A0A087WRS7_MOUSE Loading...

Neuromedin B receptor

AlphaFold DB , UniProt , Accession A0A087WRS7, Species MOUSE (Mus musculus, Mouse), Gene Nmbr, Length 141 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
1M42.7Very low57.9Low221 Ų221118.6 Ų118.6100%1.08963%0.631SS**  079.40-67.2167171.200106.8
2D46.5Very low58.9Low124 Ų124114.1 Ų114.166%0.66361%0.611SS**  trans-136.3-9.1-159.9-55.4-76.3000114.8S6D2-S6 PolarHBondContact O-OG 3.18Å
3M52.2Low59.7Low174 Ų174110.2 Ų110.286%0.85760%0.598SS**Hα-helixtrans-77.6-30.6-171.9-155.770.470.400113.9
4Q53.8Low60.4Low176 Ų176110.8 Ų110.882%0.82260%0.6SS**Hα-helixtrans-75.2-37.2-179.7-94.4-179.9-13.900112.7G7 V8Q4-G7 PolarHBondContact O-N 2.95Å; Q4-V8 WeakPolarHBondContact O-CG2 3.29Å; Q4-V8 PolarHBondContact O-N 2.86Å
5T56.8Low60.9Low86 Ų86106.8 Ų106.853%0.52858%0.575SS.*Hα-helixtrans-68.6-42.8-179-48.80000111.2G7 V8 L9T5-G7 VanDerWaalsContact C-N 3.33Å; T5-G7 PolarHBondContact O-N 2.81Å; T5-V8 PolarHBondContact O-N 3.32Å; T5-L9 HydrophobicContact CG2-CD1 3.96Å; T5-L9 HydrophobicContact CG2-CG 4.39Å; T5-L9 WeakPolarHBondContact O-CB 3.31Å; T5-L9 VanDerWaalsContact O-CG 3.23Å; T5-L9 WeakPolarHBondContact O-CG 3.21Å; T5-L9 PolarHBondContact O-N 2.98Å
6S59.3Low61.6Low60 Ų60103.6 Ų103.642%0.4257%0.568SS.*Hα-helixtrans-62.5-37.5177.5-54.40000112.9D2 L9 L10D2-S6 PolarHBondContact O-OG 3.18Å; S6-L9 PolarHBondContact O-N 2.93Å; S6-L10 WeakPolarHBondContact O-CB 3.34Å; S6-L10 WeakPolarHBondContact O-CG 3.2Å; S6-L10 PolarHBondContact O-N 3.49Å
7G62.7Low62.2Low43 Ų43102.6 Ų102.644%0.44357%0.565SS.*Hα-helixtrans-67.8-39.7177.600000113.2Q4 T5 W11Q4-G7 PolarHBondContact O-N 2.95Å; T5-G7 VanDerWaalsContact C-N 3.33Å; T5-G7 PolarHBondContact O-N 2.81Å; G7-W11 WeakPolarHBondContact O-CB 3.23Å; G7-W11 PolarHBondContact O-N 3.1Å; G7-W11 VanDerWaalsContact O-N 3.1Å
8V64.3Low62.7Low95 Ų9598.8 Ų98.858%0.57655%0.553SS**Hα-helixtrans-66.7-43.6174.2175.90000110.3Q4 T5 W11 T12Q4-V8 WeakPolarHBondContact O-CG2 3.29Å; Q4-V8 PolarHBondContact O-N 2.86Å; T5-V8 PolarHBondContact O-N 3.32Å; V8-W11 PolarHBondContact O-N 3.42Å; V8-T12 PolarHBondContact O-N 2.93Å; V8-T12 PolarHBondContact O-OG1 3.43Å
9L66.1Low63.3Low98 Ų9897.1 Ų97.151%0.51354%0.542SS..Hα-helixtrans-63-46.3178-72.1171.6000112.3T5 S6 W11 T12 S13T5-L9 HydrophobicContact CG2-CD1 3.96Å; T5-L9 HydrophobicContact CG2-CG 4.39Å; T5-L9 WeakPolarHBondContact O-CB 3.31Å; T5-L9 VanDerWaalsContact O-CG 3.23Å; T5-L9 WeakPolarHBondContact O-CG 3.21Å; T5-L9 PolarHBondContact O-N 2.98Å; S6-L9 PolarHBondContact O-N 2.93Å; L9-W11 VanDerWaalsContact C-N 3.31Å; L9-W11 PolarHBondContact O-N 3.34Å; L9-T12 VanDerWaalsContact CA-OG1 3.31Å; L9-T12 WeakPolarHBondContact CA-OG1 3.41Å; L9-T12 PolarHBondContact O-N 3.31Å; L9-T12 PolarHBondContact O-OG1 3.27Å; L9-S13 VanDerWaalsContact O-CB 3.29Å; L9-S13 WeakPolarHBondContact O-CB 3.44Å; L9-S13 PolarHBondContact O-N 3.39Å; L9-S13 PolarHBondContact O-OG 2.88Å
10L67.8Low64.1Low114 Ų114101.4 Ų101.460%0.59755%0.549SS*.Hα-helixtrans-61.6-40.7176.7-74.5168.2000111.5S6 S13 L14S6-L10 WeakPolarHBondContact O-CB 3.34Å; S6-L10 WeakPolarHBondContact O-CG 3.2Å; S6-L10 PolarHBondContact O-N 3.49Å; L10-S13 PolarHBondContact O-N 3.45Å; L10-L14 WeakPolarHBondContact O-CB 3.24Å; L10-L14 WeakPolarHBondContact O-CD1 3.47Å; L10-L14 WeakPolarHBondContact O-CG 3.39Å; L10-L14 PolarHBondContact O-N 2.82Å
11W64.4Low64.4Low114 Ų11499.8 Ų99.843%0.43254%0.543SS..Hα-helixtrans-64.8-45.4176.5-175.4-96.2000112.3G7 V8 L9 L14 K15 H86G7-W11 WeakPolarHBondContact O-CB 3.23Å; G7-W11 PolarHBondContact O-N 3.1Å; G7-W11 VanDerWaalsContact O-N 3.1Å; V8-W11 PolarHBondContact O-N 3.42Å; L9-W11 VanDerWaalsContact C-N 3.31Å; L9-W11 PolarHBondContact O-N 3.34Å; W11-L14 PolarHBondContact O-N 3.41Å; W11-K15 VanDerWaalsContact O-CG 3.28Å; W11-K15 WeakPolarHBondContact O-CG 3.43Å; W11-K15 PolarHBondContact O-N 3.04Å; W11-H86 AromaticContact CH2-NE2 3.32Å; W11-H86 VanDerWaalsContact CH2-NE2 3.32Å; W11-H86 WeakPolarHBondContact CH2-NE2 3.2Å; W11-H86 AromaticContact CZ2-NE2 3.66Å
12T70.3Confident65.6Low64 Ų6491.8 Ų91.839%0.39351%0.507SS..Hα-helixtrans-65.8-39176.246.40000112.2V8 L9 K15 A16V8-T12 PolarHBondContact O-N 2.93Å; V8-T12 PolarHBondContact O-OG1 3.43Å; L9-T12 VanDerWaalsContact CA-OG1 3.31Å; L9-T12 WeakPolarHBondContact CA-OG1 3.41Å; L9-T12 PolarHBondContact O-N 3.31Å; L9-T12 PolarHBondContact O-OG1 3.27Å; T12-K15 WeakPolarHBondContact O-CB 3.48Å; T12-K15 PolarHBondContact O-N 2.85Å; T12-A16 WeakPolarHBondContact O-CB 3.4Å; T12-A16 PolarHBondContact O-N 2.68Å
13S68.9Low66.7Low64 Ų6489.1 Ų89.145%0.44850%0.498SS..Hα-helixtrans-66.2-42.7176.9-65.50000111.4L9 L10 K15 A16 V17L9-S13 VanDerWaalsContact O-CB 3.29Å; L9-S13 WeakPolarHBondContact O-CB 3.44Å; L9-S13 PolarHBondContact O-N 3.39Å; L9-S13 PolarHBondContact O-OG 2.88Å; L10-S13 PolarHBondContact O-N 3.45Å; S13-K15 VanDerWaalsContact C-N 3.3Å; S13-K15 PolarHBondContact O-N 3.3Å; S13-A16 PolarHBondContact O-N 2.89Å; S13-V17 WeakPolarHBondContact O-CB 3.35Å; S13-V17 VanDerWaalsContact O-CG2 3.24Å; S13-V17 WeakPolarHBondContact O-CG2 3.5Å; S13-V17 PolarHBondContact O-N 2.89Å
14L69.6Low67.6Low118 Ų11884 Ų8462%0.61848%0.476SS*.Hα-helixtrans-62.4-37.9174.5-75.4167.8000112.1L10 W11 G18L10-L14 WeakPolarHBondContact O-CB 3.24Å; L10-L14 WeakPolarHBondContact O-CD1 3.47Å; L10-L14 WeakPolarHBondContact O-CG 3.39Å; L10-L14 PolarHBondContact O-N 2.82Å; W11-L14 PolarHBondContact O-N 3.41Å; L14-G18 PolarHBondContact O-N 3.06Å
15K68.2Low68.4Low51 Ų5180.8 Ų80.822%0.22246%0.464CS..Hα-helixtrans-64.6-46.9173.1-72-74.8115.2170.40111.4W11 T12 S13 G18 I19 S123W11-K15 VanDerWaalsContact O-CG 3.28Å; W11-K15 WeakPolarHBondContact O-CG 3.43Å; W11-K15 PolarHBondContact O-N 3.04Å; T12-K15 WeakPolarHBondContact O-CB 3.48Å; T12-K15 PolarHBondContact O-N 2.85Å; S13-K15 VanDerWaalsContact C-N 3.3Å; S13-K15 PolarHBondContact O-N 3.3Å; K15-G18 PolarHBondContact O-N 3.29Å; K15-I19 WeakPolarHBondContact O-CD1 3.37Å; K15-I19 VanDerWaalsContact O-CG1 3.24Å; K15-I19 WeakPolarHBondContact O-CG1 3.43Å; K15-I19 PolarHBondContact O-N 2.9Å; K15-S123 PolarHBondContact NZ-OG 3.48Å
16A71.6Confident68.7Low56 Ų5678.8 Ų78.846%0.46345%0.45SS..Hα-helixtrans-63.3-44.7179.400000112.1T12 S13 G18 I19 W20T12-A16 WeakPolarHBondContact O-CB 3.4Å; T12-A16 PolarHBondContact O-N 2.68Å; S13-A16 PolarHBondContact O-N 2.89Å; A16-G18 VanDerWaalsContact C-N 3.34Å; A16-G18 PolarHBondContact O-N 2.99Å; A16-I19 PolarHBondContact O-N 3.48Å; A16-W20 WeakPolarHBondContact O-CB 3.15Å; A16-W20 PolarHBondContact O-N 2.75Å
17V72.4Confident69Low86 Ų8678.4 Ų78.452%0.52145%0.45SS..Hα-helixtrans-63.1-41.6175172.70000110.6S13 I19 W20 V21S13-V17 WeakPolarHBondContact O-CB 3.35Å; S13-V17 VanDerWaalsContact O-CG2 3.24Å; S13-V17 WeakPolarHBondContact O-CG2 3.5Å; S13-V17 PolarHBondContact O-N 2.89Å; V17-I19 VanDerWaalsContact C-N 3.35Å; V17-I19 PolarHBondContact O-N 3.28Å; V17-W20 PolarHBondContact O-N 3.28Å; V17-V21 HydrophobicContact CG1-CG2 4.22Å; V17-V21 WeakPolarHBondContact O-CB 3.28Å; V17-V21 VanDerWaalsContact O-CG2 3.27Å; V17-V21 WeakPolarHBondContact O-CG2 3.45Å; V17-V21 PolarHBondContact O-N 3.36Å
