; V129-Y133 PolarHBondContact O-N 2.94Å
130I90.9Very high88.2Confident90 Ų9062.4 Ų62.446%0.46231%0.314SS..Hα-helixtrans-63.1-50.8178.4-64164.7000110.5G126 I127 F128 A132 Y133 V134G126-I130 PolarHBondContact O-N 3.1Å; I127-I130 PolarHBondContact O-N 2.94Å; F128-I130 VanDerWaalsContact C-N 3.32Å; F128-I130 PolarHBondContact O-N 3.25Å; I130-A132 VanDerWaalsContact C-N 3.3Å; I130-A132 PolarHBondContact O-N 3.43Å; I130-Y133 PolarHBondContact O-N 3.2Å; I130-Y133 VanDerWaalsContact O-N 3.16Å; I130-V134 HydrophobicContact CG2-CG2 4.23Å; I130-V134 VanDerWaalsContact O-CG2 3.26Å; I130-V134 WeakPolarHBondContact O-CG2 3.46Å; I130-V134 PolarHBondContact O-N 3.24Å
131T89.1Confident86.9Confident2 Ų264 Ų641%0.01232%0.321CS..Hα-helixtrans-73-20.1-174.955.20000113.7S95 I127 F128 P135 Y157 I160S95-T131 WeakPolarHBondContact OG-CB 3.4Å; S95-T131 PolarHBondContact OG-O 3.42Å; I127-T131 HydrophobicContact CG2-CG2 3.93Å; I127-T131 WeakPolarHBondContact O-CB 3.25Å; I127-T131 VanDerWaalsContact O-CG2 3.32Å; I127-T131 WeakPolarHBondContact O-CG2 3.5Å; I127-T131 PolarHBondContact O-N 3.22Å; I127-T131 PolarHBondContact O-OG1 3.31Å; F128-T131 WeakPolarHBondContact CA-OG1 3.32Å; F128-T131 PolarHBondContact O-N 2.75Å; F128-T131 PolarHBondContact O-OG1 2.85Å; T131-P135 WeakPolarHBondContact O-CD 3.01Å; T131-P135 WeakPolarHBondContact O-CG 3.16Å; T131-Y157 HydrophobicContact CG2-CE1 4.42Å; T131-I160 HydrophobicContact CG2-CD1 3.45Å; T131-I160 VanDerWaalsContact CG2-CD1 3.45Å
132A87.6Confident85.5Confident32 Ų3268.7 Ų68.726%0.26434%0.342SS..Hα-helixtrans-79.9-33.4168.800000112.3F128 I130F128-A132 HydrophobicContact CE2-CB 4.37Å; F128-A132 HydrophobicContact CZ-CB 4.45Å; F128-A132 WeakPolarHBondContact O-CB 3.32Å; F128-A132 PolarHBondContact O-N 2.82Å; I130-A132 VanDerWaalsContact C-N 3.3Å; I130-A132 PolarHBondContact O-N 3.43Å
133Y88.3Confident84.1Confident120 Ų12068.8 Ų68.847%0.47134%0.341SS..Hα-helixtrans-74.3-43.5177.8175.6-104.9000112.7V129 I130 T136 R137 F140V129-Y133 WeakPolarHBondContact O-CB 3.41Å; V129-Y133 PolarHBondContact O-N 2.94Å; I130-Y133 PolarHBondContact O-N 3.2Å; I130-Y133 VanDerWaalsContact O-N 3.16Å; Y133-T136 WeakPolarHBondContact O-CB 3.24Å; Y133-T136 WeakPolarHBondContact O-CG2 3.47Å; Y133-T136 PolarHBondContact O-N 2.82Å; Y133-T136 PolarHBondContact O-OG1 3.48Å; Y133-R137 HydrophobicContact CD1-CG 4.25Å; Y133-R137 HydrophobicContact CE1-CG 3.6Å; Y133-R137 HydrophobicContact CE2-CG 4.23Å; Y133-R137 VanDerWaalsContact OH-CD 3.3Å; Y133-R137 WeakPolarHBondContact OH-CD 3.41Å; Y133-F140 HydrophobicContact CE1-CE2 4.35Å
134V86.6Confident82.8Confident3 Ų372.1 Ų72.12%0.01835%0.353CS..G310 helixtrans-50.2-47.2-174.31610000114.1I130 T136 R137 F140 L153 I156I130-V134 HydrophobicContact CG2-CG2 4.23Å; I130-V134 VanDerWaalsContact O-CG2 3.26Å; I130-V134 WeakPolarHBondContact O-CG2 3.46Å; I130-V134 PolarHBondContact O-N 3.24Å; V134-T136 PolarHBondContact O-N 3.11Å; V134-T136 VanDerWaalsContact O-N 3.12Å; V134-R137 PolarHBondContact O-N 3.38Å; V134-F140 HydrophobicContact CB-CD2 4.41Å; V134-F140 HydrophobicContact CG1-CD2 4.19Å; V134-F140 HydrophobicContact CG2-CD2 4.24Å; V134-F140 HydrophobicContact CG2-CE2 4.08Å; V134-L153 HydrophobicContact CG1-CD1 3.16Å; V134-I156 HydrophobicContact CG2-CD1 4.24Å; V134-I156 HydrophobicContact CG2-CG2 4.32Å
135P84Confident81.6Confident9 Ų975.7 Ų75.76%0.05837%0.371CS..G310 helixtrans-62.4-19.2178.7-2130.6000114.7K88 I91 F92 T131 R137K88-P135 WeakPolarHBondContact CD-O 3.37Å; K88-P135 WeakPolarHBondContact CG-O 3.4Å; I91-P135 HydrophobicContact CG2-CB 4.47Å; I91-P135 HydrophobicContact CG2-CG 4.1Å; F92-P135 HydrophobicContact CB-CB 4.47Å; F92-P135 HydrophobicContact CB-CG 4.2Å; T131-P135 WeakPolarHBondContact O-CD 3.01Å; T131-P135 WeakPolarHBondContact O-CG 3.16Å; P135-R137 VanDerWaalsContact C-N 3.33Å
136T82.9Confident79.7Confident85 Ų8579.3 Ų79.352%0.52139%0.389SS..G310 helixtrans-76.2-22.2-179.873.60000112.7Y133 V134Y133-T136 WeakPolarHBondContact O-CB 3.24Å; Y133-T136 WeakPolarHBondContact O-CG2 3.47Å; Y133-T136 PolarHBondContact O-N 2.82Å; Y133-T136 PolarHBondContact O-OG1 3.48Å; V134-T136 PolarHBondContact O-N 3.11Å; V134-T136 VanDerWaalsContact O-N 3.12Å
137R80.6Confident78.1Confident96 Ų9681.9 Ų81.936%0.36242%0.416SS..  trans-96.4115.6-171.4-63.8-62.8-64.9-174.93111.6Y133 V134 P135 D139 F140 F141Y133-R137 HydrophobicContact CD1-CG 4.25Å; Y133-R137 HydrophobicContact CE1-CG 3.6Å; Y133-R137 HydrophobicContact CE2-CG 4.23Å; Y133-R137 VanDerWaalsContact OH-CD 3.3Å; Y133-R137 WeakPolarHBondContact OH-CD 3.41Å; V134-R137 PolarHBondContact O-N 3.38Å; P135-R137 VanDerWaalsContact C-N 3.33Å; R137-D139 IonicContact CZ-OD2 3.15Å; R137-D139 IonicContact NE-OD2 2.79Å; R137-D139 IonicContact NH2-OD2 3.34Å; R137-D139 PolarHBondContact NH2-OD2 3.07Å; R137-F140 HydrophobicContact CB-CD2 3.65Å; R137-F140 HydrophobicContact CB-CE2 3.91Å; R137-F140 HydrophobicContact CB-CG 4.09Å; R137-F140 HydrophobicContact CG-CD2 4.22Å; R137-F140 HydrophobicContact CG-CE2 3.97Å; R137-F141 WeakPolarHBondContact O-CD2 3.39Å; R137-F141 VanDerWaalsContact O-CE2 3.31Å; R137-F141 WeakPolarHBondContact O-CE2 3.39Å
138Q73.3Confident76.7Confident92 Ų9283 Ų8343%0.4343%0.425SS..THydrogen-bonded Turntrans-68.9-33.9178.1-71.5-170-5300113F140 F141Q138-F140 PolarHBondContact O-N 3.1Å; Q138-F140 VanDerWaalsContact O-N 3.08Å; Q138-F141 WeakPolarHBondContact O-CB 3.16Å; Q138-F141 PolarHBondContact O-N 3.22Å
139D70.8Confident75.8Confident67 Ų6782.1 Ų82.136%0.35842%0.419SS..Hα-helixtrans-57.5-29.6-178.4-38.9-32.4000113.3R137 F141 E142 R143R137-D139 IonicContact CZ-OD2 3.15Å; R137-D139 IonicContact NE-OD2 2.79Å; R137-D139 IonicContact NH2-OD2 3.34Å; R137-D139 PolarHBondContact NH2-OD2 3.07Å; D139-F141 VanDerWaalsContact C-N 3.28Å; D139-F141 PolarHBondContact O-N 3.3Å; D139-E142 PolarHBondContact O-N 3.06Å; D139-R143 WeakPolarHBondContact O-CG 3.49Å; D139-R143 PolarHBondContact O-N 3.31Å
140F70.1Confident75.2Confident43 Ų4378.5 Ų78.519%0.18940%0.397CS..Hα-helixtrans-71.8-22.4178.8-65.8-17.3000113.2Y133 V134 R137 Q138 L152Y133-F140 HydrophobicContact CE1-CE2 4.35Å; V134-F140 HydrophobicContact CB-CD2 4.41Å; V134-F140 HydrophobicContact CG1-CD2 4.19Å; V134-F140 HydrophobicContact CG2-CD2 4.24Å; V134-F140 HydrophobicContact CG2-CE2 4.08Å; R137-F140 HydrophobicContact CB-CD2 3.65Å; R137-F140 HydrophobicContact CB-CE2 3.91Å; R137-F140 HydrophobicContact CB-CG 4.09Å; R137-F140 HydrophobicContact CG-CD2 4.22Å; R137-F140 HydrophobicContact CG-CE2 3.97Å; Q138-F140 PolarHBondContact O-N 3.1Å; Q138-F140 VanDerWaalsContact O-N 3.08Å; F140-L152 HydrophobicContact CD1-CD2 3.57Å; F140-L152 HydrophobicContact CD1-CG 4.34Å; F140-L152 HydrophobicContact CE1-CD2 3.74Å
141F68.9Low74.8Confident50 Ų5074.4 Ų74.422%0.21938%0.377CS..Hα-helixtrans-81.1-30.9176.4-67.5-104.7000112.2L87 K88 I91 R137 Q138 D139L87-F141 HydrophobicContact CD2-CD1 4.01Å; L87-F141 HydrophobicContact CD2-CE1 3.94Å; L87-F141 HydrophobicContact CG-CE1 4.01Å; K88-F141 HydrophobicContact CG-CE2 4.48Å; K88-F141 HydrophobicContact CG-CZ 3.96Å; I91-F141 HydrophobicContact CD1-CD1 4.11Å; I91-F141 HydrophobicContact CD1-CE1 3.09Å; I91-F141 HydrophobicContact CD1-CZ 3.45Å; I91-F141 VanDerWaalsContact CD1-CZ 3.45Å; R137-F141 WeakPolarHBondContact O-CD2 3.39Å; R137-F141 VanDerWaalsContact O-CE2 3.31Å; R137-F141 WeakPolarHBondContact O-CE2 3.39Å; Q138-F141 WeakPolarHBondContact O-CB 3.16Å; Q138-F141 PolarHBondContact O-N 3.22Å; D139-F141 VanDerWaalsContact C-N 3.28Å; D139-F141 PolarHBondContact O-N 3.3Å
142E67.1Low74.7Confident150 Ų15076.9 Ų76.970%0.70139%0.39SS*.Hα-helixtrans-88.8-28.4-172.7-63.5-174.8174.700112.6D139 K144D139-E142 PolarHBondContact O-N 3.06Å; E142-K144 VanDerWaalsContact C-N 3.34Å; E142-K144 PolarHBondContact O-N 3.34Å
143R66.8Low74.7Confident167 Ų16776.1 Ų76.163%0.6338%0.381SS*.  trans-75.680.7177.6-70.6-175.7-172.2-149.22.9112.1D139 G151 L152D139-R143 WeakPolarHBondContact O-CG 3.49Å; D139-R143 PolarHBondContact O-N 3.31Å; R143-G151 CarbonylContact O-C 3.57Å; R143-G151 WeakPolarHBondContact O-CA 3.21Å; R143-L152 HydrophobicContact CB-CB 4.35Å; R143-L152 PolarHBondContact O-N 2.99Å
144K69.6Low74.7Confident143 Ų14372.1 Ų72.162%0.62237%0.367SS*.BIsolated β-bridgetrans-82.3144.3169.5-63.2-179.5-177175.80110.9E142 I146E142-K144 VanDerWaalsContact C-N 3.34Å; E142-K144 PolarHBondContact O-N 3.34Å; K144-I146 PolarHBondContact O-N 3.03Å
145I69.4Low74.8Confident90 Ų9075 Ų7546%0.46238%0.382SS..  trans-67.9129163.2-60.4169.9000106.7G147 S148 V150 I155I145-G147 PolarHBondContact O-N 2.96Å; I145-S148 PolarHBondContact O-N 3.31Å; I145-S148 PolarHBondContact O-OG 3.14Å; I145-S148 VanDerWaalsContact O-OG 3.13Å; I145-V150 WeakPolarHBondContact CB-O 3.25Å; I145-V150 HydrophobicContact CD1-CB 4.46Å; I145-V150 HydrophobicContact CD1-CG1 4.05Å; I145-V150 PolarHBondContact N-O 2.78Å; I145-I155 HydrophobicContact CD1-CD1 3.98Å; I145-I155 HydrophobicContact CD1-CG1 4.45Å; I145-I155 HydrophobicContact CG1-CD1 4.48Å
146I55.1Low75.2Confident174 Ų17476.2 Ų76.289%0.89239%0.387SS*.THydrogen-bonded Turntrans-45.4123.5-173.4-59.4173.9000110.6K144 S148K144-I146 PolarHBondContact O-N 3.03Å; I146-S148 VanDerWaalsContact C-N 3.3Å; I146-S148 PolarHBondContact O-N 3.07Å
147G61.8Low75.7Confident90 Ų9073.2 Ų73.293%0.92837%0.366SS*.THydrogen-bonded Turntrans764.7176.100000116.2I145I145-G147 PolarHBondContact O-N 2.96Å
148S63.9Low76.3Confident42 Ų4270.6 Ų70.629%0.29436%0.362SS..SBendtrans-119.5159.8179.187.70000113.6I145 I146 V150I145-S148 PolarHBondContact O-N 3.31Å; I145-S148 PolarHBondContact O-OG 3.14Å; I145-S148 VanDerWaalsContact O-OG 3.13Å; I146-S148 VanDerWaalsContact C-N 3.3Å; I146-S148 PolarHBondContact O-N 3.07Å; S148-V150 PolarHBondContact O-N 2.86Å; S148-V150 PolarHBondContact OG-N 3.25Å; S148-V150 VanDerWaalsContact OG-N 3.12Å; S148-V150 PolarHBondContact OG-O 3.27Å; S148-V150 VanDerWaalsContact OG-O 3.07Å
149R73.1Confident77.3Confident81 Ų8171.5 Ų71.531%0.30637%0.369SS..SBendtrans-73.8-12.3169.5-159.5178.5-175.6176.61.8112.3H154 Y204R149-H154 PolarHBondContact O-CE1 3.46Å; R149-Y204 WeakPolarHBondContact CD-O 3.47Å; R149-Y204 HydrophobicContact CG-CE1 4.11Å; R149-Y204 PolarHBondContact NH1-O 3.31Å
150V79Confident78.5Confident23 Ų2369 Ų6914%0.13936%0.355CS..  trans-86.4122.1-175.8-177.60000109.3I145 S148 H154 I155 F201 V205I145-V150 WeakPolarHBondContact CB-O 3.25Å; I145-V150 HydrophobicContact CD1-CB 4.46Å; I145-V150 HydrophobicContact CD1-CG1 4.05Å; I145-V150 PolarHBondContact N-O 2.78Å; S148-V150 PolarHBondContact O-N 2.86Å; S148-V150 PolarHBondContact OG-N 3.25Å; S148-V150 VanDerWaalsContact OG-N 3.12Å; S148-V150 PolarHBondContact OG-O 3.27Å; S148-V150 VanDerWaalsContact OG-O 3.07Å; V150-H154 HydrophobicContact CG1-CB 3.75Å; V150-I155 HydrophobicContact CG1-CG1 4.49Å; V150-F201 HydrophobicContact CG2-CZ 4.42Å; V150-V205 HydrophobicContact CG2-CG1 4.1Å; V150-V205 HydrophobicContact CG2-CG2 3.79Å
151G83.9Confident79.7Confident4 Ų469 Ų694%0.04136%0.357CS..BIsolated β-bridgetrans-117.2-174.3172.500000112.6R143 L153 H154 I155R143-G151 CarbonylContact O-C 3.57Å; R143-G151 WeakPolarHBondContact O-CA 3.21Å; G151-L153 PolarHBondContact O-N 2.9Å; G151-H154 PolarHBondContact N-ND1 3.02Å; G151-H154 PolarHBondContact O-N 3.47Å; G151-I155 PolarHBondContact O-N 3.39Å
152L85.3Confident81Confident54 Ų5470.4 Ų70.428%0.28337%0.37SS..Hα-helixtrans-55-38.2177.5-179.858000112.4F140 R143 H154 I155 I156F140-L152 HydrophobicContact CD1-CD2 3.57Å; F140-L152 HydrophobicContact CD1-CG 4.34Å; F140-L152 HydrophobicContact CE1-CD2 3.74Å; R143-L152 HydrophobicContact CB-CB 4.35Å; R143-L152 PolarHBondContact O-N 2.99Å; L152-H154 PolarHBondContact O-N 3.42Å; L152-I155 PolarHBondContact O-N 3.3Å; L152-I156 HydrophobicContact CD1-CD1 4.37Å; L152-I156 HydrophobicContact CD1-CG1 4.42Å; L152-I156 HydrophobicContact CG-CD1 4.07Å; L152-I156 WeakPolarHBondContact O-CG1 3.27Å; L152-I156 PolarHBondContact O-N 3.25Å
153L87.5Confident82.3Confident16 Ų1666.1 Ų66.18%0.08435%0.349CS..Hα-helixtrans-52.3-51.5173.7-176.368.6000112.2I91 V134 G151 I155 I156 Y157I91-L153 HydrophobicContact CD1-CD2 3.71Å; I91-L153 HydrophobicContact CG1-CD2 4.33Å; I91-L153 HydrophobicContact CG2-CD1 4.22Å; I91-L153 HydrophobicContact CG2-CD2 4.36Å; V134-L153 HydrophobicContact CG1-CD1 3.16Å; G151-L153 PolarHBondContact O-N 2.9Å; L153-I155 VanDerWaalsContact C-N 3.33Å; L153-I155 PolarHBondContact O-N 2.85Å; L153-I156 PolarHBondContact O-N 3.47Å; L153-Y157 HydrophobicContact CD1-CD2 4.1Å; L153-Y157 HydrophobicContact CD1-CE2 3.56Å; L153-Y157 HydrophobicContact CG-CD2 4.07Å; L153-Y157 HydrophobicContact CG-CE2 3.92Å; L153-Y157 VanDerWaalsContact O-CD2 3.25Å; L153-Y157 WeakPolarHBondContact O-CD2 3.5Å; L153-Y157 PolarHBondContact O-N 3.25Å; L153-Y157 VanDerWaalsContact O-N 3.1Å