18G71.3Confident68.9Low34 Ų3480.2 Ų80.235%0.35145%0.452SS..Hα-helixtrans-59.2-43.7174.600000112.8L14 K15 A16 V22L14-G18 PolarHBondContact O-N 3.06Å; K15-G18 PolarHBondContact O-N 3.29Å; A16-G18 VanDerWaalsContact C-N 3.34Å; A16-G18 PolarHBondContact O-N 2.99Å; G18-V22 WeakPolarHBondContact O-CB 3.21Å; G18-V22 WeakPolarHBondContact O-CG2 3.23Å; G18-V22 PolarHBondContact O-N 3.48Å
19I73.9Confident68.5Low67 Ų6777.5 Ų77.534%0.34444%0.436SS..Hα-helixtrans-65.5-44176.6-64.8161.4000110.9K15 A16 V17 V22 S23 L126 I130K15-I19 WeakPolarHBondContact O-CD1 3.37Å; K15-I19 VanDerWaalsContact O-CG1 3.24Å; K15-I19 WeakPolarHBondContact O-CG1 3.43Å; K15-I19 PolarHBondContact O-N 2.9Å; A16-I19 PolarHBondContact O-N 3.48Å; V17-I19 VanDerWaalsContact C-N 3.35Å; V17-I19 PolarHBondContact O-N 3.28Å; I19-V22 PolarHBondContact O-N 2.95Å; I19-S23 VanDerWaalsContact O-CB 3.26Å; I19-S23 WeakPolarHBondContact O-CB 3.27Å; I19-S23 PolarHBondContact O-N 2.75Å; I19-L126 HydrophobicContact CD1-CD1 4.47Å; I19-L126 HydrophobicContact CD1-CD2 3.89Å; I19-L126 HydrophobicContact CD1-CG 4.3Å; I19-I130 HydrophobicContact CD1-CD1 3.74Å; I19-I130 HydrophobicContact CG1-CD1 3.64Å
20W79Confident68Low182 Ų18278.4 Ų78.469%0.68944%0.438SS*.Hα-helixtrans-61.9-46.6179.2-171.179.6000111.6A16 V17 S23 V24A16-W20 WeakPolarHBondContact O-CB 3.15Å; A16-W20 PolarHBondContact O-N 2.75Å; V17-W20 PolarHBondContact O-N 3.28Å; W20-S23 PolarHBondContact O-N 3.5Å; W20-V24 HydrophobicContact CD2-CG2 4.3Å; W20-V24 HydrophobicContact CE3-CG2 4.47Å; W20-V24 HydrophobicContact CH2-CG2 4.44Å; W20-V24 HydrophobicContact CZ2-CG2 4.26Å; W20-V24 WeakPolarHBondContact O-CG2 3.34Å; W20-V24 PolarHBondContact O-N 3.01Å
21V71.3Confident67.6Low68 Ų6875.6 Ų75.641%0.41243%0.432SS..Hα-helixtrans-63.2-45.5176.8171.30000111.2V17 S23 V24 L25V17-V21 HydrophobicContact CG1-CG2 4.22Å; V17-V21 WeakPolarHBondContact O-CB 3.28Å; V17-V21 VanDerWaalsContact O-CG2 3.27Å; V17-V21 WeakPolarHBondContact O-CG2 3.45Å; V17-V21 PolarHBondContact O-N 3.36Å; V21-S23 PolarHBondContact O-N 2.84Å; V21-V24 PolarHBondContact O-N 3.5Å; V21-L25 WeakPolarHBondContact O-CB 3.41Å; V21-L25 PolarHBondContact O-N 2.87Å
22V67.9Low67.3Low54 Ų5475.2 Ų75.233%0.32744%0.442SS..Hα-helixtrans-61.6-44.3177.5169.90000110.7G18 I19 V24 L25 L26 F134G18-V22 WeakPolarHBondContact O-CB 3.21Å; G18-V22 WeakPolarHBondContact O-CG2 3.23Å; G18-V22 PolarHBondContact O-N 3.48Å; I19-V22 PolarHBondContact O-N 2.95Å; V22-V24 PolarHBondContact O-N 2.89Å; V22-L25 PolarHBondContact O-N 3.36Å; V22-L26 HydrophobicContact CG1-CD1 3.41Å; V22-L26 VanDerWaalsContact CG1-CD1 3.41Å; V22-L26 WeakPolarHBondContact O-CD1 3.33Å; V22-L26 PolarHBondContact O-N 3.33Å; V22-F134 HydrophobicContact CG1-CE2 3.97Å; V22-F134 HydrophobicContact CG1-CZ 3.83Å
23S68.6Low66.4Low68 Ų6880 Ų8048%0.47646%0.457SS..Hα-helixtrans-61.2-43.7176.5-179.40000112.5I19 W20 V21 L26 A27I19-S23 VanDerWaalsContact O-CB 3.26Å; I19-S23 WeakPolarHBondContact O-CB 3.27Å; I19-S23 PolarHBondContact O-N 2.75Å; W20-S23 PolarHBondContact O-N 3.5Å; V21-S23 PolarHBondContact O-N 2.84Å; S23-L26 PolarHBondContact O-N 3.22Å; S23-A27 WeakPolarHBondContact O-CB 3.43Å; S23-A27 PolarHBondContact O-N 3.27Å
24V72.6Confident65.4Low65 Ų6581.2 Ų81.239%0.39447%0.465SS..Hα-helixtrans-63.8-43.7174.8170.60000110.6W20 V21 V22 L26 A27 V28W20-V24 HydrophobicContact CD2-CG2 4.3Å; W20-V24 HydrophobicContact CE3-CG2 4.47Å; W20-V24 HydrophobicContact CH2-CG2 4.44Å; W20-V24 HydrophobicContact CZ2-CG2 4.26Å; W20-V24 WeakPolarHBondContact O-CG2 3.34Å; W20-V24 PolarHBondContact O-N 3.01Å; V21-V24 PolarHBondContact O-N 3.5Å; V22-V24 PolarHBondContact O-N 2.89Å; V24-L26 VanDerWaalsContact C-N 3.26Å; V24-L26 PolarHBondContact O-N 3.24Å; V24-A27 PolarHBondContact O-N 2.82Å; V24-V28 WeakPolarHBondContact O-CG2 3.14Å; V24-V28 PolarHBondContact O-N 3.42Å; V24-V28 VanDerWaalsContact O-N 3.11Å
25L69.1Low64.1Low110 Ų11083.2 Ų83.258%0.57647%0.472SS*.Hα-helixtrans-61.9-33.9179.2-129.784.5000112.8V21 V22 P29V21-L25 WeakPolarHBondContact O-CB 3.41Å; V21-L25 PolarHBondContact O-N 2.87Å; V22-L25 PolarHBondContact O-N 3.36Å; L25-P29 WeakPolarHBondContact O-CD 3.33Å
26L63.8Low63Low44 Ų4485 Ų8523%0.2349%0.487CS..Hα-helixtrans-81.6-26.2176.2-81.7124000113.6V22 S23 V24 P29 V71 I75 F134V22-L26 HydrophobicContact CG1-CD1 3.41Å; V22-L26 VanDerWaalsContact CG1-CD1 3.41Å; V22-L26 WeakPolarHBondContact O-CD1 3.33Å; V22-L26 PolarHBondContact O-N 3.33Å; S23-L26 PolarHBondContact O-N 3.22Å; V24-L26 VanDerWaalsContact C-N 3.26Å; V24-L26 PolarHBondContact O-N 3.24Å; L26-P29 VanDerWaalsContact O-CD 3.29Å; L26-P29 WeakPolarHBondContact O-CD 3.37Å; L26-P29 VanDerWaalsContact O-CG 3.32Å; L26-P29 WeakPolarHBondContact O-CG 3.32Å; L26-V71 HydrophobicContact CD2-CG1 3.69Å; L26-V71 HydrophobicContact CG-CG1 4.22Å; L26-I75 HydrophobicContact CD1-CD1 3.89Å; L26-I75 HydrophobicContact CD2-CD1 4.32Å; L26-F134 HydrophobicContact CB-CE1 4.1Å; L26-F134 HydrophobicContact CD1-CD1 4.07Å; L26-F134 HydrophobicContact CD1-CE1 3.14Å; L26-F134 HydrophobicContact CD1-CE2 4.22Å; L26-F134 HydrophobicContact CD1-CZ 3.26Å; L26-F134 HydrophobicContact CD2-CD1 3.88Å; L26-F134 HydrophobicContact CD2-CE1 3.57Å; L26-F134 HydrophobicContact CG-CE1 3.75Å; L26-F134 HydrophobicContact CG-CZ 4.31Å
27A65.6Low61.8Low51 Ų5186.8 Ų86.842%0.42150%0.501SS..Hα-helixtrans-73.3-32.3174.400000112.5S23 V24 E30 A31S23-A27 WeakPolarHBondContact O-CB 3.43Å; S23-A27 PolarHBondContact O-N 3.27Å; V24-A27 PolarHBondContact O-N 2.82Å; A27-E30 PolarHBondContact O-N 2.93Å; A27-A31 WeakPolarHBondContact O-CB 3.33Å; A27-A31 PolarHBondContact O-N 3.45Å
28V60Low60.4Low82 Ų8293.1 Ų93.150%0.49752%0.516SS..Hα-helixtrans-55.9-50.1177.7171.60000113.2V24 E30 A31 V32V24-V28 WeakPolarHBondContact O-CG2 3.14Å; V24-V28 PolarHBondContact O-N 3.42Å; V24-V28 VanDerWaalsContact O-N 3.11Å; V28-E30 VanDerWaalsContact C-N 3.34Å; V28-E30 PolarHBondContact O-N 3.29Å; V28-A31 PolarHBondContact O-N 2.96Å; V28-V32 HydrophobicContact CG1-CG2 4.42Å; V28-V32 WeakPolarHBondContact O-CB 3.22Å; V28-V32 WeakPolarHBondContact O-CG2 3.36Å; V28-V32 PolarHBondContact O-N 2.93Å
29P56.3Low59.2Low37 Ų3798.6 Ų98.624%0.2454%0.536CS..Hα-helixtrans-70.7-26.3-179.726.2-35.2000114.7L25 L26 F33 L67L25-P29 WeakPolarHBondContact O-CD 3.33Å; L26-P29 VanDerWaalsContact O-CD 3.29Å; L26-P29 WeakPolarHBondContact O-CD 3.37Å; L26-P29 VanDerWaalsContact O-CG 3.32Å; L26-P29 WeakPolarHBondContact O-CG 3.32Å; P29-F33 PolarHBondContact O-N 2.82Å; P29-L67 HydrophobicContact CB-CD1 4.31Å; P29-L67 HydrophobicContact CB-CD2 3.26Å; P29-L67 HydrophobicContact CB-CG 4.37Å; P29-L67 HydrophobicContact CG-CD2 3.92Å
30E56.2Low57.7Low117 Ų11798.9 Ų98.955%0.54756%0.555SS.*Hα-helixtrans-73.3-44.4173.1-165.7-80.5145.600110.9A27 V28 V32 F33 S34A27-E30 PolarHBondContact O-N 2.93Å; V28-E30 VanDerWaalsContact C-N 3.34Å; V28-E30 PolarHBondContact O-N 3.29Å; E30-V32 VanDerWaalsContact C-N 3.34Å; E30-V32 PolarHBondContact O-N 3.21Å; E30-F33 WeakPolarHBondContact O-CA 3.26Å; E30-F33 WeakPolarHBondContact O-CB 3.49Å; E30-F33 PolarHBondContact O-N 3.44Å; E30-S34 PolarHBondContact O-N 2.76Å
31A59Low55.9Low56 Ų5695.2 Ų95.246%0.46356%0.557SS.*Hα-helixtrans-64.4-36.2177.900000113.1A27 V28 F33 S34A27-A31 WeakPolarHBondContact O-CB 3.33Å; A27-A31 PolarHBondContact O-N 3.45Å; V28-A31 PolarHBondContact O-N 2.96Å; A31-F33 PolarHBondContact O-N 2.97Å; A31-S34 PolarHBondContact O-N 3.29Å
32V56.9Low54.9Low106 Ų106100.2 Ų100.264%0.64258%0.58SS**Hα-helixtrans-69.8-21.6175.4175.50000111.7V28 E30V28-V32 HydrophobicContact CG1-CG2 4.42Å; V28-V32 WeakPolarHBondContact O-CB 3.22Å; V28-V32 WeakPolarHBondContact O-CG2 3.36Å; V28-V32 PolarHBondContact O-N 2.93Å; E30-V32 VanDerWaalsContact C-N 3.34Å; E30-V32 PolarHBondContact O-N 3.21Å
33F52Low53.7Low165 Ų165103.6 Ų103.672%0.72460%0.596SS**Hα-helixtrans-86.8-23.2173.7-161.5-95.8000113P29 E30 A31 E35P29-F33 PolarHBondContact O-N 2.82Å; E30-F33 WeakPolarHBondContact O-CA 3.26Å; E30-F33 WeakPolarHBondContact O-CB 3.49Å; E30-F33 PolarHBondContact O-N 3.44Å; A31-F33 PolarHBondContact O-N 2.97Å; F33-E35 PolarHBondContact O-N 3.35Å
34S48Very low52.7Low88 Ų88107.3 Ų107.362%0.61561%0.611SS**SBendtrans-74.4-11.5176.9-140.70000113.5E30 A31 V36E30-S34 PolarHBondContact O-N 2.76Å; A31-S34 PolarHBondContact O-N 3.29Å; S34-V36 PolarHBondContact O-N 2.87Å; S34-V36 VanDerWaalsContact O-N 3.11Å
35E43.1Very low51.3Low160 Ų160109.2 Ų109.275%0.74863%0.628SS**SBendtrans-79.694.5175.3-162.786.9-129.500110.9F33 A37F33-E35 PolarHBondContact O-N 3.35Å; E35-A37 PolarHBondContact O-N 3.49Å
36V44.7Very low50.2Low89 Ų89109.6 Ų109.654%0.53964%0.639SS.*  trans20.997.6147.7169.10000116.7S34 R38S34-V36 PolarHBondContact O-N 2.87Å; S34-V36 VanDerWaalsContact O-N 3.11Å; V36-R38 VanDerWaalsContact C-N 3.33Å; V36-R38 HydrophobicContact CG1-CB 3.7Å; V36-R38 HydrophobicContact CG1-CG 3.54Å; V36-R38 PolarHBondContact O-N 2.83Å; V36-R38 VanDerWaalsContact O-N 3.12Å
37A46Very low49.1Very low93 Ų93116.5 Ų116.577%0.76967%0.668SS**  trans-76.484.9151.900000109.4E35 I39E35-A37 PolarHBondContact O-N 3.49Å; A37-I39 PolarHBondContact O-N 3.18Å
38R42.9Very low48.2Very low220 Ų220120.3 Ų120.383%0.8369%0.686SS**  trans-82.291.4166.6-104.8176.9163.7114.6-0.5108.5V36 G40V36-R38 VanDerWaalsContact C-N 3.33Å; V36-R38 HydrophobicContact CG1-CB 3.7Å; V36-R38 HydrophobicContact CG1-CG 3.54Å; V36-R38 PolarHBondContact O-N 2.83Å; V36-R38 VanDerWaalsContact O-N 3.12Å; R38-G40 PolarHBondContact O-N 2.96Å; R38-G40 VanDerWaalsContact O-N 3.1Å
39I46.6Very low47.4Very low149 Ų149119 Ų11976%0.76468%0.684SS**  trans-72.7103.4175.4-43160.8000106.9A37 S41A37-I39 PolarHBondContact O-N 3.18Å; I39-S41 PolarHBondContact O-N 3.09Å
40G42.8Very low46.5Very low72 Ų72123.8 Ų123.874%0.74272%0.717SS**  trans-64.9114.5173.200000109.9R38R38-G40 PolarHBondContact O-N 2.96Å; R38-G40 VanDerWaalsContact O-N 3.1Å
41S40.3Very low46.1Very low105 Ų105124.6 Ų124.673%0.73472%0.723SS**  trans-61.3130.9174.6-179.40000111I39I39-S41 PolarHBondContact O-N 3.09Å
42L49.5Very low45.5Very low173 Ų173127.7 Ų127.791%0.90674%0.739SS**  trans-123115.1145.7-156.380000107.4
43D44.2Very low44.8Very low125 Ų125129 Ų12967%0.66873%0.733SS**SBendtrans9381.4167.5-136.648.1000118.7S45D43-S45 PolarHBondContact O-N 2.86Å
44N47.3Very low44.4Very low146 Ų146126 Ų12678%0.78173%0.73SS**SBend54.825.6127.7-54.9-44.7000121.1
45S43.7Very low44.6Very low106 Ų106128.3 Ų128.374%0.74173%0.731SS**  trans-150.6101.6161.752.90000112.9D43 F47D43-S45 PolarHBondContact O-N 2.86Å; S45-F47 PolarHBondContact O-N 3.27Å; S45-F47 VanDerWaalsContact O-N 3.13Å
46S44.7Very low44.9Very low118 Ų118126.3 Ų126.383%0.82573%0.73SS**  trans-73.898.4171.6170.60000108.9
47F42Very low45Very low189 Ų189128.7 Ų128.783%0.82974%0.74SS**  trans-113.9101.7165.4-147-94.3000108.8S45 A49S45-F47 PolarHBondContact O-N 3.27Å; S45-F47 VanDerWaalsContact O-N 3.13Å; F47-A49 HydrophobicContact CD1-CB 4.28Å; F47-A49 PolarHBondContact O-N 3.12Å
48T45.9Very low45.2Very low130 Ų130132.1 Ų132.180%0.79874%0.74SS**  trans-72.993174.3-54.80000108.7
49A42.3Very low45.5Very low56 Ų56128.6 Ų128.646%0.46374%0.737SS.*  trans-122.4129.716500000108.8F47 I51F47-A49 HydrophobicContact CD1-CB 4.28Å; F47-A49 PolarHBondContact O-N 3.12Å; A49-I51 HydrophobicContact CB-CG1 4.27Å; A49-I51 PolarHBondContact O-N 3.43Å
50C37.4Very low45.7Very low136 Ų136128.3 Ų128.392%0.91973%0.732SS**  trans-68.892.8174-61.50000108.9
51I49.1Very low46.2Very low134 Ų134127.8 Ų127.869%0.68772%0.715SS**  trans-104.7125.2173.4-50.9177.3000107.6A49 Y53A49-I51 HydrophobicContact CB-CG1 4.27Å; A49-I51 PolarHBondContact O-N 3.43Å; I51-Y53 PolarHBondContact O-N 2.86Å; I51-Y53 VanDerWaalsContact O-N 3.09Å
52P46.7Very low46.9Very low121 Ų121130.5 Ų130.579%0.78671%0.714SS**SBendtrans-70.5108.7170.229.7-28.4000107.4
53Y41.9Very low47.3Very low134 Ų134127.1 Ų127.153%0.52570%0.696SS.*  trans82.6115158.8-147-89.5000118I51 P61I51-Y53 PolarHBondContact O-N 2.86Å; I51-Y53 VanDerWaalsContact O-N 3.09Å; Y53-P61 WeakPolarHBondContact OH-CB 3.34Å; Y53-P61 WeakPolarHBondContact OH-CD 3.24Å; Y53-P61 WeakPolarHBondContact OH-CG 3.26Å
54P42.3Very low47.9Very low102 Ų102126 Ų12666%0.66269%0.686SS**  trans-93.3145.8160.332.7-25.2000112.4T56P54-T56 PolarHBondContact O-N 2.86Å
55Q53.9Low48.6Very low137 Ų137122.9 Ų122.964%0.6468%0.676SS**  trans-103.156.2-156.5-132.8-64.878.300111.8
56T48.8Very low49.5Very low117 Ų117121.8 Ų121.872%0.71866%0.664SS**  trans-14567.9-179.460.40000111.6P54P54-T56 PolarHBondContact O-N 2.86Å
57D46.5Very low50.6Low140 Ų140119 Ų11975%0.74964%0.64SS**  trans173.4102.8144.6-87.6-29.7000108.7L59D57-L59 PolarHBondContact O-N 3.28Å
58E49.7Very low52Low165 Ų165113.3 Ų113.377%0.77162%0.617SS**THydrogen-bonded Turntrans-65.68.7-164.3-66.2-101.3132.800115.8
59L49.7Very low53.1Low146 Ų146113.3 Ų113.376%0.76461%0.607SS**THydrogen-bonded Turntrans-115.9-4.6-171.3-103150.2000115.3D57D57-L59 PolarHBondContact O-N 3.28Å
60H51.3Low54.4Low143 Ų143114.8 Ų114.866%0.66261%0.606SS**SBendtrans-100-26.8-175.2-128.2-114.1000117.8K62H60-K62 VanDerWaalsContact C-N 3.34Å; H60-K62 PolarHBondContact O-N 3.28Å
61P52.8Low56.1Low60 Ų60109.4 Ų109.439%0.3957%0.569SS.*Hα-helixtrans-77.7-16.8-177.926-28.3000113.9Y53Y53-P61 WeakPolarHBondContact OH-CB 3.34Å; Y53-P61 WeakPolarHBondContact OH-CD 3.24Å; Y53-P61 WeakPolarHBondContact OH-CG 3.26Å
62K54.9Low56.9Low163 Ų163109.9 Ų109.971%0.70956%0.563SS**Hα-helixtrans-76.2-34.2-179-168151.4-176.1165.80112.8H60 H64 V66H60-K62 VanDerWaalsContact C-N 3.34Å; H60-K62 PolarHBondContact O-N 3.28Å; K62-H64 VanDerWaalsContact C-N 3.33Å; K62-V66 HydrophobicContact CG-CG2 4.36Å; K62-V66 WeakPolarHBondContact O-CB 3.35Å; K62-V66 WeakPolarHBondContact O-CG2 3.21Å; K62-V66 PolarHBondContact O-N 3.42Å