154H88.8Confident83.7Confident35 Ų3558.3 Ų58.316%0.16232%0.32CS..Hα-helixtrans-65.1-38.2-178.9-59.989.4000111.9R149 V150 G151 L152 I156 Y157 C158 Y204R149-H154 PolarHBondContact O-CE1 3.46Å; V150-H154 HydrophobicContact CG1-CB 3.75Å; G151-H154 PolarHBondContact N-ND1 3.02Å; G151-H154 PolarHBondContact O-N 3.47Å; L152-H154 PolarHBondContact O-N 3.42Å; H154-I156 VanDerWaalsContact C-N 3.34Å; H154-Y157 PolarHBondContact O-N 2.86Å; H154-C158 WeakPolarHBondContact O-CB 3.08Å; H154-C158 PolarHBondContact O-N 3.28Å; H154-C158 PolarHBondContact O-SG 3.39Å; H154-Y204 AromaticContact CD2-CE1 3.67Å; H154-Y204 AromaticContact NE2-CE1 3.21Å; H154-Y204 WeakPolarHBondContact NE2-CE1 3.32Å; H154-Y204 AromaticContact NE2-CZ 3.35Å; H154-Y204 PolarHBondContact NE2-OH 2.89Å
155I90.1Very high85Confident65 Ų6555.5 Ų55.533%0.33331%0.311SS..Hα-helixtrans-60.5-46.2175.8-59.6170.4000110I145 V150 G151 L152 L153 Y157 C158 I159I145-I155 HydrophobicContact CD1-CD1 3.98Å; I145-I155 HydrophobicContact CD1-CG1 4.45Å; I145-I155 HydrophobicContact CG1-CD1 4.48Å; V150-I155 HydrophobicContact CG1-CG1 4.49Å; G151-I155 PolarHBondContact O-N 3.39Å; L152-I155 PolarHBondContact O-N 3.3Å; L153-I155 VanDerWaalsContact C-N 3.33Å; L153-I155 PolarHBondContact O-N 2.85Å; I155-Y157 PolarHBondContact O-N 2.89Å; I155-C158 PolarHBondContact O-N 3.45Å; I155-I159 HydrophobicContact CG2-CD1 3.9Å; I155-I159 HydrophobicContact CG2-CG1 4.47Å; I155-I159 WeakPolarHBondContact O-CG1 3.36Å; I155-I159 PolarHBondContact O-N 3.47Å
156I91.1Very high86.3Confident34 Ų3454.3 Ų54.317%0.17431%0.31CS..Hα-helixtrans-57.7-49.6178-69164.8000110.5V134 L152 L153 H154 C158 I159 I160V134-I156 HydrophobicContact CG2-CD1 4.24Å; V134-I156 HydrophobicContact CG2-CG2 4.32Å; L152-I156 HydrophobicContact CD1-CD1 4.37Å; L152-I156 HydrophobicContact CD1-CG1 4.42Å; L152-I156 HydrophobicContact CG-CD1 4.07Å; L152-I156 WeakPolarHBondContact O-CG1 3.27Å; L152-I156 PolarHBondContact O-N 3.25Å; L153-I156 PolarHBondContact O-N 3.47Å; H154-I156 VanDerWaalsContact C-N 3.34Å; I156-C158 PolarHBondContact O-N 3.21Å; I156-I159 PolarHBondContact O-N 3.36Å; I156-I160 HydrophobicContact CG2-CD1 3.79Å; I156-I160 WeakPolarHBondContact O-CG1 3.46Å; I156-I160 PolarHBondContact O-N 2.98Å
157Y93Very high88.3Confident21 Ų2146.5 Ų46.58%0.08227%0.271CS..Hα-helixtrans-65.4-37.4177.4-77.1-72.6000112.9I91 I94 S95 L98 T131 L153 H154 I155 I159 I160 I161I91-Y157 HydrophobicContact CG2-CE2 3.96Å; I91-Y157 WeakPolarHBondContact CG2-OH 3.47Å; I91-Y157 PolarHBondContact O-OH 2.89Å; I94-Y157 HydrophobicContact CG2-CD1 4.4Å; I94-Y157 HydrophobicContact CG2-CE1 4.09Å; S95-Y157 PolarHBondContact OG-OH 2.97Å; L98-Y157 HydrophobicContact CD2-CD1 3.95Å; L98-Y157 HydrophobicContact CD2-CE1 4.38Å; T131-Y157 HydrophobicContact CG2-CE1 4.42Å; L153-Y157 HydrophobicContact CD1-CD2 4.1Å; L153-Y157 HydrophobicContact CD1-CE2 3.56Å; L153-Y157 HydrophobicContact CG-CD2 4.07Å; L153-Y157 HydrophobicContact CG-CE2 3.92Å; L153-Y157 VanDerWaalsContact O-CD2 3.25Å; L153-Y157 WeakPolarHBondContact O-CD2 3.5Å; L153-Y157 PolarHBondContact O-N 3.25Å; L153-Y157 VanDerWaalsContact O-N 3.1Å; H154-Y157 PolarHBondContact O-N 2.86Å; I155-Y157 PolarHBondContact O-N 2.89Å; Y157-I159 VanDerWaalsContact C-N 3.33Å; Y157-I159 PolarHBondContact O-N 3.24Å; Y157-I160 PolarHBondContact O-N 3.1Å; Y157-I161 WeakPolarHBondContact O-CB 3.28Å; Y157-I161 WeakPolarHBondContact O-CD1 3.49Å; Y157-I161 WeakPolarHBondContact O-CG1 3.48Å; Y157-I161 PolarHBondContact O-N 2.86Å
158C93.8Very high90Very high41 Ų4143.4 Ų43.428%0.27723%0.234SC..Hα-helixtrans-62.1-41.3175.6-70.10000111.4H154 I155 I156 I161 T162H154-C158 WeakPolarHBondContact O-CB 3.08Å; H154-C158 PolarHBondContact O-N 3.28Å; H154-C158 PolarHBondContact O-SG 3.39Å; I155-C158 PolarHBondContact O-N 3.45Å; I156-C158 PolarHBondContact O-N 3.21Å; C158-I161 PolarHBondContact O-N 2.98Å; C158-T162 VanDerWaalsContact O-CB 3.26Å; C158-T162 WeakPolarHBondContact O-CB 3.41Å; C158-T162 PolarHBondContact O-N 3.39Å; C158-T162 PolarHBondContact O-OG1 2.92Å
159I94.7Very high91.7Very high111 Ų11145.9 Ų45.957%0.56925%0.247SC*.Hα-helixtrans-62.3-48.5174.7-68.6165.7000110I155 I156 Y157 I161 T162 F163I155-I159 HydrophobicContact CG2-CD1 3.9Å; I155-I159 HydrophobicContact CG2-CG1 4.47Å; I155-I159 WeakPolarHBondContact O-CG1 3.36Å; I155-I159 PolarHBondContact O-N 3.47Å; I156-I159 PolarHBondContact O-N 3.36Å; Y157-I159 VanDerWaalsContact C-N 3.33Å; Y157-I159 PolarHBondContact O-N 3.24Å; I159-I161 VanDerWaalsContact C-N 3.34Å; I159-I161 PolarHBondContact O-N 3.19Å; I159-T162 PolarHBondContact O-N 3.42Å; I159-F163 PolarHBondContact O-N 3.26Å
160I95.5Very high92.8Very high14 Ų1444.6 Ų44.67%0.07224%0.244CC..Hα-helixtrans-62.9-40.8179.8-65.4161.4000111.1L98 Y102 I127 T131 I156 Y157 F163L98-I160 HydrophobicContact CD2-CB 4.34Å; L98-I160 HydrophobicContact CD2-CG2 3.64Å; L98-I160 HydrophobicContact CG-CG2 4.44Å; Y102-I160 HydrophobicContact CE2-CG2 4.06Å; Y102-I160 PolarHBondContact OH-O 3.12Å; I127-I160 HydrophobicContact CD1-CG2 4.48Å; I127-I160 HydrophobicContact CG2-CD1 4.33Å; I127-I160 HydrophobicContact CG2-CG1 4.35Å; I127-I160 HydrophobicContact CG2-CG2 3.57Å; T131-I160 HydrophobicContact CG2-CD1 3.45Å; T131-I160 VanDerWaalsContact CG2-CD1 3.45Å; I156-I160 HydrophobicContact CG2-CD1 3.79Å; I156-I160 WeakPolarHBondContact O-CG1 3.46Å; I156-I160 PolarHBondContact O-N 2.98Å; Y157-I160 PolarHBondContact O-N 3.1Å; I160-F163 WeakPolarHBondContact O-CB 3.45Å; I160-F163 PolarHBondContact O-N 2.89Å
161I96.1Very high93.7Very high44 Ų4444.1 Ų44.123%0.22624%0.24CC..Hα-helixtrans-67.3-44.6177.7-69.8162.5000110.5L98 Y102 Y157 C158 I159 F163 G164 Y194 I197L98-I161 HydrophobicContact CD1-CG1 3.82Å; L98-I161 HydrophobicContact CD2-CG1 4.22Å; Y102-I161 PolarHBondContact OH-O 3.39Å; Y102-I161 VanDerWaalsContact OH-O 3.06Å; Y157-I161 WeakPolarHBondContact O-CB 3.28Å; Y157-I161 WeakPolarHBondContact O-CD1 3.49Å; Y157-I161 WeakPolarHBondContact O-CG1 3.48Å; Y157-I161 PolarHBondContact O-N 2.86Å; C158-I161 PolarHBondContact O-N 2.98Å; I159-I161 VanDerWaalsContact C-N 3.34Å; I159-I161 PolarHBondContact O-N 3.19Å; I161-F163 PolarHBondContact O-N 3.3Å; I161-G164 PolarHBondContact O-N 3.26Å; I161-G164 VanDerWaalsContact O-N 3.15Å; I161-Y194 HydrophobicContact CG2-CE1 4.2Å; I161-Y194 PolarHBondContact O-OH 3.13Å; I161-I197 HydrophobicContact CG2-CG2 4.29Å
162T94.8Very high94.3Very high79 Ų7944.7 Ų44.749%0.48524%0.243SC..Hα-helixtrans-67-26.2-179.2-53.20000111.9C158 I159 G164 I165C158-T162 VanDerWaalsContact O-CB 3.26Å; C158-T162 WeakPolarHBondContact O-CB 3.41Å; C158-T162 PolarHBondContact O-N 3.39Å; C158-T162 PolarHBondContact O-OG1 2.92Å; I159-T162 PolarHBondContact O-N 3.42Å; T162-G164 PolarHBondContact O-N 2.85Å; T162-G164 VanDerWaalsContact O-N 3.1Å; T162-I165 HydrophobicContact CG2-CD1 3.76Å; T162-I165 WeakPolarHBondContact O-CB 3.43Å; T162-I165 WeakPolarHBondContact O-CG1 3.48Å; T162-I165 PolarHBondContact O-N 3.49Å
163F95.9Very high94.8Very high61 Ų6148.3 Ų48.327%0.26826%0.257SS..THydrogen-bonded Turntrans-53-31.5172.9173.9-102.3000112.3Y120 I123 I127 I159 I160 I161 I165 C166 P167Y120-F163 HydrophobicContact CD1-CZ 4.36Å; Y120-F163 HydrophobicContact CE1-CZ 4.18Å; I123-F163 HydrophobicContact CD1-CZ 4.3Å; I123-F163 HydrophobicContact CG2-CE1 3.85Å; I123-F163 HydrophobicContact CG2-CE2 4.48Å; I123-F163 HydrophobicContact CG2-CZ 3.66Å; I127-F163 HydrophobicContact CD1-CD1 4.02Å; I127-F163 HydrophobicContact CD1-CE1 4.24Å; I159-F163 PolarHBondContact O-N 3.26Å; I160-F163 WeakPolarHBondContact O-CB 3.45Å; I160-F163 PolarHBondContact O-N 2.89Å; I161-F163 PolarHBondContact O-N 3.3Å; F163-I165 PolarHBondContact O-N 2.95Å; F163-I165 VanDerWaalsContact O-N 3.09Å; F163-C166 HydrophobicContact CD2-CB 4.43Å; F163-C166 HydrophobicContact CE2-CB 4.3Å; F163-C166 WeakPolarHBondContact O-CB 3.13Å; F163-C166 PolarHBondContact O-N 2.85Å; F163-P167 WeakPolarHBondContact O-CD 3.19Å
164G95.5Very high95.1Very high3 Ų348 Ų483%0.03126%0.255CS..THydrogen-bonded Turntrans-64.9-12.7179.900000114.5Y102 I161 T162 C166 P167 T168 Y194Y102-G164 VanDerWaalsContact OH-CA 3.26Å; Y102-G164 WeakPolarHBondContact OH-CA 3.47Å; Y102-G164 PolarHBondContact OH-N 3.45Å; I161-G164 PolarHBondContact O-N 3.26Å; I161-G164 VanDerWaalsContact O-N 3.15Å; T162-G164 PolarHBondContact O-N 2.85Å; T162-G164 VanDerWaalsContact O-N 3.1Å; G164-C166 VanDerWaalsContact C-N 3.29Å; G164-P167 WeakPolarHBondContact O-CD 3.34Å; G164-P167 WeakPolarHBondContact O-CG 3.47Å; G164-T168 WeakPolarHBondContact O-CB 3.42Å; G164-T168 PolarHBondContact O-N 3.44Å; G164-T168 PolarHBondContact O-OG1 2.96Å; G164-Y194 WeakPolarHBondContact CA-OH 3.47Å
165I96.5Very high95.3Very high84 Ų8446.3 Ų46.343%0.43125%0.247SC..Hα-helixtrans-65.3-36.4168.1-60.8177.6000110.2T162 F163 T168 V169 Y194T162-I165 HydrophobicContact CG2-CD1 3.76Å; T162-I165 WeakPolarHBondContact O-CB 3.43Å; T162-I165 WeakPolarHBondContact O-CG1 3.48Å; T162-I165 PolarHBondContact O-N 3.49Å; F163-I165 PolarHBondContact O-N 2.95Å; F163-I165 VanDerWaalsContact O-N 3.09Å; I165-T168 WeakPolarHBondContact O-CB 3.28Å; I165-T168 PolarHBondContact O-N 2.84Å; I165-V169 HydrophobicContact CG2-CG2 4.05Å; I165-V169 WeakPolarHBondContact O-CG2 3.35Å; I165-V169 PolarHBondContact O-N 3.34Å; I165-Y194 HydrophobicContact CG1-CE1 4.31Å; I165-Y194 PolarHBondContact N-OH 2.93Å
166C97.2Very high95.5Very high65 Ų6545.1 Ų45.144%0.43925%0.25SS..Hα-helixtrans-59.6-58.2178.9179.10000113.3F163 G164 T168 V169 H170F163-C166 HydrophobicContact CD2-CB 4.43Å; F163-C166 HydrophobicContact CE2-CB 4.3Å; F163-C166 WeakPolarHBondContact O-CB 3.13Å; F163-C166 PolarHBondContact O-N 2.85Å; G164-C166 VanDerWaalsContact C-N 3.29Å; C166-T168 PolarHBondContact O-N 3.46Å; C166-V169 PolarHBondContact O-N 2.93Å; C166-H170 WeakPolarHBondContact O-CB 3.42Å; C166-H170 PolarHBondContact O-N 3.36Å
167P97.5Very high95.6Very high9 Ų944.3 Ų44.36%0.05825%0.251CS..Hα-helixtrans-61.6-29.7175.321.5-29000112.6F110 Y120 F163 G164 W171F110-P167 HydrophobicContact CE2-CB 3.76Å; F110-P167 HydrophobicContact CZ-CB 4.02Å; F110-P167 WeakPolarHBondContact CZ-O 3.41Å; Y120-P167 HydrophobicContact CD1-CB 4.19Å; Y120-P167 HydrophobicContact CE1-CB 3.76Å; Y120-P167 HydrophobicContact CE1-CG 4.28Å; Y120-P167 HydrophobicContact CE2-CB 4.23Å; F163-P167 WeakPolarHBondContact O-CD 3.19Å; G164-P167 WeakPolarHBondContact O-CD 3.34Å; G164-P167 WeakPolarHBondContact O-CG 3.47Å; P167-W171 WeakPolarHBondContact O-CB 3.46Å; P167-W171 PolarHBondContact O-N 3.47Å
168T97.7Very high95.7Very high26 Ų2648.8 Ų48.816%0.1627%0.271CS..Hα-helixtrans-64.8-52.1175.4-58.90000111.5G164 I165 C166 H170 W171 V172 F187 V190G164-T168 WeakPolarHBondContact O-CB 3.42Å; G164-T168 PolarHBondContact O-N 3.44Å; G164-T168 PolarHBondContact O-OG1 2.96Å; I165-T168 WeakPolarHBondContact O-CB 3.28Å; I165-T168 PolarHBondContact O-N 2.84Å; C166-T168 PolarHBondContact O-N 3.46Å; T168-H170 VanDerWaalsContact C-N 3.28Å; T168-H170 PolarHBondContact O-N 2.81Å; T168-W171 PolarHBondContact O-N 3.35Å; T168-V172 WeakPolarHBondContact O-CG2 3.49Å; T168-V172 PolarHBondContact O-N 3.38Å; T168-F187 HydrophobicContact CG2-CD2 4.33Å; T168-F187 HydrophobicContact CG2-CE2 4.04Å; T168-V190 HydrophobicContact CG2-CG1 3.96Å; T168-V190 HydrophobicContact CG2-CG2 4.4Å
169V98Very high95.7Very high93 Ų9355.9 Ų55.956%0.56430%0.3SS*.Hα-helixtrans-61.3-41.6178.2170.50000110.4I165 C166 V172 F173I165-V169 HydrophobicContact CG2-CG2 4.05Å; I165-V169 WeakPolarHBondContact O-CG2 3.35Å; I165-V169 PolarHBondContact O-N 3.34Å; C166-V169 PolarHBondContact O-N 2.93Å; V169-V172 PolarHBondContact O-N 3.41Å; V169-F173 PolarHBondContact O-N 3.43Å
170H97.5Very high95.6Very high55 Ų5552.2 Ų52.226%0.25528%0.281SS..Hα-helixtrans-62.9-44.5177-168.5-176.6000111.9F110 H116 Y120 C166 T168 V172 F173 L174F110-H170 HydrophobicContact CZ-CB 4.41Å; H116-H170 AromaticContact CD2-CE1 3.28Å; H116-H170 PolarHBondContact CD2-CE1 3.22Å; H116-H170 AromaticContact CD2-NE2 3.43Å; H116-H170 PolarHBondContact CD2-NE2 2.96Å; H116-H170 AromaticContact NE2-CE1 3.96Å; H116-H170 AromaticContact NE2-NE2 3.79Å; Y120-H170 AromaticContact CE2-ND1 3.59Å; Y120-H170 AromaticContact CZ-ND1 3.68Å; Y120-H170 PolarHBondContact OH-ND1 3.06Å; C166-H170 WeakPolarHBondContact O-CB 3.42Å; C166-H170 PolarHBondContact O-N 3.36Å; T168-H170 VanDerWaalsContact C-N 3.28Å; T168-H170 PolarHBondContact O-N 2.81Å; H170-V172 PolarHBondContact O-N 3.05Å; H170-F173 WeakPolarHBondContact O-CB 3.34Å; H170-F173 PolarHBondContact O-N 3.28Å; H170-L174 WeakPolarHBondContact O-CG 3.47Å; H170-L174 PolarHBondContact O-N 3.12Å