63I57.3Low58Low102 Ų102109.2 Ų109.252%0.52355%0.548SS..Hα-helixtrans-67.9-38.4179.9-63.9162.5000110V66 L67I63-V66 PolarHBondContact O-N 2.83Å; I63-L67 WeakPolarHBondContact O-CB 3.34Å; I63-L67 PolarHBondContact O-N 2.88Å
64H57.5Low59.4Low102 Ų102106.4 Ų106.447%0.47254%0.542SS..Hα-helixtrans-62.3-51176.8-173-103.3000112.4K62 V66 L67 I68K62-H64 VanDerWaalsContact C-N 3.33Å; H64-V66 PolarHBondContact O-N 3.07Å; H64-L67 PolarHBondContact O-N 2.73Å; H64-I68 WeakPolarHBondContact CE1-CD1 3.15Å; H64-I68 WeakPolarHBondContact O-CB 3.45Å; H64-I68 WeakPolarHBondContact O-CG1 3.29Å; H64-I68 PolarHBondContact O-N 3.18Å
65S62.1Low60.8Low80 Ų80103.6 Ų103.656%0.55952%0.521SS*.Hα-helixtrans-64.8-39178.4-65.70000112.5F69S65-F69 WeakPolarHBondContact O-CB 3.34Å; S65-F69 PolarHBondContact O-N 3.32Å
66V63Low61.8Low82 Ų8299.8 Ų99.850%0.49751%0.508SS..Hα-helixtrans-68.1-38.1177.4171.60000111K62 I63 H64 L70K62-V66 HydrophobicContact CG-CG2 4.36Å; K62-V66 WeakPolarHBondContact O-CB 3.35Å; K62-V66 WeakPolarHBondContact O-CG2 3.21Å; K62-V66 PolarHBondContact O-N 3.42Å; I63-V66 PolarHBondContact O-N 2.83Å; H64-V66 PolarHBondContact O-N 3.07Å; V66-L70 WeakPolarHBondContact O-CB 3.4Å; V66-L70 PolarHBondContact O-N 3.35Å
67L67.4Low63.1Low61 Ų6197.8 Ų97.832%0.31949%0.493SS..Hα-helixtrans-73.7-42.5-179-178.3139.5000112.1P29 I63 H64 F69 L70 V71P29-L67 HydrophobicContact CB-CD1 4.31Å; P29-L67 HydrophobicContact CB-CD2 3.26Å; P29-L67 HydrophobicContact CB-CG 4.37Å; P29-L67 HydrophobicContact CG-CD2 3.92Å; I63-L67 WeakPolarHBondContact O-CB 3.34Å; I63-L67 PolarHBondContact O-N 2.88Å; H64-L67 PolarHBondContact O-N 2.73Å; L67-F69 VanDerWaalsContact C-N 3.33Å; L67-L70 WeakPolarHBondContact O-CB 3.23Å; L67-L70 PolarHBondContact O-N 3.25Å; L67-V71 WeakPolarHBondContact O-CG2 3.26Å; L67-V71 PolarHBondContact O-N 2.88Å
68I71.5Confident64.4Low69 Ų6995.1 Ų95.135%0.35448%0.481SS..Hα-helixtrans-60.3-47.1171-74.7175.6000109.7H64 L70 V71 Y72H64-I68 WeakPolarHBondContact CE1-CD1 3.15Å; H64-I68 WeakPolarHBondContact O-CB 3.45Å; H64-I68 WeakPolarHBondContact O-CG1 3.29Å; H64-I68 PolarHBondContact O-N 3.18Å; I68-L70 VanDerWaalsContact C-N 3.29Å; I68-L70 PolarHBondContact O-N 3.5Å; I68-V71 PolarHBondContact O-N 2.97Å; I68-Y72 HydrophobicContact CG2-CD2 3.58Å; I68-Y72 HydrophobicContact CG2-CE2 3.82Å; I68-Y72 WeakPolarHBondContact O-CB 3.38Å; I68-Y72 VanDerWaalsContact O-CD2 3.26Å; I68-Y72 WeakPolarHBondContact O-CD2 3.23Å; I68-Y72 PolarHBondContact O-N 2.98Å
69F69.1Low65.7Low130 Ų13089.5 Ų89.557%0.5746%0.456SS*.Hα-helixtrans-57.2-44.8175-178.7-97.2000111.3S65 L67 V71 F73S65-F69 WeakPolarHBondContact O-CB 3.34Å; S65-F69 PolarHBondContact O-N 3.32Å; L67-F69 VanDerWaalsContact C-N 3.33Å; F69-V71 PolarHBondContact O-N 3.38Å; F69-F73 HydrophobicContact CD1-CB 4.47Å; F69-F73 HydrophobicContact CE1-CB 4.3Å; F69-F73 HydrophobicContact CE1-CD1 4.38Å; F69-F73 HydrophobicContact CE1-CG 4.22Å; F69-F73 HydrophobicContact CZ-CB 4.44Å; F69-F73 HydrophobicContact CZ-CD2 4.19Å; F69-F73 HydrophobicContact CZ-CG 4.21Å; F69-F73 WeakPolarHBondContact O-CA 3.42Å; F69-F73 WeakPolarHBondContact O-CB 3.04Å; F69-F73 PolarHBondContact O-N 3.11Å
70L70.5Confident67.2Low86 Ų8687.5 Ų87.545%0.4545%0.445SS..Hα-helixtrans-61.1-44.7178.7-165.285.6000111.4V66 L67 I68 L74V66-L70 WeakPolarHBondContact O-CB 3.4Å; V66-L70 PolarHBondContact O-N 3.35Å; L67-L70 WeakPolarHBondContact O-CB 3.23Å; L67-L70 PolarHBondContact O-N 3.25Å; I68-L70 VanDerWaalsContact C-N 3.29Å; I68-L70 PolarHBondContact O-N 3.5Å; L70-L74 HydrophobicContact CD1-CD1 3.84Å; L70-L74 HydrophobicContact CD1-CG 4.17Å; L70-L74 HydrophobicContact CD2-CD1 3.99Å; L70-L74 HydrophobicContact CG-CD1 3.53Å; L70-L74 HydrophobicContact CG-CG 4Å; L70-L74 WeakPolarHBondContact O-CA 2.9Å; L70-L74 WeakPolarHBondContact O-CB 3.44Å; L70-L74 WeakPolarHBondContact O-CG 3.33Å; L70-L74 PolarHBondContact O-N 3.34Å
71V71.6Confident68.4Low23 Ų2384.3 Ų84.314%0.13944%0.438CS..Hα-helixtrans-67.4-50.8179.7172.80000110.8L26 L67 I68 F69 F73 I75L26-V71 HydrophobicContact CD2-CG1 3.69Å; L26-V71 HydrophobicContact CG-CG1 4.22Å; L67-V71 WeakPolarHBondContact O-CG2 3.26Å; L67-V71 PolarHBondContact O-N 2.88Å; I68-V71 PolarHBondContact O-N 2.97Å; F69-V71 PolarHBondContact O-N 3.38Å; V71-F73 VanDerWaalsContact C-N 3.25Å; V71-F73 PolarHBondContact O-N 3.49Å; V71-I75 HydrophobicContact CG1-CD1 3.58Å; V71-I75 HydrophobicContact CG1-CG1 4.47Å; V71-I75 VanDerWaalsContact O-CB 3.28Å; V71-I75 WeakPolarHBondContact O-CB 3.31Å; V71-I75 WeakPolarHBondContact O-CD1 3.28Å; V71-I75 WeakPolarHBondContact O-CG1 3.15Å; V71-I75 PolarHBondContact O-N 2.83Å
72Y67.4Low69.4Low144 Ų14484.3 Ų84.357%0.56544%0.435SS*.Hα-helixtrans-72.2-15.4179.6-76-76.8000113.7I68 P76 A138I68-Y72 HydrophobicContact CG2-CD2 3.58Å; I68-Y72 HydrophobicContact CG2-CE2 3.82Å; I68-Y72 WeakPolarHBondContact O-CB 3.38Å; I68-Y72 VanDerWaalsContact O-CD2 3.26Å; I68-Y72 WeakPolarHBondContact O-CD2 3.23Å; I68-Y72 PolarHBondContact O-N 2.98Å; Y72-P76 WeakPolarHBondContact O-CD 3.36Å; Y72-P76 WeakPolarHBondContact O-CG 3.46Å; Y72-A138 WeakPolarHBondContact OH-CB 3.46Å
73F68.3Low70.4Confident107 Ų10780.2 Ų80.247%0.46942%0.415SS..Hα-helixtrans-96-44.1176-174.1-108.5000112.1F69 V71 L77F69-F73 HydrophobicContact CD1-CB 4.47Å; F69-F73 HydrophobicContact CE1-CB 4.3Å; F69-F73 HydrophobicContact CE1-CD1 4.38Å; F69-F73 HydrophobicContact CE1-CG 4.22Å; F69-F73 HydrophobicContact CZ-CB 4.44Å; F69-F73 HydrophobicContact CZ-CD2 4.19Å; F69-F73 HydrophobicContact CZ-CG 4.21Å; F69-F73 WeakPolarHBondContact O-CA 3.42Å; F69-F73 WeakPolarHBondContact O-CB 3.04Å; F69-F73 PolarHBondContact O-N 3.11Å; V71-F73 VanDerWaalsContact C-N 3.25Å; V71-F73 PolarHBondContact O-N 3.49Å; F73-L77 HydrophobicContact CD1-CD1 3.6Å; F73-L77 HydrophobicContact CE1-CD1 3.21Å; F73-L77 HydrophobicContact CE1-CG 4.47Å; F73-L77 HydrophobicContact CE2-CD1 4.33Å; F73-L77 HydrophobicContact CG-CD1 4.31Å; F73-L77 HydrophobicContact CZ-CD1 3.63Å; F73-L77 WeakPolarHBondContact O-CB 3.23Å; F73-L77 PolarHBondContact O-N 3.39Å; F73-L77 VanDerWaalsContact O-N 3.13Å
74L70.8Confident71.4Confident76 Ų7683.2 Ų83.240%0.39842%0.421SS..Hα-helixtrans-70-38.5179.7-69-175.7000112.2L70 L77 V78L70-L74 HydrophobicContact CD1-CD1 3.84Å; L70-L74 HydrophobicContact CD1-CG 4.17Å; L70-L74 HydrophobicContact CD2-CD1 3.99Å; L70-L74 HydrophobicContact CG-CD1 3.53Å; L70-L74 HydrophobicContact CG-CG 4Å; L70-L74 WeakPolarHBondContact O-CA 2.9Å; L70-L74 WeakPolarHBondContact O-CB 3.44Å; L70-L74 WeakPolarHBondContact O-CG 3.33Å; L70-L74 PolarHBondContact O-N 3.34Å; L74-L77 PolarHBondContact O-N 3.24Å; L74-V78 VanDerWaalsContact O-CG2 3.28Å; L74-V78 WeakPolarHBondContact O-CG2 3.42Å; L74-V78 PolarHBondContact O-N 2.96Å