171W97.2Very high95.5Very high12 Ų1257.9 Ų57.95%0.04531%0.312CS..Hα-helixtrans-59.4-44.8175.3171.580.3000112.4A109 F110 P167 T168 F173 L174 H175 H182 V183 W186 F187A109-W171 HydrophobicContact CB-CB 4.47Å; A109-W171 HydrophobicContact CB-CG 4.08Å; A109-W171 PolarHBondContact O-NE1 3.49Å; F110-W171 HydrophobicContact CE1-CB 4.48Å; F110-W171 HydrophobicContact CZ-CB 4.19Å; P167-W171 WeakPolarHBondContact O-CB 3.46Å; P167-W171 PolarHBondContact O-N 3.47Å; T168-W171 PolarHBondContact O-N 3.35Å; W171-F173 VanDerWaalsContact C-N 3.32Å; W171-F173 PolarHBondContact O-N 2.9Å; W171-L174 PolarHBondContact O-N 2.99Å; W171-H175 AromaticContact CD1-CE1 3.24Å; W171-H175 AromaticContact CD1-ND1 3.48Å; W171-H175 AromaticContact CE2-CE1 3.76Å; W171-H175 AromaticContact CE2-ND1 3.8Å; W171-H175 AromaticContact CG-ND1 3.98Å; W171-H175 AromaticContact NE1-CE1 2.98Å; W171-H175 PolarHBondContact NE1-CE1 3.29Å; W171-H175 AromaticContact NE1-ND1 3.4Å; W171-H175 PolarHBondContact NE1-ND1 3.45Å; W171-H175 AromaticContact NE1-NE2 3.78Å; W171-H175 PolarHBondContact O-N 3.49Å; W171-H175 PolarHBondContact O-ND1 3.25Å; W171-H182 AromaticContact CZ2-CD2 3.78Å; W171-H182 AromaticContact CZ2-NE2 3.91Å; W171-V183 HydrophobicContact CH2-CB 4.39Å; W171-V183 HydrophobicContact CH2-CG1 4.44Å; W171-V183 HydrophobicContact CH2-CG2 4.27Å; W171-V183 HydrophobicContact CZ3-CG1 4.13Å; W171-V183 HydrophobicContact CZ3-CG2 4.42Å; W171-W186 HydrophobicContact CH2-CB 3.92Å; W171-W186 HydrophobicContact CZ2-CB 4.29Å; W171-F187 HydrophobicContact CZ3-CB 4.38Å
172V97.2Very high95.4Very high17 Ų1756 Ų5610%0.10330%0.302CS..Hα-helixtrans-58.9-45175170.20000110.7T168 V169 H170 H175 G176 G177 F178 V183 F187T168-V172 WeakPolarHBondContact O-CG2 3.49Å; T168-V172 PolarHBondContact O-N 3.38Å; V169-V172 PolarHBondContact O-N 3.41Å; H170-V172 PolarHBondContact O-N 3.05Å; V172-H175 PolarHBondContact O-N 3.4Å; V172-G176 PolarHBondContact O-N 2.93Å; V172-G177 WeakPolarHBondContact O-CA 3.3Å; V172-G177 PolarHBondContact O-N 3.07Å; V172-F178 HydrophobicContact CG1-CD2 4.26Å; V172-F178 HydrophobicContact CG1-CE2 4.03Å; V172-F178 HydrophobicContact CG1-CZ 4.42Å; V172-F178 HydrophobicContact CG2-CZ 4.48Å; V172-V183 HydrophobicContact CB-CG1 4.49Å; V172-V183 HydrophobicContact CG1-CG1 4.14Å; V172-V183 HydrophobicContact CG2-CG1 3.99Å; V172-F187 HydrophobicContact CG2-CD2 3.94Å; V172-F187 HydrophobicContact CG2-CE2 4.3Å
173F96.1Very high95.5Very high130 Ų13052.3 Ų52.357%0.5728%0.279SS*.Hα-helixtrans-62.6-46.6179.4178.8-97.6000112.4V169 H170 W171 H175 G176 F264V169-F173 PolarHBondContact O-N 3.43Å; H170-F173 WeakPolarHBondContact O-CB 3.34Å; H170-F173 PolarHBondContact O-N 3.28Å; W171-F173 VanDerWaalsContact C-N 3.32Å; W171-F173 PolarHBondContact O-N 2.9Å; F173-H175 PolarHBondContact O-N 3.35Å; F173-G176 PolarHBondContact O-N 2.88Å; F173-F264 HydrophobicContact CE1-CE1 4.25Å; F173-F264 HydrophobicContact CE1-CZ 4.06Å; F173-F264 HydrophobicContact CZ-CZ 4.25Å
174L93.6Very high95.5Very high9 Ų952.4 Ų52.45%0.04729%0.285CS..Hα-helixtrans-63.3-28.9-179.8-69.6172.8000113.3F110 F113 H170 W171 G176F110-L174 HydrophobicContact CD1-CD1 4.05Å; F110-L174 HydrophobicContact CE1-CD1 3.74Å; F113-L174 HydrophobicContact CB-CD1 4.46Å; F113-L174 HydrophobicContact CD1-CD1 4.08Å; F113-L174 HydrophobicContact CD1-CD2 4.47Å; F113-L174 HydrophobicContact CD2-CD1 4.19Å; F113-L174 HydrophobicContact CE1-CB 3.93Å; F113-L174 HydrophobicContact CE1-CD1 4.32Å; F113-L174 HydrophobicContact CE1-CD2 4.31Å; F113-L174 HydrophobicContact CE1-CG 4.42Å; F113-L174 HydrophobicContact CE2-CB 4.05Å; F113-L174 HydrophobicContact CE2-CD1 4.44Å; F113-L174 HydrophobicContact CG-CD1 3.99Å; F113-L174 HydrophobicContact CZ-CB 3.65Å; F113-L174 HydrophobicContact CZ-CD1 4.48Å; H170-L174 WeakPolarHBondContact O-CG 3.47Å; H170-L174 PolarHBondContact O-N 3.12Å; W171-L174 PolarHBondContact O-N 2.99Å; L174-G176 VanDerWaalsContact C-N 3.29Å
175H93.4Very high95.6Very high0 Ų057.4 Ų57.40%031%0.306CS..THydrogen-bonded Turntrans-86.64.7175-69.782.8000113.2F113 W171 V172 F173 N180 H182 V183 P261F113-H175 AromaticContact CE2-CE1 3.45Å; F113-H175 VanDerWaalsContact CE2-CE1 3.45Å; F113-H175 WeakPolarHBondContact CE2-CE1 3.42Å; F113-H175 AromaticContact CE2-ND1 3.99Å; F113-H175 AromaticContact CE2-NE2 3.87Å; W171-H175 AromaticContact CD1-CE1 3.24Å; W171-H175 AromaticContact CD1-ND1 3.48Å; W171-H175 AromaticContact CE2-CE1 3.76Å; W171-H175 AromaticContact CE2-ND1 3.8Å; W171-H175 AromaticContact CG-ND1 3.98Å; W171-H175 AromaticContact NE1-CE1 2.98Å; W171-H175 PolarHBondContact NE1-CE1 3.29Å; W171-H175 AromaticContact NE1-ND1 3.4Å; W171-H175 PolarHBondContact NE1-ND1 3.45Å; W171-H175 AromaticContact NE1-NE2 3.78Å; W171-H175 PolarHBondContact O-N 3.49Å; W171-H175 PolarHBondContact O-ND1 3.25Å; V172-H175 PolarHBondContact O-N 3.4Å; F173-H175 PolarHBondContact O-N 3.35Å; H175-N180 WeakPolarHBondContact O-CB 3.36Å; H175-N180 PolarHBondContact O-ND2 2.93Å; H175-H182 AromaticContact CD2-CD2 3.59Å; H175-H182 AromaticContact NE2-CD2 3.68Å; H175-V183 HydrophobicContact CB-CG2 3.41Å; H175-V183 VanDerWaalsContact CB-CG2 3.41Å; H175-P261 WeakPolarHBondContact O-CD 3.31Å; H175-P261 VanDerWaalsContact O-CG 3.25Å; H175-P261 WeakPolarHBondContact O-CG 3.3Å
176G92.4Very high95.6Very high39 Ų3954.3 Ų54.340%0.40229%0.289SS..THydrogen-bonded Turntrans85.216.117700000115V172 F173 L174V172-G176 PolarHBondContact O-N 2.93Å; F173-G176 PolarHBondContact O-N 2.88Å; L174-G176 VanDerWaalsContact C-N 3.29Å
177G94.3Very high95.6Very high18 Ų1854.1 Ų54.119%0.18628%0.281CS..SBendtrans86.9-167.1175.200000114.8V172 E179 N180 V183V172-G177 WeakPolarHBondContact O-CA 3.3Å; V172-G177 PolarHBondContact O-N 3.07Å; G177-E179 PolarHBondContact O-N 3.12Å; G177-N180 WeakPolarHBondContact O-CB 3.28Å; G177-N180 PolarHBondContact O-N 3.4Å; G177-V183 WeakPolarHBondContact O-CB 3.32Å; G177-V183 WeakPolarHBondContact O-CG2 3.28Å
178F95.7Very high95.7Very high115 Ų11556.5 Ų56.550%0.50430%0.296SS..THydrogen-bonded Turntrans-75.8-1.7-174.6-74-77.4000114.8V172 N180 V183 T184 F187V172-F178 HydrophobicContact CG1-CD2 4.26Å; V172-F178 HydrophobicContact CG1-CE2 4.03Å; V172-F178 HydrophobicContact CG1-CZ 4.42Å; V172-F178 HydrophobicContact CG2-CZ 4.48Å; F178-N180 VanDerWaalsContact C-N 3.25Å; F178-V183 HydrophobicContact CD1-CG1 3.85Å; F178-V183 HydrophobicContact CE1-CG1 4.02Å; F178-V183 HydrophobicContact CG-CG1 4.42Å; F178-T184 WeakPolarHBondContact O-CG2 3.39Å; F178-F187 HydrophobicContact CE1-CB 4.03Å; F178-F187 AromaticContact CE1-CD1 3.53Å; F178-F187 HydrophobicContact CE1-CD1 3.53Å; F178-F187 AromaticContact CE1-CD2 3.91Å; F178-F187 HydrophobicContact CE1-CD2 3.91Å; F178-F187 AromaticContact CE1-CE1 3.87Å; F178-F187 HydrophobicContact CE1-CE1 3.87Å; F178-F187 HydrophobicContact CE1-CE2 4.24Å; F178-F187 AromaticContact CE1-CG 3.55Å; F178-F187 HydrophobicContact CE1-CG 3.55Å; F178-F187 HydrophobicContact CE1-CZ 4.22Å; F178-F187 AromaticContact CZ-CD1 3.91Å; F178-F187 HydrophobicContact CZ-CD1 3.91Å; F178-F187 AromaticContact CZ-CD2 3.84Å; F178-F187 HydrophobicContact CZ-CD2 3.84Å; F178-F187 AromaticContact CZ-CE1 3.8Å; F178-F187 HydrophobicContact CZ-CE1 3.8Å; F178-F187 AromaticContact CZ-CE2 3.74Å; F178-F187 HydrophobicContact CZ-CE2 3.74Å; F178-F187 AromaticContact CZ-CG 3.93Å; F178-F187 HydrophobicContact CZ-CG 3.93Å; F178-F187 AromaticContact CZ-CZ 3.71Å; F178-F187 HydrophobicContact CZ-CZ 3.71Å
179E93.2Very high95.7Very high190 Ų19056.3 Ų56.389%0.88829%0.294SS*.THydrogen-bonded Turntrans-78.2-14.8170-63.5-177.1175.600111.8G177G177-E179 PolarHBondContact O-N 3.12Å
180N92.9Very high95.7Very high33 Ų3352.8 Ų52.818%0.17627%0.273CS..SBendtrans-84.1124.3177.1-171.4-40.1000111.2H175 G177 F178 H182 V183 T184 F259H175-N180 WeakPolarHBondContact O-CB 3.36Å; H175-N180 PolarHBondContact O-ND2 2.93Å; G177-N180 WeakPolarHBondContact O-CB 3.28Å; G177-N180 PolarHBondContact O-N 3.4Å; F178-N180 VanDerWaalsContact C-N 3.25Å; N180-H182 PolarHBondContact O-N 3.49Å; N180-H182 WeakPolarHBondContact OD1-CB 3.39Å; N180-H182 PolarHBondContact OD1-N 3.17Å; N180-V183 HydrophobicContact CB-CB 4.41Å; N180-V183 HydrophobicContact CB-CG2 4.11Å; N180-V183 WeakPolarHBondContact O-CB 3.37Å; N180-V183 PolarHBondContact O-N 3.33Å; N180-T184 PolarHBondContact O-N 3.19Å; N180-T184 VanDerWaalsContact O-N 3.1Å; N180-F259 PolarHBondContact ND2-O 2.84Å
181D93.4Very high95.7Very high134 Ų13453.4 Ų53.472%0.71728%0.28SS*.Hα-helixtrans-55.5-33.2178.1-70.2-21.4000113.5V183 T184 K185D181-V183 VanDerWaalsContact C-N 3.34Å; D181-T184 WeakPolarHBondContact CA-OG1 3.47Å; D181-T184 PolarHBondContact O-OG1 2.85Å; D181-T184 VanDerWaalsContact O-OG1 3.07Å; D181-K185 VanDerWaalsContact O-CB 3.24Å; D181-K185 WeakPolarHBondContact O-CB 3.19Å; D181-K185 PolarHBondContact O-N 2.97Å
182H94.1Very high95.8Very high5 Ų555.4 Ų55.42%0.02329%0.294CS..Hα-helixtrans-63.6-42.4175.8-171.569.6000111.3W171 H175 N180 W186 Y249 F259W171-H182 AromaticContact CZ2-CD2 3.78Å; W171-H182 AromaticContact CZ2-NE2 3.91Å; H175-H182 AromaticContact CD2-CD2 3.59Å; H175-H182 AromaticContact NE2-CD2 3.68Å; N180-H182 PolarHBondContact O-N 3.49Å; N180-H182 WeakPolarHBondContact OD1-CB 3.39Å; N180-H182 PolarHBondContact OD1-N 3.17Å; H182-W186 AromaticContact CE1-CD1 3.37Å; H182-W186 AromaticContact CE1-NE1 3.55Å; H182-W186 AromaticContact ND1-CD1 3.51Å; H182-W186 AromaticContact ND1-NE1 3.71Å; H182-W186 AromaticContact NE2-CD1 3.85Å; H182-W186 VanDerWaalsContact O-CD1 3.23Å; H182-W186 PolarHBondContact O-N 3.05Å; H182-Y249 AromaticContact CE1-CE1 3.82Å; H182-Y249 AromaticContact CE1-CZ 3.72Å; H182-Y249 AromaticContact NE2-CE1 3.84Å; H182-Y249 AromaticContact NE2-CZ 3.46Å; H182-Y249 PolarHBondContact NE2-OH 3.24Å; H182-F259 HydrophobicContact CB-CB 4.26Å; H182-F259 HydrophobicContact CB-CD1 3.98Å; H182-F259 HydrophobicContact CB-CG 4.35Å; H182-F259 AromaticContact ND1-CD1 3.77Å; H182-F259 AromaticContact ND1-CG 3.84Å
183V96.1Very high95.8Very high0 Ų055.1 Ų55.10%029%0.292CS..Hα-helixtrans-67.6-47.6178.8175.50000110.5W171 V172 H175 G177 F178 N180 D181 K185 W186 F187W171-V183 HydrophobicContact CH2-CB 4.39Å; W171-V183 HydrophobicContact CH2-CG1 4.44Å; W171-V183 HydrophobicContact CH2-CG2 4.27Å; W171-V183 HydrophobicContact CZ3-CG1 4.13Å; W171-V183 HydrophobicContact CZ3-CG2 4.42Å; V172-V183 HydrophobicContact CB-CG1 4.49Å; V172-V183 HydrophobicContact CG1-CG1 4.14Å; V172-V183 HydrophobicContact CG2-CG1 3.99Å; H175-V183 HydrophobicContact CB-CG2 3.41Å; H175-V183 VanDerWaalsContact CB-CG2 3.41Å; G177-V183 WeakPolarHBondContact O-CB 3.32Å; G177-V183 WeakPolarHBondContact O-CG2 3.28Å; F178-V183 HydrophobicContact CD1-CG1 3.85Å; F178-V183 HydrophobicContact CE1-CG1 4.02Å; F178-V183 HydrophobicContact CG-CG1 4.42Å; N180-V183 HydrophobicContact CB-CB 4.41Å; N180-V183 HydrophobicContact CB-CG2 4.11Å; N180-V183 WeakPolarHBondContact O-CB 3.37Å; N180-V183 PolarHBondContact O-N 3.33Å; D181-V183 VanDerWaalsContact C-N 3.34Å; V183-K185 VanDerWaalsContact C-N 3.27Å; V183-K185 PolarHBondContact O-N 2.67Å; V183-W186 PolarHBondContact O-N 3.03Å; V183-F187 HydrophobicContact CG1-CB 4.35Å; V183-F187 WeakPolarHBondContact O-CB 3.45Å; V183-F187 PolarHBondContact O-N 2.89Å
184T96.7Very high95.9Very high64 Ų6451.9 Ų51.939%0.39328%0.276SS..Hα-helixtrans-65.4-31.3-177.958.70000112.7F178 N180 D181 P188F178-T184 WeakPolarHBondContact O-CG2 3.39Å; N180-T184 PolarHBondContact O-N 3.19Å; N180-T184 VanDerWaalsContact O-N 3.1Å; D181-T184 WeakPolarHBondContact CA-OG1 3.47Å; D181-T184 PolarHBondContact O-OG1 2.85Å; D181-T184 VanDerWaalsContact O-OG1 3.07Å; T184-P188 WeakPolarHBondContact O-CD 3.47Å; T184-P188 WeakPolarHBondContact O-CG 3.24Å
185K96.1Very high96.2Very high107 Ų10754.7 Ų54.747%0.46530%0.296SS..Hα-helixtrans-68.8-45174.6-177.5180177.5-170.70113D181 V183 E248D181-K185 VanDerWaalsContact O-CB 3.24Å; D181-K185 WeakPolarHBondContact O-CB 3.19Å; D181-K185 PolarHBondContact O-N 2.97Å; V183-K185 VanDerWaalsContact C-N 3.27Å; V183-K185 PolarHBondContact O-N 2.67Å; K185-E248 IonicContact NZ-OE1 3.99Å; K185-E248 PolarHBondContact NZ-OE1 3.15Å; K185-E248 IonicContact NZ-OE2 3.96Å; K185-E248 PolarHBondContact NZ-OE2 3.34Å
186W97.1Very high96.4Very high19 Ų1956.6 Ų56.67%0.07231%0.307CS..Hα-helixtrans-100-26.2-168.8-68.6110.4000115.1W171 H182 V183 P188 N189 Q244 L245 E248W171-W186 HydrophobicContact CH2-CB 3.92Å; W171-W186 HydrophobicContact CZ2-CB 4.29Å; H182-W186 AromaticContact CE1-CD1 3.37Å; H182-W186 AromaticContact CE1-NE1 3.55Å; H182-W186 AromaticContact ND1-CD1 3.51Å; H182-W186 AromaticContact ND1-NE1 3.71Å; H182-W186 AromaticContact NE2-CD1 3.85Å; H182-W186 VanDerWaalsContact O-CD1 3.23Å; H182-W186 PolarHBondContact O-N 3.05Å; V183-W186 PolarHBondContact O-N 3.03Å; W186-P188 VanDerWaalsContact C-N 3.33Å; W186-N189 VanDerWaalsContact CE3-ND2 3.27Å; W186-N189 WeakPolarHBondContact CZ3-ND2 3.33Å; W186-N189 WeakPolarHBondContact O-CB 3.03Å; W186-N189 PolarHBondContact O-N 2.92Å; W186-Q244 HydrophobicContact CH2-CB 3.59Å; W186-Q244 HydrophobicContact CZ3-CB 4.06Å; W186-L245 HydrophobicContact CD2-CB 4.33Å; W186-L245 HydrophobicContact CD2-CD1 3.8Å; W186-L245 HydrophobicContact CE3-CB 4.17Å; W186-L245 HydrophobicContact CE3-CD1 4.47Å; W186-L245 HydrophobicContact CG-CD1 3.93Å; W186-L245 HydrophobicContact CH2-CB 4.13Å; W186-L245 HydrophobicContact CZ2-CB 4.24Å; W186-L245 HydrophobicContact CZ2-CD1 4.14Å; W186-L245 HydrophobicContact CZ3-CB 4.08Å; W186-E248 HydrophobicContact CZ2-CB 4.26Å; W186-E248 WeakPolarHBondContact CZ2-OE2 3.44Å; W186-E248 PolarHBondContact NE1-OE2 2.78Å
187F97.9Very high96.7Very high61 Ų6156.2 Ų56.227%0.26830%0.295SS..Hα-helixtrans-55-38.4176.5-178.1-95.3000114T168 W171 V172 F178 V183 N189 V190 V191T168-F187 HydrophobicContact CG2-CD2 4.33Å; T168-F187 HydrophobicContact CG2-CE2 4.04Å; W171-F187 HydrophobicContact CZ3-CB 4.38Å; V172-F187 HydrophobicContact CG2-CD2 3.94Å; V172-F187 HydrophobicContact CG2-CE2 4.3Å; F178-F187 HydrophobicContact CE1-CB 4.03Å; F178-F187 AromaticContact CE1-CD1 3.53Å; F178-F187 HydrophobicContact CE1-CD1 3.53Å; F178-F187 AromaticContact CE1-CD2 3.91Å; F178-F187 HydrophobicContact CE1-CD2 3.91Å; F178-F187 AromaticContact CE1-CE1 3.87Å; F178-F187 HydrophobicContact CE1-CE1 3.87Å; F178-F187 HydrophobicContact CE1-CE2 4.24Å; F178-F187 AromaticContact CE1-CG 3.55Å; F178-F187 HydrophobicContact CE1-CG 3.55Å; F178-F187 HydrophobicContact CE1-CZ 4.22Å; F178-F187 AromaticContact CZ-CD1 3.91Å; F178-F187 HydrophobicContact CZ-CD1 3.91Å; F178-F187 AromaticContact CZ-CD2 3.84Å; F178-F187 HydrophobicContact CZ-CD2 3.84Å; F178-F187 AromaticContact CZ-CE1 3.8Å; F178-F187 HydrophobicContact CZ-CE1 3.8Å; F178-F187 AromaticContact CZ-CE2 3.74Å; F178-F187 HydrophobicContact CZ-CE2 3.74Å; F178-F187 AromaticContact CZ-CG 3.93Å; F178-F187 HydrophobicContact CZ-CG 3.93Å; F178-F187 AromaticContact CZ-CZ 3.71Å; F178-F187 HydrophobicContact CZ-CZ 3.71Å; V183-F187 HydrophobicContact CG1-CB 4.35Å; V183-F187 WeakPolarHBondContact O-CB 3.45Å; V183-F187 PolarHBondContact O-N 2.89Å; F187-N189 PolarHBondContact O-N 3.47Å; F187-N189 VanDerWaalsContact O-N 3.14Å; F187-V190 WeakPolarHBondContact O-CB 3.18Å; F187-V190 PolarHBondContact O-N 2.98Å; F187-V191 HydrophobicContact CD1-CG2 3.88Å; F187-V191 HydrophobicContact CE1-CG2 3.46Å; F187-V191 VanDerWaalsContact CE1-CG2 3.46Å; F187-V191 HydrophobicContact CZ-CG2 4.09Å; F187-V191 PolarHBondContact O-N 3.43Å
188P98.3Very high96.9Very high59 Ų5958.2 Ų58.238%0.38331%0.31SS..Hα-helixtrans-54.7-32175.3-28.537000114T184 W186 V190 V191 V192T184-P188 WeakPolarHBondContact O-CD 3.47Å; T184-P188 WeakPolarHBondContact O-CG 3.24Å; W186-P188 VanDerWaalsContact C-N 3.33Å; P188-V190 VanDerWaalsContact C-N 3.27Å; P188-V190 PolarHBondContact O-N 2.84Å; P188-V191 WeakPolarHBondContact O-CB 3.43Å; P188-V191 PolarHBondContact O-N 3.42Å; P188-V191 VanDerWaalsContact O-N 3.12Å; P188-V192 WeakPolarHBondContact O-CG2 3.39Å; P188-V192 PolarHBondContact O-N 3.11Å
189N98.1Very high97Very high22 Ų2253.7 Ų53.712%0.11829%0.294CS..Hα-helixtrans-65.4-34.1178.9-64.43.2000111.6W186 F187 L193 Y237 S241W186-N189 VanDerWaalsContact CE3-ND2 3.27Å; W186-N189 WeakPolarHBondContact CZ3-ND2 3.33Å; W186-N189 WeakPolarHBondContact O-CB 3.03Å; W186-N189 PolarHBondContact O-N 2.92Å; F187-N189 PolarHBondContact O-N 3.47Å; F187-N189 VanDerWaalsContact O-N 3.14Å; N189-L193 WeakPolarHBondContact O-CB 3.33Å; N189-L193 PolarHBondContact O-N 3.34Å; N189-Y237 HydrophobicContact CB-CE1 3.94Å; N189-Y237 WeakPolarHBondContact O-CE1 3.48Å; N189-Y237 PolarHBondContact OD1-OH 3.23Å; N189-S241 PolarHBondContact ND2-OG 2.91Å
190V97.9Very high97.2Very high19 Ų1944.7 Ų44.712%0.11525%0.251CS..Hα-helixtrans-67-43.6173.1-175.10000110.3T168 F187 P188 V192 L193 Y194 W238T168-V190 HydrophobicContact CG2-CG1 3.96Å; T168-V190 HydrophobicContact CG2-CG2 4.4Å; F187-V190 WeakPolarHBondContact O-CB 3.18Å; F187-V190 PolarHBondContact O-N 2.98Å; P188-V190 VanDerWaalsContact C-N 3.27Å; P188-V190 PolarHBondContact O-N 2.84Å; V190-V192 VanDerWaalsContact C-N 3.34Å; V190-V192 PolarHBondContact O-N 3.34Å; V190-L193 WeakPolarHBondContact O-CB 3.37Å; V190-L193 PolarHBondContact O-N 3.23Å; V190-Y194 HydrophobicContact CG1-CD2 3.63Å; V190-Y194 HydrophobicContact CG1-CE2 3.66Å; V190-Y194 WeakPolarHBondContact O-CD2 3.46Å; V190-Y194 PolarHBondContact O-N 2.94Å; V190-W238 HydrophobicContact CG2-CH2 4Å; V190-W238 HydrophobicContact CG2-CZ3 4.15Å
191V98.4Very high97.3Very high68 Ų6846.2 Ų46.241%0.41226%0.257SS..Hα-helixtrans-60.4-44.8177.5178.40000111.1F187 P188 Y194 S195F187-V191 HydrophobicContact CD1-CG2 3.88Å; F187-V191 HydrophobicContact CE1-CG2 3.46Å; F187-V191 VanDerWaalsContact CE1-CG2 3.46Å; F187-V191 HydrophobicContact CZ-CG2 4.09Å; F187-V191 PolarHBondContact O-N 3.43Å; P188-V191 WeakPolarHBondContact O-CB 3.43Å; P188-V191 PolarHBondContact O-N 3.42Å; P188-V191 VanDerWaalsContact O-N 3.12Å; V191-Y194 PolarHBondContact O-N 3.01Å; V191-S195 VanDerWaalsContact O-CB 3.29Å; V191-S195 WeakPolarHBondContact O-CB 3.37Å; V191-S195 PolarHBondContact O-N 3.44Å; V191-S195 PolarHBondContact O-OG 3.4Å
192V98.6Very high97.4Very high54 Ų5444.9 Ų44.933%0.32725%0.248SC..Hα-helixtrans-61.7-46.4176.4172.60000110.7P188 V190 Y194 S195 L196 Y237P188-V192 WeakPolarHBondContact O-CG2 3.39Å; P188-V192 PolarHBondContact O-N 3.11Å; V190-V192 VanDerWaalsContact C-N 3.34Å; V190-V192 PolarHBondContact O-N 3.34Å; V192-Y194 PolarHBondContact O-N 3.45Å; V192-S195 PolarHBondContact O-N 2.73Å; V192-L196 HydrophobicContact CG1-CD1 3.99Å; V192-L196 HydrophobicContact CG1-CG 4.43Å; V192-L196 WeakPolarHBondContact O-CG 3.43Å; V192-L196 PolarHBondContact O-N 3.27Å; V192-Y237 HydrophobicContact CB-CD1 4.34Å; V192-Y237 HydrophobicContact CB-CE1 3.65Å; V192-Y237 HydrophobicContact CG1-CD1 3.83Å; V192-Y237 HydrophobicContact CG1-CD2 4.26Å; V192-Y237 HydrophobicContact CG1-CE1 3.53Å; V192-Y237 HydrophobicContact CG1-CE2 4Å; V192-Y237 HydrophobicContact CG1-CG 4.18Å; V192-Y237 HydrophobicContact CG2-CE1 4.5Å
193L98.3Very high97.5Very high12 Ų1246.6 Ų46.66%0.06326%0.255CS..Hα-helixtrans-54.8-55.4176.6170.263000111.8M101 N189 V190 S195 L196 I197 A234 W238M101-L193 HydrophobicContact CE-CD1 3.47Å; M101-L193 VanDerWaalsContact CE-CD1 3.47Å; N189-L193 WeakPolarHBondContact O-CB 3.33Å; N189-L193 PolarHBondContact O-N 3.34Å; V190-L193 WeakPolarHBondContact O-CB 3.37Å; V190-L193 PolarHBondContact O-N 3.23Å; L193-S195 VanDerWaalsContact C-N 3.26Å; L193-S195 PolarHBondContact O-N 2.98Å; L193-L196 PolarHBondContact O-N 2.87Å; L193-I197 HydrophobicContact CD1-CD1 3.65Å; L193-I197 HydrophobicContact CD1-CG1 4.14Å; L193-I197 HydrophobicContact CG-CD1 3.95Å; L193-I197 WeakPolarHBondContact O-CG1 3.41Å; L193-I197 PolarHBondContact O-N 3.25Å; L193-A234 HydrophobicContact CD1-CB 3.97Å; L193-W238 HydrophobicContact CB-CE3 4.03Å; L193-W238 HydrophobicContact CB-CZ3 4.35Å; L193-W238 HydrophobicContact CD1-CB 4.24Å; L193-W238 HydrophobicContact CD1-CG 4.48Å; L193-W238 HydrophobicContact CD2-CD2 3.57Å; L193-W238 HydrophobicContact CD2-CE3 3.54Å; L193-W238 HydrophobicContact CD2-CG 4.08Å; L193-W238 HydrophobicContact CD2-CH2 4.15Å; L193-W238 HydrophobicContact CD2-CZ2 4.16Å; L193-W238 HydrophobicContact CD2-CZ3 3.85Å; L193-W238 HydrophobicContact CG-CE3 4.26Å
194Y98.1Very high97.3Very high61 Ų6148.4 Ų48.424%0.23926%0.262CS..Hα-helixtrans-65.7-31.6-178-84.6-86.5000112.1I161 G164 I165 V190 V191 V192 I197 A198I161-Y194 HydrophobicContact CG2-CE1 4.2Å; I161-Y194 PolarHBondContact O-OH 3.13Å; G164-Y194 WeakPolarHBondContact CA-OH 3.47Å; I165-Y194 HydrophobicContact CG1-CE1 4.31Å; I165-Y194 PolarHBondContact N-OH 2.93Å; V190-Y194 HydrophobicContact CG1-CD2 3.63Å; V190-Y194 HydrophobicContact CG1-CE2 3.66Å; V190-Y194 WeakPolarHBondContact O-CD2 3.46Å; V190-Y194 PolarHBondContact O-N 2.94Å; V191-Y194 PolarHBondContact O-N 3.01Å; V192-Y194 PolarHBondContact O-N 3.45Å; Y194-I197 PolarHBondContact O-N 2.83Å; Y194-A198 WeakPolarHBondContact O-CB 3.25Å; Y194-A198 PolarHBondContact O-N 3.48Å
195S98.6Very high97.1Very high68 Ų6847.8 Ų47.848%0.47626%0.258SS..Hα-helixtrans-65.2-43.3174.5-59.90000111.8V191 V192 L193 A198 A199V191-S195 VanDerWaalsContact O-CB 3.29Å; V191-S195 WeakPolarHBondContact O-CB 3.37Å; V191-S195 PolarHBondContact O-N 3.44Å; V191-S195 PolarHBondContact O-OG 3.4Å; V192-S195 PolarHBondContact O-N 2.73Å; L193-S195 VanDerWaalsContact C-N 3.26Å; L193-S195 PolarHBondContact O-N 2.98Å; S195-A198 PolarHBondContact O-N 3.2Å; S195-A199 VanDerWaalsContact O-CB 3.31Å; S195-A199 WeakPolarHBondContact O-CB 3.45Å; S195-A199 PolarHBondContact O-N 2.79Å
196L98.6Very high97Very high41 Ų4145.1 Ų45.122%0.21525%0.251CS..Hα-helixtrans-65.3-43.4176.3-68.7169.8000111.7V192 L193 A199 A200 F230 A234V192-L196 HydrophobicContact CG1-CD1 3.99Å; V192-L196 HydrophobicContact CG1-CG 4.43Å; V192-L196 WeakPolarHBondContact O-CG 3.43Å; V192-L196 PolarHBondContact O-N 3.27Å; L193-L196 PolarHBondContact O-N 2.87Å; L196-A199 PolarHBondContact O-N 3.49Å; L196-A200 PolarHBondContact O-N 3.44Å; L196-F230 HydrophobicContact CD2-CD1 3.77Å; L196-F230 HydrophobicContact CD2-CE1 4.14Å; L196-A234 HydrophobicContact CB-CB 3.89Å; L196-A234 HydrophobicContact CD1-CB 4.32Å
197I98.2Very high96.8Very high31 Ų3147.9 Ų47.916%0.15927%0.265CS..Hα-helixtrans-63.8-44.2176.6-67.2171.6000110.9I161 L193 Y194 A200 F201 A234I161-I197 HydrophobicContact CG2-CG2 4.29Å; L193-I197 HydrophobicContact CD1-CD1 3.65Å; L193-I197 HydrophobicContact CD1-CG1 4.14Å; L193-I197 HydrophobicContact CG-CD1 3.95Å; L193-I197 WeakPolarHBondContact O-CG1 3.41Å; L193-I197 PolarHBondContact O-N 3.25Å; Y194-I197 PolarHBondContact O-N 2.83Å; I197-A200 WeakPolarHBondContact O-CB 3.12Å; I197-A200 PolarHBondContact O-N 3.17Å; I197-F201 PolarHBondContact O-N 3.49Å; I197-A234 HydrophobicContact CG1-CB 4.16Å
198A97.7Very high96.6Very high60 Ų6047.4 Ų47.450%0.49627%0.267SS..Hα-helixtrans-63.2-42.3177.700000111.6Y194 S195 F201 M202Y194-A198 WeakPolarHBondContact O-CB 3.25Å; Y194-A198 PolarHBondContact O-N 3.48Å; S195-A198 PolarHBondContact O-N 3.2Å; A198-F201 PolarHBondContact O-N 3.28Å; A198-M202 WeakPolarHBondContact O-CB 3.34Å; A198-M202 PolarHBondContact O-N 3.06Å
199A98.2Very high96.5Very high20 Ų2045.2 Ų45.217%0.16525%0.253CS..Hα-helixtrans-60.9-47.2174.600000111.4S195 L196 F201 M202 F203 F230S195-A199 VanDerWaalsContact O-CB 3.31Å; S195-A199 WeakPolarHBondContact O-CB 3.45Å; S195-A199 PolarHBondContact O-N 2.79Å; L196-A199 PolarHBondContact O-N 3.49Å; A199-F201 PolarHBondContact O-N 3.02Å; A199-M202 WeakPolarHBondContact O-CB 3.05Å; A199-M202 PolarHBondContact O-N 3.45Å; A199-F203 VanDerWaalsContact O-CD2 3.23Å; A199-F203 WeakPolarHBondContact O-CD2 3.44Å; A199-F203 PolarHBondContact O-N 2.73Å; A199-F203 VanDerWaalsContact O-N 3.13Å; A199-F230 HydrophobicContact CB-CD1 3.82Å; A199-F230 HydrophobicContact CB-CE1 3.81Å; A199-F230 HydrophobicContact CB-CG 4.26Å; A199-F230 HydrophobicContact CB-CZ 4.24Å
200A97.6Very high96.4Very high0 Ų045.9 Ų45.90%026%0.256CS..Hα-helixtrans-53.3-54.7174.600000110.6L196 I197 M202 F203 Y204 W227 F230 I231L196-A200 PolarHBondContact O-N 3.44Å; I197-A200 WeakPolarHBondContact O-CB 3.12Å; I197-A200 PolarHBondContact O-N 3.17Å; A200-M202 VanDerWaalsContact C-N 3.28Å; A200-M202 PolarHBondContact O-N 2.92Å; A200-F203 PolarHBondContact O-N 2.95Å; A200-F203 VanDerWaalsContact O-N 3.13Å; A200-Y204 PolarHBondContact O-N 3.12Å; A200-W227 VanDerWaalsContact C-CE3 3.43Å; A200-W227 HydrophobicContact CB-CD2 4.39Å; A200-W227 HydrophobicContact CB-CE3 3.76Å; A200-W227 HydrophobicContact CB-CZ3 4.11Å; A200-F230 HydrophobicContact CB-CB 3.61Å; A200-I231 HydrophobicContact CB-CD1 3.77Å; A200-I231 HydrophobicContact CB-CG1 3.86Å
201F95.2Very high96.2Very high65 Ų6552.1 Ų52.129%0.28528%0.281SS..Hα-helixtrans-61.9-35.7-177.1-168.8-115.2000112.8V150 I197 A198 A199 Y204 V205 W227V150-F201 HydrophobicContact CG2-CZ 4.42Å; I197-F201 PolarHBondContact O-N 3.49Å; A198-F201 PolarHBondContact O-N 3.28Å; A199-F201 PolarHBondContact O-N 3.02Å; F201-Y204 HydrophobicContact CE2-CD1 4.47Å; F201-Y204 PolarHBondContact O-N 2.9Å; F201-V205 HydrophobicContact CD1-CG2 4.06Å; F201-V205 HydrophobicContact CD2-CG2 4.07Å; F201-V205 HydrophobicContact CE1-CG2 3.7Å; F201-V205 HydrophobicContact CE2-CG2 3.7Å; F201-V205 HydrophobicContact CG-CG2 4.24Å; F201-V205 HydrophobicContact CZ-CG2 3.5Å; F201-V205 WeakPolarHBondContact O-CB 3.29Å; F201-V205 WeakPolarHBondContact O-CG2 3.46Å; F201-V205 PolarHBondContact O-N 3.36Å; F201-W227 HydrophobicContact CB-CZ3 4.1Å; F201-W227 AromaticContact CD2-CZ3 3.98Å; F201-W227 HydrophobicContact CD2-CZ3 3.98Å