75I73.2Confident72.4Confident43 Ų4385.1 Ų85.122%0.22143%0.425CS..Hα-helixtrans-60.4-53.6179-69.9171.7000110.9L26 V71 L77 V78 I79L26-I75 HydrophobicContact CD1-CD1 3.89Å; L26-I75 HydrophobicContact CD2-CD1 4.32Å; V71-I75 HydrophobicContact CG1-CD1 3.58Å; V71-I75 HydrophobicContact CG1-CG1 4.47Å; V71-I75 VanDerWaalsContact O-CB 3.28Å; V71-I75 WeakPolarHBondContact O-CB 3.31Å; V71-I75 WeakPolarHBondContact O-CD1 3.28Å; V71-I75 WeakPolarHBondContact O-CG1 3.15Å; V71-I75 PolarHBondContact O-N 2.83Å; I75-L77 VanDerWaalsContact C-N 3.32Å; I75-L77 PolarHBondContact O-N 2.82Å; I75-V78 PolarHBondContact O-N 2.89Å; I75-I79 HydrophobicContact CG2-CD1 3.93Å; I75-I79 VanDerWaalsContact O-CG1 3.31Å; I75-I79 WeakPolarHBondContact O-CG1 3.17Å; I75-I79 PolarHBondContact O-N 2.8Å; I75-I79 VanDerWaalsContact O-N 3.12Å
76P74Confident72.9Confident56 Ų5685 Ų8536%0.36442%0.415SS..Hα-helixtrans-59.3-39.7173.8-27.938.3000113.4Y72 V78 I79 I80Y72-P76 WeakPolarHBondContact O-CD 3.36Å; Y72-P76 WeakPolarHBondContact O-CG 3.46Å; P76-V78 PolarHBondContact O-N 2.99Å; P76-I79 PolarHBondContact O-N 3.09Å; P76-I80 WeakPolarHBondContact O-CB 3.42Å; P76-I80 WeakPolarHBondContact O-CD1 3.49Å; P76-I80 WeakPolarHBondContact O-CG1 3.2Å; P76-I80 PolarHBondContact O-N 3.29Å
77L76.3Confident73.7Confident76 Ų7685.3 Ų85.340%0.39841%0.414SS..Hα-helixtrans-60.2-44.3178.3-103.4166.4000112.7F73 L74 I75 I80 S81F73-L77 HydrophobicContact CD1-CD1 3.6Å; F73-L77 HydrophobicContact CE1-CD1 3.21Å; F73-L77 HydrophobicContact CE1-CG 4.47Å; F73-L77 HydrophobicContact CE2-CD1 4.33Å; F73-L77 HydrophobicContact CG-CD1 4.31Å; F73-L77 HydrophobicContact CZ-CD1 3.63Å; F73-L77 WeakPolarHBondContact O-CB 3.23Å; F73-L77 PolarHBondContact O-N 3.39Å; F73-L77 VanDerWaalsContact O-N 3.13Å; L74-L77 PolarHBondContact O-N 3.24Å; I75-L77 VanDerWaalsContact C-N 3.32Å; I75-L77 PolarHBondContact O-N 2.82Å; L77-I80 PolarHBondContact O-N 3.07Å; L77-S81 VanDerWaalsContact O-CB 3.26Å; L77-S81 WeakPolarHBondContact O-CB 3.29Å; L77-S81 PolarHBondContact O-N 3.42Å
78V74.1Confident74.3Confident84 Ų8484.1 Ų84.151%0.50941%0.412SS..Hα-helixtrans-65.3-41.8178.3171.30000110.5L74 I75 P76 S81 I82L74-V78 VanDerWaalsContact O-CG2 3.28Å; L74-V78 WeakPolarHBondContact O-CG2 3.42Å; L74-V78 PolarHBondContact O-N 2.96Å; I75-V78 PolarHBondContact O-N 2.89Å; P76-V78 PolarHBondContact O-N 2.99Å; V78-S81 PolarHBondContact O-N 2.89Å; V78-I82 HydrophobicContact CG1-CD1 3.96Å; V78-I82 VanDerWaalsContact O-CG1 3.31Å; V78-I82 WeakPolarHBondContact O-CG1 3.32Å; V78-I82 PolarHBondContact O-N 2.75Å; V78-I82 VanDerWaalsContact O-N 3.07Å
79I76.4Confident74.3Confident47 Ų4786.5 Ų86.524%0.24142%0.42CS..Hα-helixtrans-61-50.3176.1-67.6169.1000110.6I75 P76 S81 I82 Y83I75-I79 HydrophobicContact CG2-CD1 3.93Å; I75-I79 VanDerWaalsContact O-CG1 3.31Å; I75-I79 WeakPolarHBondContact O-CG1 3.17Å; I75-I79 PolarHBondContact O-N 2.8Å; I75-I79 VanDerWaalsContact O-N 3.12Å; P76-I79 PolarHBondContact O-N 3.09Å; I79-S81 VanDerWaalsContact C-N 3.33Å; I79-S81 PolarHBondContact O-N 3.36Å; I79-I82 PolarHBondContact O-N 3.43Å; I79-Y83 HydrophobicContact CG2-CD2 3.63Å; I79-Y83 HydrophobicContact CG2-CE2 3.3Å; I79-Y83 WeakPolarHBondContact O-CD2 3.33Å; I79-Y83 PolarHBondContact O-N 2.98Å; I79-Y83 VanDerWaalsContact O-N 3.09Å
80I81.9Confident74.4Confident103 Ų10383.4 Ų83.453%0.52841%0.412SS..Hα-helixtrans-60.5-43.6179.2-67.1163.2000110.6P76 L77 I82 Y83 Y84P76-I80 WeakPolarHBondContact O-CB 3.42Å; P76-I80 WeakPolarHBondContact O-CD1 3.49Å; P76-I80 WeakPolarHBondContact O-CG1 3.2Å; P76-I80 PolarHBondContact O-N 3.29Å; L77-I80 PolarHBondContact O-N 3.07Å; I80-I82 PolarHBondContact O-N 3.48Å; I80-Y83 PolarHBondContact O-N 2.9Å; I80-Y84 WeakPolarHBondContact O-CB 3.14Å; I80-Y84 PolarHBondContact O-N 3.38Å
81S75.4Confident74.8Confident76 Ų7684.7 Ų84.753%0.53142%0.419SS..Hα-helixtrans-60.7-45.5179.5-176.10000112.4L77 V78 I79 Y83 Y84 Y85L77-S81 VanDerWaalsContact O-CB 3.26Å; L77-S81 WeakPolarHBondContact O-CB 3.29Å; L77-S81 PolarHBondContact O-N 3.42Å; V78-S81 PolarHBondContact O-N 2.89Å; I79-S81 VanDerWaalsContact C-N 3.33Å; I79-S81 PolarHBondContact O-N 3.36Å; S81-Y83 PolarHBondContact O-N 3.41Å; S81-Y84 PolarHBondContact O-N 2.87Å; S81-Y85 WeakPolarHBondContact O-CB 3.33Å; S81-Y85 PolarHBondContact O-N 3.49Å
82I75.6Confident75.1Confident60 Ų6089.3 Ų89.331%0.30844%0.441SS..Hα-helixtrans-63.5-43.5177.6-67.5167000110.8V78 I79 I80 Y85 H86V78-I82 HydrophobicContact CG1-CD1 3.96Å; V78-I82 VanDerWaalsContact O-CG1 3.31Å; V78-I82 WeakPolarHBondContact O-CG1 3.32Å; V78-I82 PolarHBondContact O-N 2.75Å; V78-I82 VanDerWaalsContact O-N 3.07Å; I79-I82 PolarHBondContact O-N 3.43Å; I80-I82 PolarHBondContact O-N 3.48Å; I82-Y85 PolarHBondContact O-N 3.3Å; I82-H86 PolarHBondContact O-CD2 3.19Å; I82-H86 PolarHBondContact O-N 2.88Å; I82-H86 VanDerWaalsContact O-N 3.09Å
83Y75.3Confident75.2Confident77 Ų7789.5 Ų89.530%0.30245%0.445SS..Hα-helixtrans-61.8-48176.7-77.3-51.1000111.8I79 I80 S81 Y85 H86 I87 F124I79-Y83 HydrophobicContact CG2-CD2 3.63Å; I79-Y83 HydrophobicContact CG2-CE2 3.3Å; I79-Y83 WeakPolarHBondContact O-CD2 3.33Å; I79-Y83 PolarHBondContact O-N 2.98Å; I79-Y83 VanDerWaalsContact O-N 3.09Å; I80-Y83 PolarHBondContact O-N 2.9Å; S81-Y83 PolarHBondContact O-N 3.41Å; Y83-Y85 VanDerWaalsContact C-N 3.32Å; Y83-Y85 PolarHBondContact O-N 3.48Å; Y83-H86 PolarHBondContact O-N 3.39Å; Y83-I87 VanDerWaalsContact O-CG1 3.23Å; Y83-I87 WeakPolarHBondContact O-CG1 3.31Å; Y83-I87 PolarHBondContact O-N 3.23Å; Y83-F124 AromaticContact CE1-CD2 3.46Å; Y83-F124 HydrophobicContact CE1-CD2 3.46Å; Y83-F124 VanDerWaalsContact CE1-CD2 3.46Å; Y83-F124 HydrophobicContact CE1-CE2 4.05Å; Y83-F124 HydrophobicContact CE1-CG 4.44Å; Y83-F124 AromaticContact CZ-CD2 3.59Å; Y83-F124 AromaticContact CZ-CE2 3.91Å; Y83-F124 WeakPolarHBondContact OH-CD2 3.24Å
84Y77.9Confident75Confident166 Ų16687.1 Ų87.165%0.65144%0.442SS*.Hα-helixtrans-65.1-37.2-178.5-153.9-94.5000112.1I80 S81 I87 A88I80-Y84 WeakPolarHBondContact O-CB 3.14Å; I80-Y84 PolarHBondContact O-N 3.38Å; S81-Y84 PolarHBondContact O-N 2.87Å; Y84-I87 PolarHBondContact O-N 2.87Å; Y84-A88 VanDerWaalsContact O-CB 3.23Å; Y84-A88 WeakPolarHBondContact O-CB 2.97Å; Y84-A88 PolarHBondContact O-N 3.35Å
85Y78.6Confident74.8Confident141 Ų14186.5 Ų86.555%0.55345%0.448SS*.Hα-helixtrans-60.9-45172.7176.9-96.9000112.1S81 I82 Y83 A88 K89S81-Y85 WeakPolarHBondContact O-CB 3.33Å; S81-Y85 PolarHBondContact O-N 3.49Å; I82-Y85 PolarHBondContact O-N 3.3Å; Y83-Y85 VanDerWaalsContact C-N 3.32Å; Y83-Y85 PolarHBondContact O-N 3.48Å; Y85-A88 PolarHBondContact O-N 3.43Å; Y85-K89 HydrophobicContact CE1-CD 4.07Å; Y85-K89 WeakPolarHBondContact O-CB 3.15Å; Y85-K89 PolarHBondContact O-N 3.45Å