202M95.7Very high96.1Very high107 Ų10753.8 Ų53.853%0.52729%0.288SS..Hα-helixtrans-59.1-49.2173.2-175.6-126.4-66.300111.6A198 A199 A200 Y204 V205 T206A198-M202 WeakPolarHBondContact O-CB 3.34Å; A198-M202 PolarHBondContact O-N 3.06Å; A199-M202 WeakPolarHBondContact O-CB 3.05Å; A199-M202 PolarHBondContact O-N 3.45Å; A200-M202 VanDerWaalsContact C-N 3.28Å; A200-M202 PolarHBondContact O-N 2.92Å; M202-Y204 VanDerWaalsContact C-N 3.35Å; M202-Y204 PolarHBondContact O-N 2.96Å; M202-V205 PolarHBondContact O-N 3Å; M202-T206 HydrophobicContact CG-CG2 4.17Å; M202-T206 VanDerWaalsContact O-CB 3.31Å; M202-T206 WeakPolarHBondContact O-CB 3.46Å; M202-T206 WeakPolarHBondContact O-CG2 3.49Å; M202-T206 PolarHBondContact O-N 2.98Å; M202-T206 PolarHBondContact O-OG1 3.34Å
203F96.1Very high96Very high41 Ų4157.2 Ų57.218%0.1829%0.294CS..Hα-helixtrans-59.9-45.3175.3-78.7-73000111.6A199 A200 V205 M207 V208 S223 W226 F230A199-F203 VanDerWaalsContact O-CD2 3.23Å; A199-F203 WeakPolarHBondContact O-CD2 3.44Å; A199-F203 PolarHBondContact O-N 2.73Å; A199-F203 VanDerWaalsContact O-N 3.13Å; A200-F203 PolarHBondContact O-N 2.95Å; A200-F203 VanDerWaalsContact O-N 3.13Å; F203-V205 PolarHBondContact O-N 3.39Å; F203-M207 PolarHBondContact O-N 3.25Å; F203-M207 VanDerWaalsContact O-N 3.11Å; F203-V208 WeakPolarHBondContact CD1-O 3.39Å; F203-S223 WeakPolarHBondContact O-CB 3.48Å; F203-S223 PolarHBondContact O-OG 3.27Å; F203-W226 HydrophobicContact CB-CB 4.01Å; F203-W226 HydrophobicContact CD1-CB 3.78Å; F203-W226 AromaticContact CD1-CG 3.99Å; F203-W226 HydrophobicContact CD1-CG 3.99Å; F203-W226 HydrophobicContact CD2-CB 3.77Å; F203-W226 HydrophobicContact CD2-CG 4.47Å; F203-W226 HydrophobicContact CE1-CB 4.18Å; F203-W226 AromaticContact CE1-CD1 3.98Å; F203-W226 AromaticContact CE1-CG 3.97Å; F203-W226 HydrophobicContact CE1-CG 3.97Å; F203-W226 HydrophobicContact CE2-CB 4.2Å; F203-W226 HydrophobicContact CE2-CG 4.47Å; F203-W226 HydrophobicContact CG-CB 3.57Å; F203-W226 HydrophobicContact CG-CG 4.26Å; F203-W226 HydrophobicContact CZ-CB 4.38Å; F203-W226 HydrophobicContact CZ-CD2 4.46Å; F203-W226 HydrophobicContact CZ-CG 4.23Å; F203-F230 AromaticContact CD2-CD2 3.94Å; F203-F230 HydrophobicContact CD2-CD2 3.94Å; F203-F230 AromaticContact CD2-CE2 3.78Å; F203-F230 HydrophobicContact CD2-CE2 3.78Å; F203-F230 HydrophobicContact CE2-CD2 4Å; F203-F230 AromaticContact CE2-CE2 3.35Å; F203-F230 HydrophobicContact CE2-CE2 3.35Å; F203-F230 HydrophobicContact CE2-CZ 4.06Å; F203-F230 HydrophobicContact CZ-CE2 4.29Å
204Y93Very high95.8Very high37 Ų3761.8 Ų61.815%0.14533%0.325CS..Hα-helixtrans-59.4-46.9-179.4178.5-90.1000113.1R149 H154 A200 F201 M202 W227R149-Y204 WeakPolarHBondContact CD-O 3.47Å; R149-Y204 HydrophobicContact CG-CE1 4.11Å; R149-Y204 PolarHBondContact NH1-O 3.31Å; H154-Y204 AromaticContact CD2-CE1 3.67Å; H154-Y204 AromaticContact NE2-CE1 3.21Å; H154-Y204 WeakPolarHBondContact NE2-CE1 3.32Å; H154-Y204 AromaticContact NE2-CZ 3.35Å; H154-Y204 PolarHBondContact NE2-OH 2.89Å; A200-Y204 PolarHBondContact O-N 3.12Å; F201-Y204 HydrophobicContact CE2-CD1 4.47Å; F201-Y204 PolarHBondContact O-N 2.9Å; M202-Y204 VanDerWaalsContact C-N 3.35Å; M202-Y204 PolarHBondContact O-N 2.96Å; Y204-W227 VanDerWaalsContact CB-CE3 3.42Å; Y204-W227 HydrophobicContact CD2-CD2 4.16Å; Y204-W227 HydrophobicContact CD2-CE3 4.27Å; Y204-W227 HydrophobicContact CD2-CG 4.4Å; Y204-W227 HydrophobicContact CG-CD2 4.38Å; Y204-W227 HydrophobicContact CG-CE3 4.03Å; Y204-W227 HydrophobicContact CG-CZ3 4.39Å
205V92.3Very high95.6Very high52 Ų5261.3 Ų61.332%0.31534%0.339SS..Hα-helixtrans-76.5-42.5-175.9174.30000111.9V150 F201 M202 F203V150-V205 HydrophobicContact CG2-CG1 4.1Å; V150-V205 HydrophobicContact CG2-CG2 3.79Å; F201-V205 HydrophobicContact CD1-CG2 4.06Å; F201-V205 HydrophobicContact CD2-CG2 4.07Å; F201-V205 HydrophobicContact CE1-CG2 3.7Å; F201-V205 HydrophobicContact CE2-CG2 3.7Å; F201-V205 HydrophobicContact CG-CG2 4.24Å; F201-V205 HydrophobicContact CZ-CG2 3.5Å; F201-V205 WeakPolarHBondContact O-CB 3.29Å; F201-V205 WeakPolarHBondContact O-CG2 3.46Å; F201-V205 PolarHBondContact O-N 3.36Å; M202-V205 PolarHBondContact O-N 3Å; F203-V205 PolarHBondContact O-N 3.39Å
206T92.6Very high95.4Very high51 Ų5165.4 Ų65.431%0.31335%0.348SS..Hα-helixtrans-77-25.5-174.161.30000113.2M202 V208 K211M202-T206 HydrophobicContact CG-CG2 4.17Å; M202-T206 VanDerWaalsContact O-CB 3.31Å; M202-T206 WeakPolarHBondContact O-CB 3.46Å; M202-T206 WeakPolarHBondContact O-CG2 3.49Å; M202-T206 PolarHBondContact O-N 2.98Å; M202-T206 PolarHBondContact O-OG1 3.34Å; T206-V208 PolarHBondContact O-N 2.94Å; T206-V208 PolarHBondContact OG1-N 3.49Å; T206-K211 WeakPolarHBondContact O-CD 3.35Å
207M93.1Very high95.3Very high76 Ų7666 Ų6637%0.37435%0.349SS..  trans57.225.2-172.9-56.9-178.961.200113.2F203 E210 K211F203-M207 PolarHBondContact O-N 3.25Å; F203-M207 VanDerWaalsContact O-N 3.11Å; M207-E210 WeakPolarHBondContact O-CG 3.11Å; M207-E210 PolarHBondContact O-N 3.03Å; M207-K211 HydrophobicContact CB-CB 4.11Å; M207-K211 WeakPolarHBondContact O-CB 3.48Å; M207-K211 PolarHBondContact O-N 2.9Å
208V94.6Very high95.1Very high51 Ų5169 Ų6931%0.30937%0.366SS..THydrogen-bonded Turntrans-84.1135.8172.3173.40000107.5F203 T206 L212 S223F203-V208 WeakPolarHBondContact CD1-O 3.39Å; T206-V208 PolarHBondContact O-N 2.94Å; T206-V208 PolarHBondContact OG1-N 3.49Å; V208-L212 HydrophobicContact CG1-CD1 4.02Å; V208-L212 HydrophobicContact CG2-CD1 4.21Å; V208-L212 HydrophobicContact CG2-CG 4.28Å; V208-S223 WeakPolarHBondContact O-CB 3.41Å
209P96.2Very high94.9Very high13 Ų1369 Ų698%0.08436%0.359CS..THydrogen-bonded Turncis-93.2-1212.436.1-36.4000116.6K211 L212 W213 F217 G221P209-K211 VanDerWaalsContact C-N 3.25Å; P209-K211 PolarHBondContact O-N 3.28Å; P209-L212 PolarHBondContact O-N 3.26Å; P209-W213 HydrophobicContact CB-CE3 3.82Å; P209-W213 HydrophobicContact CB-CZ3 3.85Å; P209-W213 PolarHBondContact O-N 3.48Å; P209-W213 VanDerWaalsContact O-N 3.1Å; P209-F217 HydrophobicContact CB-CD1 4.49Å; P209-F217 HydrophobicContact CB-CD2 3.95Å; P209-F217 HydrophobicContact CB-CE1 4.23Å; P209-F217 HydrophobicContact CB-CE2 3.68Å; P209-F217 HydrophobicContact CB-CG 4.36Å; P209-F217 HydrophobicContact CB-CZ 3.82Å; P209-F217 HydrophobicContact CG-CB 4.44Å; P209-F217 HydrophobicContact CG-CD1 3.59Å; P209-F217 HydrophobicContact CG-CD2 3.76Å; P209-F217 HydrophobicContact CG-CE1 3.64Å; P209-F217 HydrophobicContact CG-CE2 3.83Å; P209-F217 HydrophobicContact CG-CG 3.65Å; P209-F217 HydrophobicContact CG-CZ 3.76Å; P209-G221 VanDerWaalsContact CD-O 3.23Å; P209-G221 WeakPolarHBondContact CD-O 3.42Å; P209-G221 WeakPolarHBondContact CG-O 3.34Å
210E95.4Very high94.9Very high37 Ų3772.5 Ų72.517%0.17338%0.378CS..THydrogen-bonded Turntrans-64.1-27-171.866.1-87-155.100114.1M207 L212 W213 F217 C222 S223M207-E210 WeakPolarHBondContact O-CG 3.11Å; M207-E210 PolarHBondContact O-N 3.03Å; E210-L212 VanDerWaalsContact C-N 3.31Å; E210-W213 CarbonylContact O-C 3.59Å; E210-F217 HydrophobicContact CB-CB 4.29Å; E210-C222 WeakPolarHBondContact OE2-CA 2.96Å; E210-S223 VanDerWaalsContact OE1-CB 3.27Å; E210-S223 WeakPolarHBondContact OE1-CB 3.25Å; E210-S223 PolarHBondContact OE1-N 3.06Å; E210-S223 PolarHBondContact OE1-OG 2.71Å; E210-S223 VanDerWaalsContact OE1-OG 3.1Å; E210-S223 WeakPolarHBondContact OE2-CB 3.43Å; E210-S223 PolarHBondContact OE2-N 2.78Å
211K93.6Very high94.8Very high149 Ų14973.1 Ų73.165%0.64839%0.385SS*.THydrogen-bonded Turntrans-66.9-32.4173.2-174.2179.5-179.6-1770112.4T206 M207 P209T206-K211 WeakPolarHBondContact O-CD 3.35Å; M207-K211 HydrophobicContact CB-CB 4.11Å; M207-K211 WeakPolarHBondContact O-CB 3.48Å; M207-K211 PolarHBondContact O-N 2.9Å; P209-K211 VanDerWaalsContact C-N 3.25Å; P209-K211 PolarHBondContact O-N 3.28Å
212L96Very high94.9Very high104 Ų10470.9 Ų70.955%0.54538%0.377SS..THydrogen-bonded Turntrans-86.5-32.8-179-62.3179.1000112.1V208 P209 E210V208-L212 HydrophobicContact CG1-CD1 4.02Å; V208-L212 HydrophobicContact CG2-CD1 4.21Å; V208-L212 HydrophobicContact CG2-CG 4.28Å; P209-L212 PolarHBondContact O-N 3.26Å; E210-L212 VanDerWaalsContact C-N 3.31Å
213W96.3Very high95Very high125 Ų12565.8 Ų65.847%0.47335%0.352SS..SBendtrans-132.580.3179.2-57-67.4000111.7P209 E210 K216 F217P209-W213 HydrophobicContact CB-CE3 3.82Å; P209-W213 HydrophobicContact CB-CZ3 3.85Å; P209-W213 PolarHBondContact O-N 3.48Å; P209-W213 VanDerWaalsContact O-N 3.1Å; E210-W213 CarbonylContact O-C 3.59Å; W213-K216 HydrophobicContact CB-CB 4.18Å; W213-K216 HydrophobicContact CB-CD 3.9Å; W213-K216 HydrophobicContact CB-CG 4.12Å; W213-K216 HydrophobicContact CG-CD 4.32Å; W213-K216 PolarHBondContact O-N 3.47Å; W213-F217 HydrophobicContact CB-CD2 4.32Å; W213-F217 HydrophobicContact CB-CE2 3.97Å; W213-F217 HydrophobicContact CD2-CE2 4.25Å; W213-F217 AromaticContact CE3-CE2 3.59Å; W213-F217 HydrophobicContact CE3-CE2 3.59Å; W213-F217 HydrophobicContact CE3-CZ 4.12Å; W213-F217 HydrophobicContact CG-CE2 4.46Å; W213-F217 HydrophobicContact CZ3-CE2 4.4Å
214P95.2Very high95Very high109 Ų10965.5 Ų65.571%0.70835%0.351SS*.THydrogen-bonded Turntrans-57.2138.7177.4-24.134.6000111.9K216P214-K216 VanDerWaalsContact C-N 3.27Å; P214-K216 PolarHBondContact O-N 3.17Å
215G93.2Very high95.3Very high51 Ų5164 Ų6453%0.52635%0.345SS..THydrogen-bonded Turntrans83.2-16178.900000115.6D218G215-D218 WeakPolarHBondContact CA-OD1 3.21Å; G215-D218 WeakPolarHBondContact CA-OD2 3.42Å
216K95.5Very high95.5Very high153 Ų15366.6 Ų66.667%0.66535%0.349SS*.THydrogen-bonded Turntrans-82.2-33-179.6-70.1-162.4-176.5177.90113.7W213 P214W213-K216 HydrophobicContact CB-CB 4.18Å; W213-K216 HydrophobicContact CB-CD 3.9Å; W213-K216 HydrophobicContact CB-CG 4.12Å; W213-K216 HydrophobicContact CG-CD 4.32Å; W213-K216 PolarHBondContact O-N 3.47Å; P214-K216 VanDerWaalsContact C-N 3.27Å; P214-K216 PolarHBondContact O-N 3.17Å
217F95.6Very high95.8Very high53 Ų5366.4 Ų66.423%0.23234%0.343CS..SBendtrans-110.424.7-171.9-62.1-85000112.2P209 E210 W213 V219 V220 C222P209-F217 HydrophobicContact CB-CD1 4.49Å; P209-F217 HydrophobicContact CB-CD2 3.95Å; P209-F217 HydrophobicContact CB-CE1 4.23Å; P209-F217 HydrophobicContact CB-CE2 3.68Å; P209-F217 HydrophobicContact CB-CG 4.36Å; P209-F217 HydrophobicContact CB-CZ 3.82Å; P209-F217 HydrophobicContact CG-CB 4.44Å; P209-F217 HydrophobicContact CG-CD1 3.59Å; P209-F217 HydrophobicContact CG-CD2 3.76Å; P209-F217 HydrophobicContact CG-CE1 3.64Å; P209-F217 HydrophobicContact CG-CE2 3.83Å; P209-F217 HydrophobicContact CG-CG 3.65Å; P209-F217 HydrophobicContact CG-CZ 3.76Å; E210-F217 HydrophobicContact CB-CB 4.29Å; W213-F217 HydrophobicContact CB-CD2 4.32Å; W213-F217 HydrophobicContact CB-CE2 3.97Å; W213-F217 HydrophobicContact CD2-CE2 4.25Å; W213-F217 AromaticContact CE3-CE2 3.59Å; W213-F217 HydrophobicContact CE3-CE2 3.59Å; W213-F217 HydrophobicContact CE3-CZ 4.12Å; W213-F217 HydrophobicContact CG-CE2 4.46Å; W213-F217 HydrophobicContact CZ3-CE2 4.4Å; F217-V219 VanDerWaalsContact C-N 3.28Å; F217-V219 PolarHBondContact O-N 2.89Å; F217-V220 WeakPolarHBondContact CA-O 3.32Å; F217-V220 WeakPolarHBondContact CD1-O 3.48Å; F217-C222 HydrophobicContact CB-CB 4.42Å; F217-C222 WeakPolarHBondContact O-CB 3.22Å
218D93.4Very high96Very high96 Ų9662.9 Ų62.951%0.51333%0.325SS..SBendtrans-66.2-30.5-173.8-69.1-2.7000112.7N15 G215N15-D218 VanDerWaalsContact CA-O 3.25Å; N15-D218 WeakPolarHBondContact CA-O 3.48Å; N15-D218 WeakPolarHBondContact CB-O 3.33Å; G215-D218 WeakPolarHBondContact CA-OD1 3.21Å; G215-D218 WeakPolarHBondContact CA-OD2 3.42Å
219V95.4Very high96.2Very high59 Ų5964.1 Ų64.136%0.35833%0.33SS..SBendtrans-110.2-38.9-179.1-177.60000112.4I13 F217 Q225I13-V219 HydrophobicContact CG2-CG1 3.61Å; F217-V219 VanDerWaalsContact C-N 3.28Å; F217-V219 PolarHBondContact O-N 2.89Å; V219-Q225 PolarHBondContact O-NE2 3.45Å
220V97.4Very high96.3Very high94 Ų9465.9 Ų65.957%0.5734%0.336SS*.SBendtrans-134136.2-174.6-175.80000110.4I18 F217I18-V220 HydrophobicContact CD1-CB 4.09Å; I18-V220 HydrophobicContact CD1-CG1 3.84Å; I18-V220 HydrophobicContact CD1-CG2 3.86Å; F217-V220 WeakPolarHBondContact CA-O 3.32Å; F217-V220 WeakPolarHBondContact CD1-O 3.48Å
221G95.5Very high96.5Very high13 Ų1365.2 Ų65.213%0.13433%0.333CS..SBendtrans84.512.7170.400000115.4P209 W226P209-G221 VanDerWaalsContact CD-O 3.23Å; P209-G221 WeakPolarHBondContact CD-O 3.42Å; P209-G221 WeakPolarHBondContact CG-O 3.34Å; G221-W226 PolarHBondContact O-NE1 3.33Å
222C96.8Very high96.7Very high18 Ų1859.1 Ų59.112%0.12231%0.308CS..  trans-68.6158.5172.671.80000111.6E210 F217 H224 Q225 W226E210-C222 WeakPolarHBondContact OE2-CA 2.96Å; F217-C222 HydrophobicContact CB-CB 4.42Å; F217-C222 WeakPolarHBondContact O-CB 3.22Å; C222-H224 PolarHBondContact O-N 2.84Å; C222-Q225 WeakPolarHBondContact O-CB 2.97Å; C222-Q225 PolarHBondContact O-N 3.1Å; C222-Q225 VanDerWaalsContact SG-CG 3.56Å; C222-W226 PolarHBondContact O-N 3.47Å
223S97.2Very high96.9Very high0 Ų055.4 Ų55.40%030%0.295CS..Hα-helixtrans-61.7-31.3-173.198.10000113.2F203 V208 E210 Q225 W226 W227F203-S223 WeakPolarHBondContact O-CB 3.48Å; F203-S223 PolarHBondContact O-OG 3.27Å; V208-S223 WeakPolarHBondContact O-CB 3.41Å; E210-S223 VanDerWaalsContact OE1-CB 3.27Å; E210-S223 WeakPolarHBondContact OE1-CB 3.25Å; E210-S223 PolarHBondContact OE1-N 3.06Å; E210-S223 PolarHBondContact OE1-OG 2.71Å; E210-S223 VanDerWaalsContact OE1-OG 3.1Å; E210-S223 WeakPolarHBondContact OE2-CB 3.43Å; E210-S223 PolarHBondContact OE2-N 2.78Å; S223-Q225 VanDerWaalsContact C-N 3.32Å; S223-Q225 PolarHBondContact O-N 3.05Å; S223-W226 PolarHBondContact O-N 3.3Å; S223-W227 PolarHBondContact O-N 2.73Å
224H96.9Very high97Very high34 Ų3449.5 Ų49.516%0.15727%0.273CS..Hα-helixtrans-67.9-34177.3-15877.3000111.9H73 C222 W227 H228H73-H224 AromaticContact CE1-CD2 3.5Å; H73-H224 AromaticContact CE1-NE2 3.18Å; H73-H224 PolarHBondContact CE1-NE2 2.96Å; H73-H224 AromaticContact NE2-CD2 3.71Å; H73-H224 AromaticContact NE2-NE2 3.08Å; H73-H224 PolarHBondContact NE2-NE2 3.41Å; C222-H224 PolarHBondContact O-N 2.84Å; H224-W227 WeakPolarHBondContact O-CB 3.15Å; H224-W227 PolarHBondContact O-N 3.17Å; H224-H228 AromaticContact CD2-CD2 3.59Å; H224-H228 AromaticContact CD2-NE2 3.46Å; H224-H228 PolarHBondContact CD2-NE2 3.23Å; H224-H228 AromaticContact NE2-CD2 3.63Å; H224-H228 AromaticContact NE2-NE2 3.19Å; H224-H228 PolarHBondContact NE2-NE2 2.98Å; H224-H228 VanDerWaalsContact NE2-NE2 3.19Å; H224-H228 PolarHBondContact O-CD2 2.98Å; H224-H228 PolarHBondContact O-N 3.47Å; H224-H228 VanDerWaalsContact O-N 3.07Å
225Q98.3Very high97.2Very high7 Ų744.8 Ų44.83%0.03324%0.241CC..Hα-helixtrans-66.6-42.1173.2-67.4172.18.500110.8I18 N19 V219 C222 S223 W227 H228 I229I18-Q225 HydrophobicContact CB-CG 3.79Å; I18-Q225 VanDerWaalsContact CD1-OE1 3.22Å; I18-Q225 HydrophobicContact CG2-CB 3.85Å; I18-Q225 HydrophobicContact CG2-CG 3.64Å; N19-Q225 WeakPolarHBondContact OD1-CG 3.16Å; V219-Q225 PolarHBondContact O-NE2 3.45Å; C222-Q225 WeakPolarHBondContact O-CB 2.97Å; C222-Q225 PolarHBondContact O-N 3.1Å; C222-Q225 VanDerWaalsContact SG-CG 3.56Å; S223-Q225 VanDerWaalsContact C-N 3.32Å; S223-Q225 PolarHBondContact O-N 3.05Å; Q225-W227 PolarHBondContact O-N 2.86Å; Q225-H228 WeakPolarHBondContact O-CB 3.42Å; Q225-H228 PolarHBondContact O-N 3.35Å; Q225-I229 WeakPolarHBondContact O-CG1 3.21Å; Q225-I229 PolarHBondContact O-N 2.92Å
226W98.3Very high97.4Very high105 Ų10544.2 Ų44.240%0.39823%0.226SC..Hα-helixtrans-61.6-43173.7-70.2109.2000112F203 G221 C222 S223 H228 I229 F230F203-W226 HydrophobicContact CB-CB 4.01Å; F203-W226 HydrophobicContact CD1-CB 3.78Å; F203-W226 AromaticContact CD1-CG 3.99Å; F203-W226 HydrophobicContact CD1-CG 3.99Å; F203-W226 HydrophobicContact CD2-CB 3.77Å; F203-W226 HydrophobicContact CD2-CG 4.47Å; F203-W226 HydrophobicContact CE1-CB 4.18Å; F203-W226 AromaticContact CE1-CD1 3.98Å; F203-W226 AromaticContact CE1-CG 3.97Å; F203-W226 HydrophobicContact CE1-CG 3.97Å; F203-W226 HydrophobicContact CE2-CB 4.2Å; F203-W226 HydrophobicContact CE2-CG 4.47Å; F203-W226 HydrophobicContact CG-CB 3.57Å; F203-W226 HydrophobicContact CG-CG 4.26Å; F203-W226 HydrophobicContact CZ-CB 4.38Å; F203-W226 HydrophobicContact CZ-CD2 4.46Å; F203-W226 HydrophobicContact CZ-CG 4.23Å; G221-W226 PolarHBondContact O-NE1 3.33Å; C222-W226 PolarHBondContact O-N 3.47Å; S223-W226 PolarHBondContact O-N 3.3Å; W226-H228 VanDerWaalsContact C-N 3.31Å; W226-H228 PolarHBondContact O-N 2.96Å; W226-I229 PolarHBondContact O-N 3.48Å; W226-F230 HydrophobicContact CB-CD2 4.34Å; W226-F230 HydrophobicContact CB-CE2 4.48Å; W226-F230 HydrophobicContact CE3-CD2 4.36Å; W226-F230 AromaticContact CE3-CE2 3.78Å; W226-F230 HydrophobicContact CE3-CE2 3.78Å; W226-F230 HydrophobicContact CZ3-CE2 4.47Å; W226-F230 VanDerWaalsContact O-CD2 3.24Å; W226-F230 WeakPolarHBondContact O-CD2 3.03Å; W226-F230 PolarHBondContact O-N 3.43Å
227W97.8Very high97.6Very high48 Ų4840 Ų4018%0.18221%0.206CC..Hα-helixtrans-51.7-50.3172.3165.7-85.6000111.5A200 F201 Y204 S223 H224 Q225 I229 F230 I231A200-W227 VanDerWaalsContact C-CE3 3.43Å; A200-W227 HydrophobicContact CB-CD2 4.39Å; A200-W227 HydrophobicContact CB-CE3 3.76Å; A200-W227 HydrophobicContact CB-CZ3 4.11Å; F201-W227 HydrophobicContact CB-CZ3 4.1Å; F201-W227 AromaticContact CD2-CZ3 3.98Å; F201-W227 HydrophobicContact CD2-CZ3 3.98Å; Y204-W227 VanDerWaalsContact CB-CE3 3.42Å; Y204-W227 HydrophobicContact CD2-CD2 4.16Å; Y204-W227 HydrophobicContact CD2-CE3 4.27Å; Y204-W227 HydrophobicContact CD2-CG 4.4Å; Y204-W227 HydrophobicContact CG-CD2 4.38Å; Y204-W227 HydrophobicContact CG-CE3 4.03Å; Y204-W227 HydrophobicContact CG-CZ3 4.39Å; S223-W227 PolarHBondContact O-N 2.73Å; H224-W227 WeakPolarHBondContact O-CB 3.15Å; H224-W227 PolarHBondContact O-N 3.17Å; Q225-W227 PolarHBondContact O-N 2.86Å; W227-I229 PolarHBondContact O-N 2.81Å; W227-F230 PolarHBondContact O-N 3.46Å; W227-I231 HydrophobicContact CD2-CG1 4.07Å; W227-I231 HydrophobicContact CE3-CG1 4.45Å; W227-I231 HydrophobicContact CH2-CD1 4.22Å; W227-I231 HydrophobicContact CH2-CG1 4.43Å; W227-I231 HydrophobicContact CZ2-CD1 4.23Å; W227-I231 HydrophobicContact CZ2-CG1 4.05Å; W227-I231 HydrophobicContact CZ3-CD1 4.45Å; W227-I231 WeakPolarHBondContact O-CB 3.45Å; W227-I231 VanDerWaalsContact O-CG1 3.26Å; W227-I231 WeakPolarHBondContact O-CG1 3.47Å; W227-I231 PolarHBondContact O-N 2.93Å
228H98.4Very high97.7Very high1 Ų139.3 Ų39.31%0.00520%0.202CC..Hα-helixtrans-57.4-49.2177.2-83.1-125.6000112.1N19 S22 H23 H73 H224 Q225 W226 I231 L232N19-H228 PolarHBondContact O-CE1 3.3Å; N19-H228 VanDerWaalsContact O-CE1 3.29Å; N19-H228 PolarHBondContact O-ND1 3.42Å; S22-H228 WeakPolarHBondContact OG-CB 3.44Å; S22-H228 PolarHBondContact OG-ND1 3.45Å; H23-H228 AromaticContact CD2-CG 3.88Å; H23-H228 AromaticContact CD2-ND1 3.35Å; H23-H228 PolarHBondContact CD2-ND1 3.46Å; H23-H228 AromaticContact CE1-CE1 3.48Å; H23-H228 PolarHBondContact CE1-CE1 3.03Å; H23-H228 VanDerWaalsContact CE1-CE1 3.48Å; H23-H228 AromaticContact CE1-CG 3.55Å; H23-H228 AromaticContact CE1-ND1 3.2Å; H23-H228 PolarHBondContact CE1-ND1 3.38Å; H23-H228 AromaticContact CE1-NE2 3.99Å; H23-H228 AromaticContact CG-CE1 3.8Å; H23-H228 AromaticContact CG-ND1 3.28Å; H23-H228 VanDerWaalsContact CG-ND1 3.28Å; H23-H228 AromaticContact ND1-CE1 3.29Å; H23-H228 PolarHBondContact ND1-CE1 2.82Å; H23-H228 VanDerWaalsContact ND1-CE1 3.29Å; H23-H228 AromaticContact ND1-CG 4Å; H23-H228 AromaticContact ND1-ND1 3.17Å; H23-H228 PolarHBondContact ND1-ND1 3.16Å; H23-H228 VanDerWaalsContact ND1-ND1 3.17Å; H23-H228 WeakPolarHBondContact NE2-CA 3.43Å; H23-H228 AromaticContact NE2-CG 3.48Å; H23-H228 AromaticContact NE2-ND1 3.34Å; H23-H228 PolarHBondContact NE2-ND1 3.32Å; H23-H228 PolarHBondContact NE2-O 2.81Å; H73-H228 AromaticContact CD2-CE1 3.53Å; H73-H228 AromaticContact CD2-NE2 3.73Å; H73-H228 AromaticContact NE2-CE1 3.52Å; H73-H228 AromaticContact NE2-NE2 3.19Å; H73-H228 PolarHBondContact NE2-NE2 3.43Å; H73-H228 VanDerWaalsContact NE2-NE2 3.19Å; H224-H228 AromaticContact CD2-CD2 3.59Å; H224-H228 AromaticContact CD2-NE2 3.46Å; H224-H228 PolarHBondContact CD2-NE2 3.23Å; H224-H228 AromaticContact NE2-CD2 3.63Å; H224-H228 AromaticContact NE2-NE2 3.19Å; H224-H228 PolarHBondContact NE2-NE2 2.98Å; H224-H228 VanDerWaalsContact NE2-NE2 3.19Å; H224-H228 PolarHBondContact O-CD2 2.98Å; H224-H228 PolarHBondContact O-N 3.47Å; H224-H228 VanDerWaalsContact O-N 3.07Å; Q225-H228 WeakPolarHBondContact O-CB 3.42Å; Q225-H228 PolarHBondContact O-N 3.35Å; W226-H228 VanDerWaalsContact C-N 3.31Å; W226-H228 PolarHBondContact O-N 2.96Å; H228-I231 PolarHBondContact O-N 2.96Å; H228-L232 VanDerWaalsContact O-CB 3.32Å; H228-L232 WeakPolarHBondContact O-CB 3.13Å; H228-L232 PolarHBondContact O-N 3.41Å
229I98.6Very high97.9Very high78 Ų7834.8 Ų34.840%0.418%0.178SC..Hα-helixtrans-63.9-45-178-63.9-59.4000112.2Q225 W226 W227 L232 G233Q225-I229 WeakPolarHBondContact O-CG1 3.21Å; Q225-I229 PolarHBondContact O-N 2.92Å; W226-I229 PolarHBondContact O-N 3.48Å; W227-I229 PolarHBondContact O-N 2.81Å; I229-L232 PolarHBondContact O-N 3.15Å; I229-G233 PolarHBondContact O-N 2.04Å
230F98.7Very high98.1Very high49 Ų4935.6 Ų35.622%0.21518%0.178CC..Hα-helixtrans-68.8-38.7179.6-81.8-78000112.4L196 A199 A200 F203 W226 W227 G233 A234L196-F230 HydrophobicContact CD2-CD1 3.77Å; L196-F230 HydrophobicContact CD2-CE1 4.14Å; A199-F230 HydrophobicContact CB-CD1 3.82Å; A199-F230 HydrophobicContact CB-CE1 3.81Å; A199-F230 HydrophobicContact CB-CG 4.26Å; A199-F230 HydrophobicContact CB-CZ 4.24Å; A200-F230 HydrophobicContact CB-CB 3.61Å; F203-F230 AromaticContact CD2-CD2 3.94Å; F203-F230 HydrophobicContact CD2-CD2 3.94Å; F203-F230 AromaticContact CD2-CE2 3.78Å; F203-F230 HydrophobicContact CD2-CE2 3.78Å; F203-F230 HydrophobicContact CE2-CD2 4Å; F203-F230 AromaticContact CE2-CE2 3.35Å; F203-F230 HydrophobicContact CE2-CE2 3.35Å; F203-F230 HydrophobicContact CE2-CZ 4.06Å; F203-F230 HydrophobicContact CZ-CE2 4.29Å; W226-F230 HydrophobicContact CB-CD2 4.34Å; W226-F230 HydrophobicContact CB-CE2 4.48Å; W226-F230 HydrophobicContact CE3-CD2 4.36Å; W226-F230 AromaticContact CE3-CE2 3.78Å; W226-F230 HydrophobicContact CE3-CE2 3.78Å; W226-F230 HydrophobicContact CZ3-CE2 4.47Å; W226-F230 VanDerWaalsContact O-CD2 3.24Å; W226-F230 WeakPolarHBondContact O-CD2 3.03Å; W226-F230 PolarHBondContact O-N 3.43Å; W227-F230 PolarHBondContact O-N 3.46Å; F230-G233 PolarHBondContact O-N 3.34Å; F230-A234 WeakPolarHBondContact O-CB 3.18Å; F230-A234 PolarHBondContact O-N 3.35Å
231I98.5Very high98.1Very high23 Ų2331.5 Ų31.512%0.11815%0.153CC..Hα-helixtrans-65.8-44.8175.1-68.7-61.2000111A200 W227 H228 G233 A234 M235A200-I231 HydrophobicContact CB-CD1 3.77Å; A200-I231 HydrophobicContact CB-CG1 3.86Å; W227-I231 HydrophobicContact CD2-CG1 4.07Å; W227-I231 HydrophobicContact CE3-CG1 4.45Å; W227-I231 HydrophobicContact CH2-CD1 4.22Å; W227-I231 HydrophobicContact CH2-CG1 4.43Å; W227-I231 HydrophobicContact CZ2-CD1 4.23Å; W227-I231 HydrophobicContact CZ2-CG1 4.05Å; W227-I231 HydrophobicContact CZ3-CD1 4.45Å; W227-I231 WeakPolarHBondContact O-CB 3.45Å; W227-I231 VanDerWaalsContact O-CG1 3.26Å; W227-I231 WeakPolarHBondContact O-CG1 3.47Å; W227-I231 PolarHBondContact O-N 2.93Å; H228-I231 PolarHBondContact O-N 2.96Å; I231-G233 VanDerWaalsContact C-N 3.35Å; I231-G233 PolarHBondContact O-N 3.46Å; I231-A234 PolarHBondContact O-N 3.27Å; I231-M235 HydrophobicContact CG2-CE 3.92Å; I231-M235 WeakPolarHBondContact O-CG 3.3Å; I231-M235 PolarHBondContact O-N 2.78Å
232L98.8Very high98.2Very high22 Ų2231 Ų3112%0.11515%0.148CC..Hα-helixtrans-59.3-47.3174.6176.258.3000111S22 F30 M66 H228 I229 A234 M235 I236S22-L232 WeakPolarHBondContact O-CD2 3.4Å; F30-L232 HydrophobicContact CE2-CD1 3.76Å; F30-L232 HydrophobicContact CZ-CD1 4.37Å; M66-L232 HydrophobicContact CE-CB 4.45Å; M66-L232 HydrophobicContact CE-CD1 4.06Å; M66-L232 HydrophobicContact SD-CD1 3.97Å; H228-L232 VanDerWaalsContact O-CB 3.32Å; H228-L232 WeakPolarHBondContact O-CB 3.13Å; H228-L232 PolarHBondContact O-N 3.41Å; I229-L232 PolarHBondContact O-N 3.15Å; L232-A234 VanDerWaalsContact C-N 3.34Å; L232-A234 PolarHBondContact O-N 2.89Å; L232-M235 PolarHBondContact O-N 3.26Å; L232-I236 HydrophobicContact CD1-CD1 3.82Å; L232-I236 HydrophobicContact CD1-CG1 4.01Å; L232-I236 HydrophobicContact CG-CD1 3.85Å; L232-I236 HydrophobicContact CG-CG1 4.41Å; L232-I236 VanDerWaalsContact O-CG1 3.27Å; L232-I236 WeakPolarHBondContact O-CG1 2.98Å; L232-I236 PolarHBondContact O-N 2.99Å
233G98.8Very high98.1Very high26 Ų2630.9 Ų30.927%0.26815%0.146SC..Hα-helixtrans-57.9-43.7176.400000112.8I229 F230 I231 I236 Y237I229-G233 PolarHBondContact O-N 2.04Å; F230-G233 PolarHBondContact O-N 3.34Å; I231-G233 VanDerWaalsContact C-N 3.35Å; I231-G233 PolarHBondContact O-N 3.46Å; G233-I236 PolarHBondContact O-N 2.77Å; G233-Y237 VanDerWaalsContact O-CB 3.25Å; G233-Y237 WeakPolarHBondContact O-CB 3.34Å; G233-Y237 PolarHBondContact O-N 3.36Å
234A98.8Very high98.1Very high1 Ų136 Ų361%0.00817%0.17CC..Hα-helixtrans-60.7-45.8175.800000112.1L193 L196 I197 F230 I231 L232 W238L193-A234 HydrophobicContact CD1-CB 3.97Å; L196-A234 HydrophobicContact CB-CB 3.89Å; L196-A234 HydrophobicContact CD1-CB 4.32Å; I197-A234 HydrophobicContact CG1-CB 4.16Å; F230-A234 WeakPolarHBondContact O-CB 3.18Å; F230-A234 PolarHBondContact O-N 3.35Å; I231-A234 PolarHBondContact O-N 3.27Å; L232-A234 VanDerWaalsContact C-N 3.34Å; L232-A234 PolarHBondContact O-N 2.89Å; A234-W238 VanDerWaalsContact O-CB 3.27Å; A234-W238 WeakPolarHBondContact O-CB 3.39Å; A234-W238 PolarHBondContact O-N 3.16Å