86H71.7Confident74.3Confident77 Ų7792.2 Ų92.236%0.35647%0.473SS..Hα-helixtrans-64.3-42.7176.8-94.6-96.2000112.6W11 I82 Y83 T90W11-H86 AromaticContact CH2-NE2 3.32Å; W11-H86 VanDerWaalsContact CH2-NE2 3.32Å; W11-H86 WeakPolarHBondContact CH2-NE2 3.2Å; W11-H86 AromaticContact CZ2-NE2 3.66Å; I82-H86 PolarHBondContact O-CD2 3.19Å; I82-H86 PolarHBondContact O-N 2.88Å; I82-H86 VanDerWaalsContact O-N 3.09Å; Y83-H86 PolarHBondContact O-N 3.39Å; H86-T90 WeakPolarHBondContact O-CB 3.48Å; H86-T90 PolarHBondContact O-N 2.91Å; H86-T90 PolarHBondContact O-OG1 3.02Å
87I81.4Confident73.4Confident90 Ų9095.1 Ų95.146%0.46249%0.485SS..Hα-helixtrans-59.7-55175.7-68.6164.5000109Y83 Y84 K89 T90 L91Y83-I87 VanDerWaalsContact O-CG1 3.23Å; Y83-I87 WeakPolarHBondContact O-CG1 3.31Å; Y83-I87 PolarHBondContact O-N 3.23Å; Y84-I87 PolarHBondContact O-N 2.87Å; I87-K89 VanDerWaalsContact C-N 3.35Å; I87-K89 PolarHBondContact O-N 3.11Å; I87-T90 PolarHBondContact O-N 3.37Å; I87-T90 VanDerWaalsContact O-N 3.12Å; I87-L91 HydrophobicContact CG2-CD1 3.42Å; I87-L91 VanDerWaalsContact CG2-CD1 3.42Å; I87-L91 WeakPolarHBondContact O-CD1 3.28Å; I87-L91 PolarHBondContact O-N 3.04Å
88A79Confident72.4Confident35 Ų3597.1 Ų97.129%0.28950%0.496SS..Hα-helixtrans-57.8-44.7179.800000112.3Y84 Y85 T90 L91 I92Y84-A88 VanDerWaalsContact O-CB 3.23Å; Y84-A88 WeakPolarHBondContact O-CB 2.97Å; Y84-A88 PolarHBondContact O-N 3.35Å; Y85-A88 PolarHBondContact O-N 3.43Å; A88-T90 VanDerWaalsContact C-N 3.33Å; A88-T90 PolarHBondContact O-N 2.86Å; A88-L91 WeakPolarHBondContact O-CB 3.48Å; A88-L91 PolarHBondContact O-N 3.39Å; A88-I92 VanDerWaalsContact O-CG1 3.26Å; A88-I92 WeakPolarHBondContact O-CG1 3.44Å; A88-I92 PolarHBondContact O-N 3.05Å
89K71.1Confident71.1Confident119 Ų11998.5 Ų98.552%0.51751%0.507SS..Hα-helixtrans-62.7-39.8177.3-174.1177-178.9174.30112.3Y85 I87 K93Y85-K89 HydrophobicContact CE1-CD 4.07Å; Y85-K89 WeakPolarHBondContact O-CB 3.15Å; Y85-K89 PolarHBondContact O-N 3.45Å; I87-K89 VanDerWaalsContact C-N 3.35Å; I87-K89 PolarHBondContact O-N 3.11Å; K89-K93 VanDerWaalsContact O-CB 3.23Å; K89-K93 WeakPolarHBondContact O-CB 3.21Å; K89-K93 PolarHBondContact O-N 3.4Å
90T72.2Confident70Confident65 Ų65100.4 Ų100.440%0.39954%0.538SS..Hα-helixtrans-67.5-41.9176.6-56.70000110.9H86 I87 A88 S94 Y116H86-T90 WeakPolarHBondContact O-CB 3.48Å; H86-T90 PolarHBondContact O-N 2.91Å; H86-T90 PolarHBondContact O-OG1 3.02Å; I87-T90 PolarHBondContact O-N 3.37Å; I87-T90 VanDerWaalsContact O-N 3.12Å; A88-T90 VanDerWaalsContact C-N 3.33Å; A88-T90 PolarHBondContact O-N 2.86Å; T90-S94 WeakPolarHBondContact O-CB 3.07Å; T90-S94 PolarHBondContact O-N 3.46Å; T90-Y116 HydrophobicContact CG2-CE2 4.4Å
91L78.9Confident68.2Low113 Ų113101.5 Ų101.559%0.59254%0.541SS*.Hα-helixtrans-61.1-50.1174.7-95.4123.9000112.3I87 A88 K93 S94 A95I87-L91 HydrophobicContact CG2-CD1 3.42Å; I87-L91 VanDerWaalsContact CG2-CD1 3.42Å; I87-L91 WeakPolarHBondContact O-CD1 3.28Å; I87-L91 PolarHBondContact O-N 3.04Å; A88-L91 WeakPolarHBondContact O-CB 3.48Å; A88-L91 PolarHBondContact O-N 3.39Å; L91-K93 PolarHBondContact O-N 3.45Å; L91-S94 PolarHBondContact O-N 3.34Å; L91-A95 WeakPolarHBondContact O-CB 3.18Å; L91-A95 PolarHBondContact O-N 3.12Å
92I77.8Confident67.1Low120 Ų120107.9 Ų107.962%0.61555%0.554SS**Hα-helixtrans-63.4-43.6179.7-66.5163.4000110.6A88 S94 A95 H96A88-I92 VanDerWaalsContact O-CG1 3.26Å; A88-I92 WeakPolarHBondContact O-CG1 3.44Å; A88-I92 PolarHBondContact O-N 3.05Å; I92-S94 VanDerWaalsContact C-N 3.35Å; I92-S94 PolarHBondContact O-N 2.85Å; I92-A95 PolarHBondContact O-N 3.27Å; I92-H96 PolarHBondContact O-N 3.27Å
93K68.9Low65.6Low149 Ų149108.5 Ų108.565%0.64856%0.558SS**Hα-helixtrans-63.9-40.3177.7-171.7176.2-179.1-179.30111.5K89 L91 N97K89-K93 VanDerWaalsContact O-CB 3.23Å; K89-K93 WeakPolarHBondContact O-CB 3.21Å; K89-K93 PolarHBondContact O-N 3.4Å; L91-K93 PolarHBondContact O-N 3.45Å; K93-N97 PolarHBondContact O-N 2.91Å; K93-N97 PolarHBondContact O-ND2 3.39Å
94S63.9Low64.6Low57 Ų57113.7 Ų113.740%0.39959%0.585SS.*Hα-helixtrans-64.5-48.6174.9-171.30000111T90 L91 I92 H96 N97 L98T90-S94 WeakPolarHBondContact O-CB 3.07Å; T90-S94 PolarHBondContact O-N 3.46Å; L91-S94 PolarHBondContact O-N 3.34Å; I92-S94 VanDerWaalsContact C-N 3.35Å; I92-S94 PolarHBondContact O-N 2.85Å; S94-H96 VanDerWaalsContact C-N 3.3Å; S94-H96 PolarHBondContact O-N 2.87Å; S94-N97 CarbonylContact O-C 3.38Å; S94-N97 WeakPolarHBondContact O-CA 3.35Å; S94-N97 PolarHBondContact O-N 3.33Å; S94-L98 WeakPolarHBondContact O-CD1 3.43Å; S94-L98 PolarHBondContact O-N 3.07Å
95A67.1Low63.2Low63 Ų63114.2 Ų114.252%0.52159%0.594SS.*Hα-helixtrans-58-38.418000000113.3L91 I92 N97 L98L91-A95 WeakPolarHBondContact O-CB 3.18Å; L91-A95 PolarHBondContact O-N 3.12Å; I92-A95 PolarHBondContact O-N 3.27Å; A95-N97 VanDerWaalsContact C-N 3.3Å; A95-N97 PolarHBondContact O-N 3.35Å; A95-L98 PolarHBondContact O-N 2.8Å
96H62Low61.8Low163 Ų163111.4 Ų111.476%0.75559%0.591SS**Hα-helixtrans-75.1-18.3175.4-164.1-68.2000113.2I92 S94I92-H96 PolarHBondContact O-N 3.27Å; S94-H96 VanDerWaalsContact C-N 3.3Å; S94-H96 PolarHBondContact O-N 2.87Å
97N55.6Low60.8Low116 Ų116116.1 Ų116.162%0.6261%0.611SS**THydrogen-bonded Turntrans-94.93.2172.8-76.9-85.7000112.7K93 S94 A95 P99K93-N97 PolarHBondContact O-N 2.91Å; K93-N97 PolarHBondContact O-ND2 3.39Å; S94-N97 CarbonylContact O-C 3.38Å; S94-N97 WeakPolarHBondContact O-CA 3.35Å; S94-N97 PolarHBondContact O-N 3.33Å; A95-N97 VanDerWaalsContact C-N 3.3Å; A95-N97 PolarHBondContact O-N 3.35Å; N97-P99 WeakPolarHBondContact O-CD 3.44Å
98L55.1Low59.3Low118 Ų118121.1 Ų121.162%0.61863%0.629SS**SBendtrans-74.2111.3158.4-83.1102.5000106.6S94 A95 G100S94-L98 WeakPolarHBondContact O-CD1 3.43Å; S94-L98 PolarHBondContact O-N 3.07Å; A95-L98 PolarHBondContact O-N 2.8Å; L98-G100 PolarHBondContact O-N 2.91Å
99P48.1Very low57.9Low114 Ų114126.9 Ų126.974%0.7465%0.65SS**  trans-58.4113.5166.225.6-30.9000106.1N97 E101N97-P99 WeakPolarHBondContact O-CD 3.44Å; P99-E101 PolarHBondContact O-N 3.27Å
100G51.7Low56.9Low86 Ų86127.8 Ų127.889%0.88766%0.659SS**  trans-66.372.3169.700000109L98L98-G100 PolarHBondContact O-N 2.91Å
101E45.9Very low56Low126 Ų126130.8 Ų130.859%0.58968%0.677SS**  trans-111.2101.6167.4-164.5-177.594.800106.1P99 N103P99-E101 PolarHBondContact O-N 3.27Å; E101-N103 HydrophobicContact CG-CB 3.93Å; E101-N103 WeakPolarHBondContact CG-ND2 3.43Å; E101-N103 PolarHBondContact O-N 2.87Å; E101-N103 WeakPolarHBondContact OE1-CB 3.47Å; E101-N103 PolarHBondContact OE1-ND2 3.13Å
102Y50.9Low54.4Low210 Ų210132.5 Ų132.582%0.82468%0.682SS**  trans-66.328.5175.170.9-82.5000112.5E104Y102-E104 PolarHBondContact O-N 3.44Å
103N45.3Very low53Low73 Ų73131.8 Ų131.839%0.3968%0.684SS.*  trans-79.5112.9-176.4-77.5-16.7000110.3E101 H105 T106E101-N103 HydrophobicContact CG-CB 3.93Å; E101-N103 WeakPolarHBondContact CG-ND2 3.43Å; E101-N103 PolarHBondContact O-N 2.87Å; E101-N103 WeakPolarHBondContact OE1-CB 3.47Å; E101-N103 PolarHBondContact OE1-ND2 3.13Å; N103-H105 PolarHBondContact O-N 3.45Å; N103-T106 PolarHBondContact O-N 2.88Å