235M98.8Very high98.1Very high9 Ų935 Ų354%0.04417%0.166CC..Hα-helixtrans-64.8-43.5178.2-69.5-170.4179.300112.2F30 M62 C65 M66 M101 I231 L232 Q239F30-M235 HydrophobicContact CE1-CB 4.41Å; F30-M235 HydrophobicContact CE2-CB 4.08Å; F30-M235 HydrophobicContact CZ-CB 3.5Å; M62-M235 HydrophobicContact CB-SD 4.15Å; M62-M235 HydrophobicContact CG-SD 4.12Å; M62-M235 HydrophobicContact SD-CB 4.38Å; C65-M235 HydrophobicContact CB-CE 4.12Å; M66-M235 HydrophobicContact CE-CE 4.18Å; M66-M235 HydrophobicContact CE-CG 4.4Å; M66-M235 HydrophobicContact CE-SD 3.25Å; M66-M235 WeakPolarHBondContact CE-SD 3.43Å; M101-M235 HydrophobicContact CE-CG 4.28Å; M101-M235 HydrophobicContact CG-CG 4.41Å; M101-M235 HydrophobicContact SD-CE 4.17Å; M101-M235 HydrophobicContact SD-CG 3.68Å; I231-M235 HydrophobicContact CG2-CE 3.92Å; I231-M235 WeakPolarHBondContact O-CG 3.3Å; I231-M235 PolarHBondContact O-N 2.78Å; L232-M235 PolarHBondContact O-N 3.26Å; M235-Q239 VanDerWaalsContact O-CB 3.28Å; M235-Q239 WeakPolarHBondContact O-CB 3.46Å; M235-Q239 PolarHBondContact O-N 2.95Å
236I98.8Very high97.9Very high40 Ų4034.8 Ų34.821%0.20517%0.165CC..Hα-helixtrans-60-52.4177-70.4176000110Y29 F30 L232 G233 W238 Q239 Q240Y29-I236 HydrophobicContact CD1-CD1 4.15Å; Y29-I236 HydrophobicContact CD1-CG1 3.85Å; Y29-I236 HydrophobicContact CE1-CB 4.26Å; Y29-I236 HydrophobicContact CE1-CD1 4.16Å; Y29-I236 HydrophobicContact CE1-CG1 3.56Å; Y29-I236 HydrophobicContact CE1-CG2 4.14Å; Y29-I236 HydrophobicContact CG-CD1 4.47Å; F30-I236 HydrophobicContact CE1-CG1 4.47Å; F30-I236 HydrophobicContact CZ-CG1 3.88Å; L232-I236 HydrophobicContact CD1-CD1 3.82Å; L232-I236 HydrophobicContact CD1-CG1 4.01Å; L232-I236 HydrophobicContact CG-CD1 3.85Å; L232-I236 HydrophobicContact CG-CG1 4.41Å; L232-I236 VanDerWaalsContact O-CG1 3.27Å; L232-I236 WeakPolarHBondContact O-CG1 2.98Å; L232-I236 PolarHBondContact O-N 2.99Å; G233-I236 PolarHBondContact O-N 2.77Å; I236-W238 VanDerWaalsContact C-N 3.33Å; I236-W238 PolarHBondContact O-N 3.41Å; I236-Q239 PolarHBondContact O-N 2.78Å; I236-Q240 WeakPolarHBondContact O-CG 3.44Å; I236-Q240 PolarHBondContact O-N 3.43Å
237Y98.6Very high97.7Very high65 Ų6531.9 Ų31.926%0.25516%0.159SC..Hα-helixtrans-61.9-42.3-176.9-177.1-93.4000111.7N189 V192 G233 Q240 S241N189-Y237 HydrophobicContact CB-CE1 3.94Å; N189-Y237 WeakPolarHBondContact O-CE1 3.48Å; N189-Y237 PolarHBondContact OD1-OH 3.23Å; V192-Y237 HydrophobicContact CB-CD1 4.34Å; V192-Y237 HydrophobicContact CB-CE1 3.65Å; V192-Y237 HydrophobicContact CG1-CD1 3.83Å; V192-Y237 HydrophobicContact CG1-CD2 4.26Å; V192-Y237 HydrophobicContact CG1-CE1 3.53Å; V192-Y237 HydrophobicContact CG1-CE2 4Å; V192-Y237 HydrophobicContact CG1-CG 4.18Å; V192-Y237 HydrophobicContact CG2-CE1 4.5Å; G233-Y237 VanDerWaalsContact O-CB 3.25Å; G233-Y237 WeakPolarHBondContact O-CB 3.34Å; G233-Y237 PolarHBondContact O-N 3.36Å; Y237-Q240 PolarHBondContact O-N 2.94Å; Y237-S241 WeakPolarHBondContact O-CB 3.1Å; Y237-S241 PolarHBondContact O-N 2.99Å; Y237-S241 PolarHBondContact O-OG 2.59Å
238W98.3Very high97.5Very high37 Ų3731.1 Ų31.114%0.1416%0.157CC..Hα-helixtrans-67.9-43.5179.5-166.2-119.1000112.7M101 V190 L193 A234 I236 Q240 S241 G242M101-W238 HydrophobicContact CE-CB 4Å; M101-W238 HydrophobicContact CE-CG 4.21Å; M101-W238 PolarHBondContact O-NE1 2.99Å; V190-W238 HydrophobicContact CG2-CH2 4Å; V190-W238 HydrophobicContact CG2-CZ3 4.15Å; L193-W238 HydrophobicContact CB-CE3 4.03Å; L193-W238 HydrophobicContact CB-CZ3 4.35Å; L193-W238 HydrophobicContact CD1-CB 4.24Å; L193-W238 HydrophobicContact CD1-CG 4.48Å; L193-W238 HydrophobicContact CD2-CD2 3.57Å; L193-W238 HydrophobicContact CD2-CE3 3.54Å; L193-W238 HydrophobicContact CD2-CG 4.08Å; L193-W238 HydrophobicContact CD2-CH2 4.15Å; L193-W238 HydrophobicContact CD2-CZ2 4.16Å; L193-W238 HydrophobicContact CD2-CZ3 3.85Å; L193-W238 HydrophobicContact CG-CE3 4.26Å; A234-W238 VanDerWaalsContact O-CB 3.27Å; A234-W238 WeakPolarHBondContact O-CB 3.39Å; A234-W238 PolarHBondContact O-N 3.16Å; I236-W238 VanDerWaalsContact C-N 3.33Å; I236-W238 PolarHBondContact O-N 3.41Å; W238-Q240 VanDerWaalsContact C-N 3.33Å; W238-Q240 PolarHBondContact O-N 3.42Å; W238-S241 WeakPolarHBondContact O-CB 3.44Å; W238-S241 PolarHBondContact O-N 3.45Å; W238-G242 PolarHBondContact O-N 2.9Å
239Q98.1Very high97.2Very high1 Ų131.2 Ų31.21%0.00516%0.158CC..Hα-helixtrans-59.5-43.6175.5178.4-88.9-37.100111.9F30 T37 I59 M62 M235 I236 G242 N243F30-Q239 HydrophobicContact CE1-CB 4.31Å; T37-Q239 PolarHBondContact OG1-NE2 3.28Å; I59-Q239 HydrophobicContact CG1-CG 4.17Å; M62-Q239 HydrophobicContact CE-CB 4.09Å; M62-Q239 HydrophobicContact SD-CB 4.02Å; M62-Q239 HydrophobicContact SD-CG 4.42Å; M235-Q239 VanDerWaalsContact O-CB 3.28Å; M235-Q239 WeakPolarHBondContact O-CB 3.46Å; M235-Q239 PolarHBondContact O-N 2.95Å; I236-Q239 PolarHBondContact O-N 2.78Å; Q239-G242 PolarHBondContact O-N 3.18Å; Q239-N243 PolarHBondContact NE2-ND2 3.12Å; Q239-N243 PolarHBondContact O-N 3.38Å; Q239-N243 VanDerWaalsContact O-N 3.11Å
240Q98.1Very high96.8Very high77 Ų7730 Ų3036%0.3615%0.148SC..Hα-helixtrans-65.8-42.7176-71.1176.8-1000111.8Y29 I236 Y237 W238 G242 N243 Q244Y29-Q240 PolarHBondContact OH-NE2 3.01Å; I236-Q240 WeakPolarHBondContact O-CG 3.44Å; I236-Q240 PolarHBondContact O-N 3.43Å; Y237-Q240 PolarHBondContact O-N 2.94Å; W238-Q240 VanDerWaalsContact C-N 3.33Å; W238-Q240 PolarHBondContact O-N 3.42Å; Q240-G242 VanDerWaalsContact C-N 3.32Å; Q240-G242 PolarHBondContact O-N 3.3Å; Q240-N243 PolarHBondContact O-N 2.65Å; Q240-Q244 WeakPolarHBondContact O-CG 3.5Å; Q240-Q244 PolarHBondContact O-N 3.23Å
241S98.1Very high96.3Very high7 Ų731.2 Ų31.25%0.04916%0.163CC..Hα-helixtrans-58.5-44.1176.6-62.90000111.6N189 Y237 W238 Q244 L245N189-S241 PolarHBondContact ND2-OG 2.91Å; Y237-S241 WeakPolarHBondContact O-CB 3.1Å; Y237-S241 PolarHBondContact O-N 2.99Å; Y237-S241 PolarHBondContact O-OG 2.59Å; W238-S241 WeakPolarHBondContact O-CB 3.44Å; W238-S241 PolarHBondContact O-N 3.45Å; S241-Q244 PolarHBondContact O-N 3.2Å; S241-L245 WeakPolarHBondContact O-CB 3.49Å; S241-L245 PolarHBondContact O-N 3.18Å
242G97.1Very high95.6Very high3 Ų334 Ų343%0.03117%0.174CC..Hα-helixtrans-62.9-42.717600000113N104 W238 Q239 Q240 Q244 L245 L246N104-G242 WeakPolarHBondContact OD1-CA 3.39Å; W238-G242 PolarHBondContact O-N 2.9Å; Q239-G242 PolarHBondContact O-N 3.18Å; Q240-G242 VanDerWaalsContact C-N 3.32Å; Q240-G242 PolarHBondContact O-N 3.3Å; G242-Q244 PolarHBondContact O-N 2.95Å; G242-L245 PolarHBondContact O-N 2.89Å; G242-L246 WeakPolarHBondContact O-CB 3.35Å; G242-L246 PolarHBondContact O-N 2.98Å
243N96.4Very high94.5Very high15 Ų1540.7 Ų40.78%0.0822%0.216CC..Hα-helixtrans-59.4-45.9174.8-83.12.1000111.5T37 F55 Q239 Q240 T247T37-N243 PolarHBondContact OG1-ND2 3.32Å; T37-N243 VanDerWaalsContact OG1-ND2 3.17Å; F55-N243 WeakPolarHBondContact CD1-OD1 3.43Å; F55-N243 WeakPolarHBondContact CE1-OD1 3.24Å; Q239-N243 PolarHBondContact NE2-ND2 3.12Å; Q239-N243 PolarHBondContact O-N 3.38Å; Q239-N243 VanDerWaalsContact O-N 3.11Å; Q240-N243 PolarHBondContact O-N 2.65Å; N243-T247 WeakPolarHBondContact O-CB 3.37Å; N243-T247 PolarHBondContact O-N 2.96Å; N243-T247 PolarHBondContact O-OG1 2.95Å
244Q96.8Very high93.7Very high107 Ų10743.8 Ų43.850%0.523%0.227SC..Hα-helixtrans-68.6-40.9-178.6-64.4172.1-5.300112W186 Q240 S241 G242 T247 E248W186-Q244 HydrophobicContact CH2-CB 3.59Å; W186-Q244 HydrophobicContact CZ3-CB 4.06Å; Q240-Q244 WeakPolarHBondContact O-CG 3.5Å; Q240-Q244 PolarHBondContact O-N 3.23Å; S241-Q244 PolarHBondContact O-N 3.2Å; G242-Q244 PolarHBondContact O-N 2.95Å; Q244-T247 WeakPolarHBondContact O-CB 3.25Å; Q244-T247 PolarHBondContact O-N 3.24Å; Q244-E248 PolarHBondContact O-N 2.86Å
245L95.9Very high92.9Very high15 Ų1544 Ų448%0.07923%0.228CC..Hα-helixtrans-65.3-44.5177.8177.856.2000111.4W186 S241 G242 T247 E248 Y249W186-L245 HydrophobicContact CD2-CB 4.33Å; W186-L245 HydrophobicContact CD2-CD1 3.8Å; W186-L245 HydrophobicContact CE3-CB 4.17Å; W186-L245 HydrophobicContact CE3-CD1 4.47Å; W186-L245 HydrophobicContact CG-CD1 3.93Å; W186-L245 HydrophobicContact CH2-CB 4.13Å; W186-L245 HydrophobicContact CZ2-CB 4.24Å; W186-L245 HydrophobicContact CZ2-CD1 4.14Å; W186-L245 HydrophobicContact CZ3-CB 4.08Å; S241-L245 WeakPolarHBondContact O-CB 3.49Å; S241-L245 PolarHBondContact O-N 3.18Å; G242-L245 PolarHBondContact O-N 2.89Å; L245-T247 VanDerWaalsContact C-N 3.31Å; L245-T247 PolarHBondContact O-N 3.13Å; L245-E248 PolarHBondContact O-N 3.29Å; L245-Y249 HydrophobicContact CD1-CD2 3.93Å; L245-Y249 HydrophobicContact CD1-CE2 3.38Å; L245-Y249 HydrophobicContact CD2-CE2 4.14Å; L245-Y249 HydrophobicContact CG-CD2 3.98Å; L245-Y249 HydrophobicContact CG-CE2 3.56Å; L245-Y249 VanDerWaalsContact O-CD2 3.25Å; L245-Y249 WeakPolarHBondContact O-CD2 3.34Å; L245-Y249 PolarHBondContact O-N 3.43Å
246L95.3Very high92.3Very high1 Ų144.8 Ų44.81%0.00523%0.234CC..Hα-helixtrans-62.6-40.2174.2-178.164.4000111.7L42 I45 D51 F55 T108 F111 G242 E248 Y249 R250L42-L246 HydrophobicContact CD2-CD2 3.6Å; I45-L246 HydrophobicContact CD1-CD2 4.39Å; I45-L246 HydrophobicContact CD1-CG 4.21Å; D51-L246 HydrophobicContact CB-CD2 4.06Å; F55-L246 HydrophobicContact CD2-CD2 4.15Å; F55-L246 HydrophobicContact CE2-CB 4.42Å; F55-L246 HydrophobicContact CE2-CD2 3.5Å; F55-L246 VanDerWaalsContact CE2-CD2 3.5Å; F55-L246 HydrophobicContact CE2-CG 4.49Å; F55-L246 HydrophobicContact CZ-CB 4.05Å; F55-L246 HydrophobicContact CZ-CD2 3.82Å; T108-L246 HydrophobicContact CG2-CB 4.22Å; F111-L246 HydrophobicContact CD2-CD1 4Å; F111-L246 HydrophobicContact CE2-CD1 3.86Å; G242-L246 WeakPolarHBondContact O-CB 3.35Å; G242-L246 PolarHBondContact O-N 2.98Å; L246-E248 VanDerWaalsContact C-N 3.29Å; L246-E248 PolarHBondContact O-N 3.33Å; L246-Y249 PolarHBondContact O-N 2.8Å; L246-R250 HydrophobicContact CD1-CG 4.14Å; L246-R250 HydrophobicContact CG-CG 4.33Å; L246-R250 WeakPolarHBondContact O-CG 3.26Å; L246-R250 PolarHBondContact O-N 2.85Å
247T94.3Very high91.6Very high44 Ų4447.8 Ų47.827%0.2725%0.247SC..Hα-helixtrans-58.7-42.6175.5-61.80000111.1I45 N243 Q244 L245 R250 S251I45-T247 HydrophobicContact CG2-CG2 3.91Å; N243-T247 WeakPolarHBondContact O-CB 3.37Å; N243-T247 PolarHBondContact O-N 2.96Å; N243-T247 PolarHBondContact O-OG1 2.95Å; Q244-T247 WeakPolarHBondContact O-CB 3.25Å; Q244-T247 PolarHBondContact O-N 3.24Å; L245-T247 VanDerWaalsContact C-N 3.31Å; L245-T247 PolarHBondContact O-N 3.13Å; T247-R250 PolarHBondContact O-N 3.01Å; T247-S251 WeakPolarHBondContact O-CB 3.23Å; T247-S251 PolarHBondContact O-N 2.96Å; T247-S251 PolarHBondContact O-OG 3.34Å
248E92.6Very high90.9Very high32 Ų3252.3 Ų52.315%0.1526%0.264CS..Hα-helixtrans-63.4-45.7175.9-179.9159.3-137.200111.9K185 W186 Q244 L245 L246 R250 S251 F252 F259K185-E248 IonicContact NZ-OE1 3.99Å; K185-E248 PolarHBondContact NZ-OE1 3.15Å; K185-E248 IonicContact NZ-OE2 3.96Å; K185-E248 PolarHBondContact NZ-OE2 3.34Å; W186-E248 HydrophobicContact CZ2-CB 4.26Å; W186-E248 WeakPolarHBondContact CZ2-OE2 3.44Å; W186-E248 PolarHBondContact NE1-OE2 2.78Å; Q244-E248 PolarHBondContact O-N 2.86Å; L245-E248 PolarHBondContact O-N 3.29Å; L246-E248 VanDerWaalsContact C-N 3.29Å; L246-E248 PolarHBondContact O-N 3.33Å; E248-R250 VanDerWaalsContact C-N 3.26Å; E248-R250 PolarHBondContact O-N 3.25Å; E248-S251 PolarHBondContact O-N 2.79Å; E248-F252 HydrophobicContact CG-CE2 4.3Å; E248-F259 HydrophobicContact CG-CE2 4.29Å; E248-F259 HydrophobicContact CG-CZ 3.97Å
249Y92.1Very high90.2Very high4 Ų451.4 Ų51.42%0.01626%0.261CS..Hα-helixtrans-62.5-31.1176.8-73.6-54.8000113.4T108 F111 H182 L245 L246 S255 F259T108-Y249 WeakPolarHBondContact O-CE2 3.26Å; F111-Y249 HydrophobicContact CB-CD2 4.09Å; F111-Y249 HydrophobicContact CB-CE2 4.12Å; F111-Y249 HydrophobicContact CD1-CD1 4.3Å; F111-Y249 HydrophobicContact CD1-CD2 4.32Å; F111-Y249 AromaticContact CD1-CG 3.98Å; F111-Y249 HydrophobicContact CD1-CG 3.98Å; F111-Y249 HydrophobicContact CG-CD2 4.21Å; F111-Y249 HydrophobicContact CG-CG 4.33Å; H182-Y249 AromaticContact CE1-CE1 3.82Å; H182-Y249 AromaticContact CE1-CZ 3.72Å; H182-Y249 AromaticContact NE2-CE1 3.84Å; H182-Y249 AromaticContact NE2-CZ 3.46Å; H182-Y249 PolarHBondContact NE2-OH 3.24Å; L245-Y249 HydrophobicContact CD1-CD2 3.93Å; L245-Y249 HydrophobicContact CD1-CE2 3.38Å; L245-Y249 HydrophobicContact CD2-CE2 4.14Å; L245-Y249 HydrophobicContact CG-CD2 3.98Å; L245-Y249 HydrophobicContact CG-CE2 3.56Å; L245-Y249 VanDerWaalsContact O-CD2 3.25Å; L245-Y249 WeakPolarHBondContact O-CD2 3.34Å; L245-Y249 PolarHBondContact O-N 3.43Å; L246-Y249 PolarHBondContact O-N 2.8Å; Y249-S255 VanDerWaalsContact O-CB 3.26Å; Y249-S255 WeakPolarHBondContact O-CB 3.4Å; Y249-S255 PolarHBondContact O-OG 3.38Å; Y249-F259 AromaticContact CD1-CD2 3.9Å; Y249-F259 HydrophobicContact CD1-CD2 3.9Å; Y249-F259 HydrophobicContact CD1-CE2 4.11Å; Y249-F259 AromaticContact CE1-CD2 3.78Å; Y249-F259 HydrophobicContact CE1-CD2 3.78Å; Y249-F259 HydrophobicContact CE1-CE2 4.35Å
250R90.4Very high89.5Confident51 Ų5151.9 Ų51.919%0.19226%0.263CS..Hα-helixtrans-87.9-13.1178.1-65.1-68.1-174-173.2-1.2113.5I45 H48 D51 F111 L246 T247 E248 F252I45-R250 HydrophobicContact CB-CB 4.03Å; I45-R250 HydrophobicContact CD1-CB 4.03Å; I45-R250 HydrophobicContact CD1-CG 3.95Å; I45-R250 HydrophobicContact CG1-CB 4.24Å; I45-R250 HydrophobicContact CG1-CG 4.4Å; H48-R250 PolarHBondContact CD2-NH1 3Å; H48-R250 PolarHBondContact CD2-NH2 3.11Å; H48-R250 PolarHBondContact NE2-NH1 3.43Å; D51-R250 IonicContact OD1-NE 2.71Å; D51-R250 IonicContact OD1-NH2 3.58Å; D51-R250 PolarHBondContact OD1-NH2 3.17Å; D51-R250 VanDerWaalsContact OD1-NH2 3.15Å; D51-R250 IonicContact OD2-CZ 2.66Å; D51-R250 IonicContact OD2-NE 2.78Å; D51-R250 PolarHBondContact OD2-NE 3.14Å; D51-R250 IonicContact OD2-NH2 3.86Å; D51-R250 PolarHBondContact OD2-NH2 3.4Å; F111-R250 VanDerWaalsContact CZ-CZ 3.47Å; L246-R250 HydrophobicContact CD1-CG 4.14Å; L246-R250 HydrophobicContact CG-CG 4.33Å; L246-R250 WeakPolarHBondContact O-CG 3.26Å; L246-R250 PolarHBondContact O-N 2.85Å; T247-R250 PolarHBondContact O-N 3.01Å; E248-R250 VanDerWaalsContact C-N 3.26Å; E248-R250 PolarHBondContact O-N 3.25Å; R250-F252 VanDerWaalsContact C-N 3.31Å; R250-F252 PolarHBondContact O-N 3.08Å
251S87.8Confident88.5Confident76 Ų7650 Ų5053%0.53126%0.258SS..Hα-helixtrans-74.9-19.2179.2-650000113.3T247 E248T247-S251 WeakPolarHBondContact O-CB 3.23Å; T247-S251 PolarHBondContact O-N 2.96Å; T247-S251 PolarHBondContact O-OG 3.34Å; E248-S251 PolarHBondContact O-N 2.79Å
252F84.2Confident86.9Confident80 Ų8060.5 Ų60.535%0.35130%0.296SS..SBendtrans-119.4137.4174.4-46.5-82.5000110.6E248 R250 D254 S255 F259E248-F252 HydrophobicContact CG-CE2 4.3Å; R250-F252 VanDerWaalsContact C-N 3.31Å; R250-F252 PolarHBondContact O-N 3.08Å; F252-D254 PolarHBondContact O-N 3.47Å; F252-S255 WeakPolarHBondContact CB-OG 3.42Å; F252-S255 PolarHBondContact O-OG 3.4Å; F252-F259 HydrophobicContact CD2-CE2 4.31Å; F252-F259 HydrophobicContact CD2-CZ 4.01Å; F252-F259 HydrophobicContact CE2-CZ 4.01Å
253T76.2Confident85.2Confident164 Ų16467.4 Ų67.4100%1.00633%0.333SS*.THydrogen-bonded Turntrans-67.2-21.8176.547.40000112.9
254D81Confident83.4Confident90 Ų9069.3 Ų69.348%0.48134%0.34SS..THydrogen-bonded Turntrans-12332.3-176.4-160.122.4000112.8F252 C256 H257 R258F252-D254 PolarHBondContact O-N 3.47Å; D254-C256 PolarHBondContact O-N 3Å; D254-H257 PolarHBondContact O-N 3.45Å; D254-H257 VanDerWaalsContact OD1-CB 3.24Å; D254-H257 WeakPolarHBondContact OD1-CB 3.49Å; D254-H257 IonicContact OD1-CD2 3.36Å; D254-H257 PolarHBondContact OD1-CD2 3.02Å; D254-H257 IonicContact OD1-CG 3.47Å; D254-H257 VanDerWaalsContact OD1-CG 3.25Å; D254-H257 IonicContact OD1-NE2 3.25Å; D254-H257 WeakPolarHBondContact OD2-CB 3.38Å; D254-H257 IonicContact OD2-CG 2.83Å; D254-R258 WeakPolarHBondContact O-CB 3.35Å; D254-R258 PolarHBondContact O-N 3.44Å
255S82.6Confident81.4Confident5 Ų565.5 Ų65.54%0.03533%0.326CS..Hα-helixtrans-52-41.1-175.6-66.70000113.2Y249 F252 R258 F259Y249-S255 VanDerWaalsContact O-CB 3.26Å; Y249-S255 WeakPolarHBondContact O-CB 3.4Å; Y249-S255 PolarHBondContact O-OG 3.38Å; F252-S255 WeakPolarHBondContact CB-OG 3.42Å; F252-S255 PolarHBondContact O-OG 3.4Å; S255-R258 WeakPolarHBondContact O-CB 3.49Å; S255-R258 PolarHBondContact O-N 3.28Å; S255-F259 WeakPolarHBondContact O-CD2 3.37Å; S255-F259 WeakPolarHBondContact O-CG 3.46Å; S255-F259 PolarHBondContact O-N 3.31Å
256C86.1Confident79.2Confident26 Ų2672.5 Ų72.518%0.17636%0.358CS..Hα-helixtrans-68.5-40.7-177.2-62.70000112.5C112 D254 R258 I260C112-C256 WeakPolarHBondContact CA-SG 3.24Å; C112-C256 HydrophobicContact CB-CB 3.6Å; C112-C256 WeakPolarHBondContact CB-SG 3.45Å; C112-C256 WeakPolarHBondContact SG-CA 3.32Å; C112-C256 WeakPolarHBondContact SG-CB 3.35Å; C112-C256 CovalentContact SG-SG 2.04Å; C112-C256 PolarHBondContact SG-SG 3.48Å; D254-C256 PolarHBondContact O-N 3Å; C256-R258 VanDerWaalsContact C-N 3.28Å; C256-R258 PolarHBondContact O-N 2.65Å; C256-I260 HydrophobicContact CB-CD1 4.26Å; C256-I260 WeakPolarHBondContact O-CB 3.3Å; C256-I260 WeakPolarHBondContact O-CD1 3.45Å; C256-I260 WeakPolarHBondContact O-CG1 3.23Å; C256-I260 PolarHBondContact O-N 3.48Å; C256-I260 VanDerWaalsContact O-N 3.15Å
257H83.8Confident77.2Confident103 Ų10376.9 Ų76.948%0.47738%0.38SS..Hα-helixtrans-71.1-26.6173.7-69.2-91000112.5D254D254-H257 PolarHBondContact O-N 3.45Å; D254-H257 VanDerWaalsContact OD1-CB 3.24Å; D254-H257 WeakPolarHBondContact OD1-CB 3.49Å; D254-H257 IonicContact OD1-CD2 3.36Å; D254-H257 PolarHBondContact OD1-CD2 3.02Å; D254-H257 IonicContact OD1-CG 3.47Å; D254-H257 VanDerWaalsContact OD1-CG 3.25Å; D254-H257 IonicContact OD1-NE2 3.25Å; D254-H257 WeakPolarHBondContact OD2-CB 3.38Å; D254-H257 IonicContact OD2-CG 2.83Å
258R83.1Confident75Confident161 Ų16175.1 Ų75.161%0.60837%0.37SS*.Hα-helixtrans-71.9-41.3177.6-175.2174.9-176.2148.52.9113.2D254 S255 C256D254-R258 WeakPolarHBondContact O-CB 3.35Å; D254-R258 PolarHBondContact O-N 3.44Å; S255-R258 WeakPolarHBondContact O-CB 3.49Å; S255-R258 PolarHBondContact O-N 3.28Å; C256-R258 VanDerWaalsContact C-N 3.28Å; C256-R258 PolarHBondContact O-N 2.65Å
259F84.3Confident72.8Confident18 Ų1876.4 Ų76.48%0.07938%0.382CS..Hα-helixtrans-97.8-15.9-171.4-57.6-52.2000113.8N180 H182 E248 Y249 F252 S255N180-F259 PolarHBondContact ND2-O 2.84Å; H182-F259 HydrophobicContact CB-CB 4.26Å; H182-F259 HydrophobicContact CB-CD1 3.98Å; H182-F259 HydrophobicContact CB-CG 4.35Å; H182-F259 AromaticContact ND1-CD1 3.77Å; H182-F259 AromaticContact ND1-CG 3.84Å; E248-F259 HydrophobicContact CG-CE2 4.29Å; E248-F259 HydrophobicContact CG-CZ 3.97Å; Y249-F259 AromaticContact CD1-CD2 3.9Å; Y249-F259 HydrophobicContact CD1-CD2 3.9Å; Y249-F259 HydrophobicContact CD1-CE2 4.11Å; Y249-F259 AromaticContact CE1-CD2 3.78Å; Y249-F259 HydrophobicContact CE1-CD2 3.78Å; Y249-F259 HydrophobicContact CE1-CE2 4.35Å; F252-F259 HydrophobicContact CD2-CE2 4.31Å; F252-F259 HydrophobicContact CD2-CZ 4.01Å; F252-F259 HydrophobicContact CE2-CZ 4.01Å; S255-F259 WeakPolarHBondContact O-CD2 3.37Å; S255-F259 WeakPolarHBondContact O-CG 3.46Å; S255-F259 PolarHBondContact O-N 3.31Å
260I84.4Confident70.3Confident10 Ų1080.6 Ų80.65%0.05141%0.412CS..SBendtrans-94.8132.4178.6-59.8174.3000110.1C112 F113 C256 F264C112-I260 HydrophobicContact CB-CD1 3.56Å; C112-I260 HydrophobicContact CB-CG1 4.43Å; F113-I260 HydrophobicContact CD1-CD1 4.46Å; F113-I260 HydrophobicContact CE1-CD1 3.73Å; F113-I260 HydrophobicContact CE1-CG1 4.24Å; F113-I260 HydrophobicContact CE1-CG2 4.36Å; F113-I260 HydrophobicContact CE2-CD1 3.93Å; F113-I260 HydrophobicContact CE2-CG1 4.09Å; F113-I260 HydrophobicContact CZ-CB 4.5Å; F113-I260 HydrophobicContact CZ-CD1 3.44Å; F113-I260 VanDerWaalsContact CZ-CD1 3.44Å; F113-I260 HydrophobicContact CZ-CG1 3.55Å; F113-I260 HydrophobicContact CZ-CG2 4.2Å; C256-I260 HydrophobicContact CB-CD1 4.26Å; C256-I260 WeakPolarHBondContact O-CB 3.3Å; C256-I260 WeakPolarHBondContact O-CD1 3.45Å; C256-I260 WeakPolarHBondContact O-CG1 3.23Å; C256-I260 PolarHBondContact O-N 3.48Å; C256-I260 VanDerWaalsContact O-N 3.15Å; I260-F264 HydrophobicContact CG2-CB 3.75Å
261P75.4Confident68.1Low39 Ų3979.4 Ų79.425%0.25341%0.412SS..  trans-56.9143.6171-20.829.1000112.5H175 N263 F264 S265H175-P261 WeakPolarHBondContact O-CD 3.31Å; H175-P261 VanDerWaalsContact O-CG 3.25Å; H175-P261 WeakPolarHBondContact O-CG 3.3Å; P261-N263 PolarHBondContact O-N 3.3Å; P261-F264 HydrophobicContact CB-CD2 4.35Å; P261-F264 HydrophobicContact CG-CD2 4.49Å; P261-F264 PolarHBondContact O-N 3.22Å; P261-S265 PolarHBondContact O-N 3.35Å
262R65.4Low66.1Low226 Ų22678.4 Ų78.485%0.85340%0.402SS*.THydrogen-bonded Turntrans-57.5-22.7-178.3-67.9-174.9-177.1176.91.1115F264 S265R262-F264 VanDerWaalsContact C-N 3.27Å; R262-F264 PolarHBondContact O-N 3.36Å; R262-S265 WeakPolarHBondContact CA-OG 3.27Å; R262-S265 PolarHBondContact O-OG 3.21Å
263N60.6Low63.9Low149 Ų14980.9 Ų80.980%0.79742%0.42SS*.THydrogen-bonded Turntrans-74.2-18.5176.6-70.3-1.6000113P261P261-N263 PolarHBondContact O-N 3.3Å
264F58.8Low61.9Low54 Ų5477.1 Ų77.124%0.23740%0.4CS..THydrogen-bonded Turntrans-106.8-5.7179.5-70.3-83.1000113.1F173 I260 P261 R262 E266 I267F173-F264 HydrophobicContact CE1-CE1 4.25Å; F173-F264 HydrophobicContact CE1-CZ 4.06Å; F173-F264 HydrophobicContact CZ-CZ 4.25Å; I260-F264 HydrophobicContact CG2-CB 3.75Å; P261-F264 HydrophobicContact CB-CD2 4.35Å; P261-F264 HydrophobicContact CG-CD2 4.49Å; P261-F264 PolarHBondContact O-N 3.22Å; R262-F264 VanDerWaalsContact C-N 3.27Å; R262-F264 PolarHBondContact O-N 3.36Å; F264-E266 VanDerWaalsContact C-N 3.3Å; F264-E266 PolarHBondContact O-N 3.21Å; F264-I267 HydrophobicContact CD1-CD1 4.11Å; F264-I267 PolarHBondContact O-N 2.98Å
265S55.2Low59.9Low28 Ų2879.4 Ų79.420%0.19641%0.412CS..Hα-helixtrans-67-25.9-179.743.40000114.1P261 R262 I267 S268 S269P261-S265 PolarHBondContact O-N 3.35Å; R262-S265 WeakPolarHBondContact CA-OG 3.27Å; R262-S265 PolarHBondContact O-OG 3.21Å; S265-I267 VanDerWaalsContact C-N 3.28Å; S265-I267 PolarHBondContact O-N 3.18Å; S265-S268 PolarHBondContact O-N 2.83Å; S265-S269 PolarHBondContact O-N 3.21Å; S265-S269 VanDerWaalsContact O-N 3.11Å; S265-S269 PolarHBondContact O-OG 3.09Å
266E49.9Very low58.1Low161 Ų16185.3 Ų85.375%0.75243%0.434SS*.Hα-helixtrans-67.2-28.2176.4-71.5-175.7170.800112.7F264 S268 S269F264-E266 VanDerWaalsContact C-N 3.3Å; F264-E266 PolarHBondContact O-N 3.21Å; E266-S268 VanDerWaalsContact C-N 3.35Å; E266-S269 PolarHBondContact O-OG 3.16Å
267I52.3Low55.5Low93 Ų9388.3 Ų88.348%0.47746%0.455SS..Hα-helixtrans-74.4-28.4175.1-58.4171.3000110.8F264 S265 S270F264-I267 HydrophobicContact CD1-CD1 4.11Å; F264-I267 PolarHBondContact O-N 2.98Å; S265-I267 VanDerWaalsContact C-N 3.28Å; S265-I267 PolarHBondContact O-N 3.18Å; I267-S270 PolarHBondContact O-OG 3.11Å
268S49.1Very low53.2Low8 Ų891 Ų916%0.05647%0.474CS..Hα-helixtrans-82.8-27.8178.9-178.90000113.3S265 E266 S270 S271S265-S268 PolarHBondContact O-N 2.83Å; E266-S268 VanDerWaalsContact C-N 3.35Å; S268-S270 VanDerWaalsContact C-N 3.33Å; S268-S270 PolarHBondContact O-N 3.41Å; S268-S271 PolarHBondContact O-OG 3.4Å
269S46Very low50.7Low58 Ų5888.8 Ų88.841%0.40648%0.482SS..Hα-helixtrans-73-18.8-173.848.60000115S265 E266S265-S269 PolarHBondContact O-N 3.21Å; S265-S269 VanDerWaalsContact O-N 3.11Å; S265-S269 PolarHBondContact O-OG 3.09Å; E266-S269 PolarHBondContact O-OG 3.16Å
270S39.8Very low48.6Very low92 Ų9293.6 Ų93.664%0.64352%0.516SS*.Hα-helixtrans-80.5-12179.842.80000114.5I267 S268I267-S270 PolarHBondContact O-OG 3.11Å; S268-S270 VanDerWaalsContact C-N 3.33Å; S268-S270 PolarHBondContact O-N 3.41Å
271S44.4Very low46.2Very low27 Ų2797.9 Ų97.919%0.18955%0.553CS.*Hα-helixtrans-120.1-16.5-174.3490000114.8S268S268-S271 PolarHBondContact O-OG 3.4Å
272V46.7Very low44.2Very low54 Ų54108.6 Ų108.633%0.32760%0.603SS.*Hα-helixtrans-83.7-32.5176.6179.60000112S274 Y276V272-S274 VanDerWaalsContact C-N 3.32Å; V272-S274 PolarHBondContact O-N 3.3Å; V272-Y276 HydrophobicContact CG1-CD2 4.03Å; V272-Y276 WeakPolarHBondContact O-CD2 3.43Å
273N36.1Very low43.1Very low133 Ų133102.8 Ų102.871%0.71159%0.59SS**THydrogen-bonded Turntrans-76.6-8.5-174.8-88.3-15000115.7
274S36.1Very low42.2Very low85 Ų85100.3 Ų100.359%0.59458%0.579SS**THydrogen-bonded Turntrans-97.4-14.1-178.855.50000114.7V272V272-S274 VanDerWaalsContact C-N 3.32Å; V272-S274 PolarHBondContact O-N 3.3Å
275N37.6Very low41.3Very low137 Ų137102.9 Ų102.973%0.73360%0.598SS**THydrogen-bonded Turntrans-121.5-5.5-175.2-81.7-22.3000115.5
276Y45.8Very low40.5Very low130 Ų130107.3 Ų107.351%0.5162%0.622SS.*SBendtrans-115.34.2-174.2-71.9-79.8000115.1V272V272-Y276 HydrophobicContact CG1-CD2 4.03Å; V272-Y276 WeakPolarHBondContact O-CD2 3.43Å
277S31.6Very low39.9Very low88 Ų88103.9 Ų103.962%0.61561%0.614SS**SBendtrans-99.324.6-177.263.60000115
278N34.3Very low39Very low161 Ų161104.7 Ų104.786%0.86162%0.623SS**  trans-138.481.1172.7-84.1-31.6000111.2
279S30.6Very low38.3Very low113 Ų113111.6 Ų111.679%0.7966%0.663SS**  trans-138.4122143.9-156.20000108.1
280P40Very low37.7Very low120 Ų120115.7 Ų115.778%0.77968%0.683SS**  trans-72.2140.9178.227.7-27.7000109.6M282P280-M282 PolarHBondContact O-N 3.34Å
281A34.9Very low37.6Very low100 Ų100117.7 Ų117.783%0.82669%0.686SS**  trans-61.3122165.700000109.6
282M32.8Very low36.9Very low264 Ų264125.9 Ų125.9100%1.373%0.732SS**  trans-1630148.3-104.3-179.2-155.400109.3P280P280-M282 PolarHBondContact O-N 3.34Å

Retrieved 282 of 282 residues in 163.5 ms (Link to these results)

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