104E54Low52Low186 Ų186132.6 Ų132.687%0.86969%0.693SS**THydrogen-bonded Turntrans-53.7-6.2179.8-69.5176.2100.500114.9Y102Y102-E104 PolarHBondContact O-N 3.44Å
105H48.2Very low51Low178 Ų178139.1 Ų139.182%0.82471%0.714SS**THydrogen-bonded Turntrans-85.5-9.7179.7-85.5-88.4000115.6N103 K107N103-H105 PolarHBondContact O-N 3.45Å; H105-K107 VanDerWaalsContact C-N 3.3Å; H105-K107 PolarHBondContact O-N 3.11Å
106T49.9Very low50Low81 Ų81143.1 Ų143.150%0.49772%0.717SS.*G310 helixtrans-9021.3-174.7-49.70000113.8N103 K108 Q109N103-T106 PolarHBondContact O-N 2.88Å; T106-K108 PolarHBondContact O-N 3.23Å; T106-Q109 HydrophobicContact CG2-CB 4.3Å
107K49.1Very low49.1Very low177 Ų177144 Ų14477%0.7772%0.718SS**G310 helixtrans-66.8-16.4174.8-95.2-160.5177.1-162.70114.6H105H105-K107 VanDerWaalsContact C-N 3.3Å; H105-K107 PolarHBondContact O-N 3.11Å
108K50.5Low48.8Very low195 Ų195143.3 Ų143.385%0.84872%0.715SS**G310 helixtrans-93.9-12-173.6-61-172.7-177.8-177.40114.6T106T106-K108 PolarHBondContact O-N 3.23Å
109Q49.4Very low48.6Very low156 Ų156147.7 Ų147.773%0.72972%0.723SS**SBendtrans-104.1-4.1-174.1-129.6168.6-85.200114.5T106 V111 H112T106-Q109 HydrophobicContact CG2-CB 4.3Å; Q109-V111 PolarHBondContact O-N 3.38Å; Q109-H112 PolarHBondContact O-N 2.85Å
110I51Low48.7Very low137 Ų137146.2 Ų146.270%0.70371%0.713SS**THydrogen-bonded Turntrans-69.1-8174-12.1173.2000112.5
111V52.8Low48.9Very low128 Ų128144.1 Ų144.178%0.77669%0.692SS**THydrogen-bonded Turntrans-99.629.8175-165.50000111Q109Q109-V111 PolarHBondContact O-N 3.38Å
112H45.8Very low49.2Very low150 Ų150145.4 Ų145.469%0.69470%0.698SS**SBendtrans-100.7111.6156.8-142.3-76.1000106.9Q109 M114Q109-H112 PolarHBondContact O-N 2.85Å; H112-M114 PolarHBondContact O-N 3.24Å
113P48.1Very low49.2Very low104 Ų104136.6 Ų136.668%0.67567%0.666SS**  trans-57.7119.7-179.223.1-31.1000107.3K115P113-K115 VanDerWaalsContact C-N 3.3Å; P113-K115 PolarHBondContact O-N 2.97Å
114M48.1Very low49.7Very low167 Ų167137.6 Ų137.682%0.82367%0.668SS**  trans-54.6103.3166.6-78.1-157.3-82.800106.1H112 Y116H112-M114 PolarHBondContact O-N 3.24Å; M114-Y116 PolarHBondContact O-N 3.43Å
115K43.7Very low50Low193 Ų193131.3 Ų131.384%0.83965%0.647SS**  trans-69.277.5169.3-110.4-84.7-172.9177.50105.9P113 K117P113-K115 VanDerWaalsContact C-N 3.3Å; P113-K115 PolarHBondContact O-N 2.97Å; K115-K117 VanDerWaalsContact C-N 3.28Å; K115-K117 PolarHBondContact O-N 2.89Å
116Y45.7Very low50.4Low148 Ų148125.1 Ų125.158%0.5862%0.62SS**  trans-64.295.8168.4-177-122.4000106.6T90 M114 D118T90-Y116 HydrophobicContact CG2-CE2 4.4Å; M114-Y116 PolarHBondContact O-N 3.43Å; Y116-D118 HydrophobicContact CD1-CB 4.11Å; Y116-D118 HydrophobicContact CE1-CB 3.83Å; Y116-D118 WeakPolarHBondContact CE1-OD1 3.27Å; Y116-D118 WeakPolarHBondContact CE1-OD2 3.49Å; Y116-D118 PolarHBondContact O-N 3.34Å; Y116-D118 PolarHBondContact OH-OD1 2.84Å
117K42.9Very low50.8Low180 Ų180122.4 Ų122.478%0.78361%0.606SS**  trans-77.378.4169.2-173.4101.6177.8-175.50106K115 R119K115-K117 VanDerWaalsContact C-N 3.28Å; K115-K117 PolarHBondContact O-N 2.89Å; K117-R119 PolarHBondContact O-N 3.38Å
118D48.8Very low51.2Low103 Ų103117.6 Ų117.655%0.55159%0.586SS**  trans-58.292.4156.7-118.6-25.5000105.9Y116 P120Y116-D118 HydrophobicContact CD1-CB 4.11Å; Y116-D118 HydrophobicContact CE1-CB 3.83Å; Y116-D118 WeakPolarHBondContact CE1-OD1 3.27Å; Y116-D118 WeakPolarHBondContact CE1-OD2 3.49Å; Y116-D118 PolarHBondContact O-N 3.34Å; Y116-D118 PolarHBondContact OH-OD1 2.84Å; D118-P120 VanDerWaalsContact O-CD 3.29Å; D118-P120 WeakPolarHBondContact O-CD 3.42Å
119R51.7Low51.8Low209 Ų209117.2 Ų117.279%0.78958%0.579SS**  trans-81109.8157.8-150.6-144.3-64.1-121.28.1102.5K117 G121K117-R119 PolarHBondContact O-N 3.38Å; R119-G121 PolarHBondContact O-N 2.71Å
120P49.6Very low52.3Low83 Ų83112.1 Ų112.154%0.53956%0.556SS.*  trans-51.4113.9173.920.5-30.5000105.7D118 H122 F124D118-P120 VanDerWaalsContact O-CD 3.29Å; D118-P120 WeakPolarHBondContact O-CD 3.42Å; P120-H122 PolarHBondContact O-N 3.12Å; P120-F124 HydrophobicContact CB-CB 4.29Å; P120-F124 HydrophobicContact CB-CD1 4.29Å; P120-F124 HydrophobicContact CB-CG 4.46Å
121G55Low52.6Low42 Ų42109.5 Ų109.543%0.43354%0.543SS..  trans-55.1144.7-178.500000106.8R119 S123 F124R119-G121 PolarHBondContact O-N 2.71Å; G121-S123 CarbonylContact O-C 3.58Å; G121-S123 PolarHBondContact O-N 3.48Å; G121-F124 WeakPolarHBondContact O-CB 3.16Å; G121-F124 PolarHBondContact O-N 3.16Å
122H53.1Low53.4Low154 Ų154110.7 Ų110.771%0.71353%0.534SS*.Hα-helixtrans-46-27175.1-173.3-95.2000112.4P120 L126P120-H122 PolarHBondContact O-N 3.12Å; H122-L126 WeakPolarHBondContact O-CB 3.49Å; H122-L126 PolarHBondContact O-N 3.41Å
123S51.1Low54.2Low24 Ų24109.4 Ų109.417%0.16853%0.528CS..Hα-helixtrans-66.8-28.8172.6-161.10000116K15 G121 A127K15-S123 PolarHBondContact NZ-OG 3.48Å; G121-S123 CarbonylContact O-C 3.58Å; G121-S123 PolarHBondContact O-N 3.48Å; S123-A127 VanDerWaalsContact O-CB 3.23Å; S123-A127 WeakPolarHBondContact O-CB 3.26Å; S123-A127 PolarHBondContact O-N 2.89Å
124F56Low54.8Low95 Ų95107.3 Ų107.342%0.41751%0.509SS..Hα-helixtrans-72.8-49.4176.3-174.7-83.8000110.4Y83 P120 G121 L126 A127 E128Y83-F124 AromaticContact CE1-CD2 3.46Å; Y83-F124 HydrophobicContact CE1-CD2 3.46Å; Y83-F124 VanDerWaalsContact CE1-CD2 3.46Å; Y83-F124 HydrophobicContact CE1-CE2 4.05Å; Y83-F124 HydrophobicContact CE1-CG 4.44Å; Y83-F124 AromaticContact CZ-CD2 3.59Å; Y83-F124 AromaticContact CZ-CE2 3.91Å; Y83-F124 WeakPolarHBondContact OH-CD2 3.24Å; P120-F124 HydrophobicContact CB-CB 4.29Å; P120-F124 HydrophobicContact CB-CD1 4.29Å; P120-F124 HydrophobicContact CB-CG 4.46Å; G121-F124 WeakPolarHBondContact O-CB 3.16Å; G121-F124 PolarHBondContact O-N 3.16Å; F124-L126 VanDerWaalsContact C-N 3.26Å; F124-L126 PolarHBondContact O-N 3.02Å; F124-A127 PolarHBondContact O-N 2.88Å; F124-E128 WeakPolarHBondContact O-CB 3.12Å; F124-E128 PolarHBondContact O-N 3.48Å
125A60.1Low55.2Low54 Ų54104.8 Ų104.845%0.44650%0.498SS..Hα-helixtrans-62.9-35.1176.100000112R129A125-R129 WeakPolarHBondContact O-CB 3.44Å; A125-R129 PolarHBondContact O-N 2.9Å
126L57.3Low56Low48 Ų4899.1 Ų99.125%0.25148%0.48SS..Hα-helixtrans-70.5-42.8175.1-170.764.5000112I19 H122 F124 E128 R129 I130I19-L126 HydrophobicContact CD1-CD1 4.47Å; I19-L126 HydrophobicContact CD1-CD2 3.89Å; I19-L126 HydrophobicContact CD1-CG 4.3Å; H122-L126 WeakPolarHBondContact O-CB 3.49Å; H122-L126 PolarHBondContact O-N 3.41Å; F124-L126 VanDerWaalsContact C-N 3.26Å; F124-L126 PolarHBondContact O-N 3.02Å; L126-E128 VanDerWaalsContact C-N 3.35Å; L126-R129 PolarHBondContact O-N 3.03Å; L126-I130 HydrophobicContact CD1-CD1 4.28Å; L126-I130 HydrophobicContact CG-CD1 3.84Å; L126-I130 WeakPolarHBondContact O-CB 2.92Å; L126-I130 WeakPolarHBondContact O-CD1 3.33Å; L126-I130 WeakPolarHBondContact O-CG1 3.38Å; L126-I130 PolarHBondContact O-N 3.45Å
127A56.5Low56.1Low23 Ų2395.7 Ų95.719%0.1948%0.477CS..Hα-helixtrans-64.8-38.5175.400000112S123 F124 I130 L131S123-A127 VanDerWaalsContact O-CB 3.23Å; S123-A127 WeakPolarHBondContact O-CB 3.26Å; S123-A127 PolarHBondContact O-N 2.89Å; F124-A127 PolarHBondContact O-N 2.88Å; A127-I130 PolarHBondContact O-N 3.46Å; A127-L131 VanDerWaalsContact O-CB 3.24Å; A127-L131 WeakPolarHBondContact O-CB 3.04Å; A127-L131 PolarHBondContact O-N 3.36Å
128E58.6Low56.4Low77 Ų7789.1 Ų89.136%0.3646%0.456SS..Hα-helixtrans-68.9-39.1177-154.5-159.8134.500112F124 L126 R132F124-E128 WeakPolarHBondContact O-CB 3.12Å; F124-E128 PolarHBondContact O-N 3.48Å; L126-E128 VanDerWaalsContact C-N 3.35Å; E128-R132 WeakPolarHBondContact O-CG 2.91Å; E128-R132 PolarHBondContact O-N 2.94Å; E128-R132 IonicContact OE1-CZ 3.37Å; E128-R132 IonicContact OE1-NE 3.16Å; E128-R132 PolarHBondContact OE1-NE 2.93Å; E128-R132 VanDerWaalsContact OE1-NE 3.16Å; E128-R132 IonicContact OE1-NH2 2.71Å; E128-R132 PolarHBondContact OE1-NH2 3.48Å
129R63.3Low56.2Low187 Ų18789.4 Ų89.471%0.70647%0.465SS*.Hα-helixtrans-62.2-50.6170.2-91.9-177.3177.1175.2-1.4111.5A125 L126 L131 R132 E133A125-R129 WeakPolarHBondContact O-CB 3.44Å; A125-R129 PolarHBondContact O-N 2.9Å; L126-R129 PolarHBondContact O-N 3.03Å; R129-L131 VanDerWaalsContact C-N 3.31Å; R129-L131 PolarHBondContact O-N 3.22Å; R129-R132 PolarHBondContact O-N 3.31Å; R129-R132 VanDerWaalsContact O-N 3.11Å; R129-E133 WeakPolarHBondContact O-CG 3.22Å; R129-E133 PolarHBondContact O-N 2.79Å
130I59.3Low55.7Low49 Ų4986 Ų8625%0.25146%0.461SS..Hα-helixtrans-59.3-43.7-180-71.5164000110.9I19 L126 A127 R132 E133 F134I19-I130 HydrophobicContact CD1-CD1 3.74Å; I19-I130 HydrophobicContact CG1-CD1 3.64Å; L126-I130 HydrophobicContact CD1-CD1 4.28Å; L126-I130 HydrophobicContact CG-CD1 3.84Å; L126-I130 WeakPolarHBondContact O-CB 2.92Å; L126-I130 WeakPolarHBondContact O-CD1 3.33Å; L126-I130 WeakPolarHBondContact O-CG1 3.38Å; L126-I130 PolarHBondContact O-N 3.45Å; A127-I130 PolarHBondContact O-N 3.46Å; I130-R132 VanDerWaalsContact C-N 3.32Å; I130-R132 PolarHBondContact O-N 3.04Å; I130-E133 PolarHBondContact O-N 3.46Å; I130-F134 HydrophobicContact CG2-CD2 3.42Å; I130-F134 VanDerWaalsContact CG2-CD2 3.42Å; I130-F134 HydrophobicContact CG2-CE2 3.42Å; I130-F134 VanDerWaalsContact CG2-CE2 3.42Å; I130-F134 WeakPolarHBondContact O-CB 3.11Å; I130-F134 WeakPolarHBondContact O-CD2 3.18Å; I130-F134 PolarHBondContact O-N 3.24Å
131L57.8Low55.4Low82 Ų8290.1 Ų90.143%0.42948%0.484SS..Hα-helixtrans-62.7-38.8177.2-171.165.7000111.7A127 R129 L135A127-L131 VanDerWaalsContact O-CB 3.24Å; A127-L131 WeakPolarHBondContact O-CB 3.04Å; A127-L131 PolarHBondContact O-N 3.36Å; R129-L131 VanDerWaalsContact C-N 3.31Å; R129-L131 PolarHBondContact O-N 3.22Å; L131-L135 HydrophobicContact CD1-CD1 3.89Å; L131-L135 HydrophobicContact CG-CD1 4.01Å; L131-L135 WeakPolarHBondContact O-CB 3.47Å; L131-L135 WeakPolarHBondContact O-CD1 3.37Å; L131-L135 PolarHBondContact O-N 3.25Å
132R68.1Low55.4Low152 Ų15292.6 Ų92.657%0.57449%0.487SS*.Hα-helixtrans-66.1-48.7173.7-75.4175.5-164.6-86.60.5112E128 R129 I130 F134 L135 T136E128-R132 WeakPolarHBondContact O-CG 2.91Å; E128-R132 PolarHBondContact O-N 2.94Å; E128-R132 IonicContact OE1-CZ 3.37Å; E128-R132 IonicContact OE1-NE 3.16Å; E128-R132 PolarHBondContact OE1-NE 2.93Å; E128-R132 VanDerWaalsContact OE1-NE 3.16Å; E128-R132 IonicContact OE1-NH2 2.71Å; E128-R132 PolarHBondContact OE1-NH2 3.48Å; R129-R132 PolarHBondContact O-N 3.31Å; R129-R132 VanDerWaalsContact O-N 3.11Å; I130-R132 VanDerWaalsContact C-N 3.32Å; I130-R132 PolarHBondContact O-N 3.04Å; R132-F134 VanDerWaalsContact C-N 3.3Å; R132-F134 PolarHBondContact O-N 3.17Å; R132-L135 PolarHBondContact O-N 3.1Å; R132-T136 WeakPolarHBondContact O-CB 3.18Å; R132-T136 PolarHBondContact O-N 2.8Å; R132-T136 PolarHBondContact O-OG1 3.25Å
133E63.9Low55.6Low124 Ų12489.3 Ų89.358%0.57948%0.475SS*.Hα-helixtrans-59.4-40.9177.6-63.4-61.9142.500111.4R129 I130 T136 C137R129-E133 WeakPolarHBondContact O-CG 3.22Å; R129-E133 PolarHBondContact O-N 2.79Å; I130-E133 PolarHBondContact O-N 3.46Å; E133-T136 PolarHBondContact O-N 3.35Å; E133-C137 WeakPolarHBondContact O-CB 3.46Å; E133-C137 PolarHBondContact O-N 3.1Å; E133-C137 PolarHBondContact O-SG 2.85Å
134F60.5Low55.8Low60 Ų6092.9 Ų92.926%0.26349%0.492SS..Hα-helixtrans-65.8-45175.1-88-64000112.8V22 L26 I130 R132 T136 C137 A138V22-F134 HydrophobicContact CG1-CE2 3.97Å; V22-F134 HydrophobicContact CG1-CZ 3.83Å; L26-F134 HydrophobicContact CB-CE1 4.1Å; L26-F134 HydrophobicContact CD1-CD1 4.07Å; L26-F134 HydrophobicContact CD1-CE1 3.14Å; L26-F134 HydrophobicContact CD1-CE2 4.22Å; L26-F134 HydrophobicContact CD1-CZ 3.26Å; L26-F134 HydrophobicContact CD2-CD1 3.88Å; L26-F134 HydrophobicContact CD2-CE1 3.57Å; L26-F134 HydrophobicContact CG-CE1 3.75Å; L26-F134 HydrophobicContact CG-CZ 4.31Å; I130-F134 HydrophobicContact CG2-CD2 3.42Å; I130-F134 VanDerWaalsContact CG2-CD2 3.42Å; I130-F134 HydrophobicContact CG2-CE2 3.42Å; I130-F134 VanDerWaalsContact CG2-CE2 3.42Å; I130-F134 WeakPolarHBondContact O-CB 3.11Å; I130-F134 WeakPolarHBondContact O-CD2 3.18Å; I130-F134 PolarHBondContact O-N 3.24Å; R132-F134 VanDerWaalsContact C-N 3.3Å; R132-F134 PolarHBondContact O-N 3.17Å; F134-T136 VanDerWaalsContact C-N 3.26Å; F134-T136 PolarHBondContact O-N 3.29Å; F134-C137 PolarHBondContact O-N 3.39Å; F134-A138 VanDerWaalsContact O-CB 3.27Å; F134-A138 WeakPolarHBondContact O-CB 3.24Å; F134-A138 PolarHBondContact O-N 3.3Å
135L56.2Low55.8Low113 Ų11392.8 Ų92.859%0.59250%0.497SS*.Hα-helixtrans-63.3-35.3174.6-98.182.9000111.7L131 R132 C139L131-L135 HydrophobicContact CD1-CD1 3.89Å; L131-L135 HydrophobicContact CG-CD1 4.01Å; L131-L135 WeakPolarHBondContact O-CB 3.47Å; L131-L135 WeakPolarHBondContact O-CD1 3.37Å; L131-L135 PolarHBondContact O-N 3.25Å; R132-L135 PolarHBondContact O-N 3.1Å; L135-C139 VanDerWaalsContact O-CB 3.24Å; L135-C139 WeakPolarHBondContact O-CB 3.41Å; L135-C139 PolarHBondContact O-N 3.24Å; L135-C139 VanDerWaalsContact O-N 3.1Å
136T60.8Low55.5Low75 Ų7595.3 Ų95.346%0.4650%0.5SS..Hα-helixtrans-69.2-45176.4-55.80000111.1R132 E133 F134 C139 I140R132-T136 WeakPolarHBondContact O-CB 3.18Å; R132-T136 PolarHBondContact O-N 2.8Å; R132-T136 PolarHBondContact O-OG1 3.25Å; E133-T136 PolarHBondContact O-N 3.35Å; F134-T136 VanDerWaalsContact C-N 3.26Å; F134-T136 PolarHBondContact O-N 3.29Å; T136-C139 PolarHBondContact O-N 3.46Å; T136-I140 HydrophobicContact CG2-CD1 3.85Å; T136-I140 WeakPolarHBondContact O-CD1 3.38Å; T136-I140 WeakPolarHBondContact O-CG1 3.44Å; T136-I140 PolarHBondContact O-N 3.09Å
137C47.3Very low55.4Low76 Ų7698.4 Ų98.451%0.51452%0.516SS..Hα-helixtrans-63.4-43.8176-68.40000112E133 F134 C139 I140 T141E133-C137 WeakPolarHBondContact O-CB 3.46Å; E133-C137 PolarHBondContact O-N 3.1Å; E133-C137 PolarHBondContact O-SG 2.85Å; F134-C137 PolarHBondContact O-N 3.39Å; C137-C139 PolarHBondContact O-N 2.95Å; C137-I140 PolarHBondContact O-N 3.04Å; C137-T141 PolarHBondContact O-N 3.13Å; C137-T141 PolarHBondContact O-OG1 2.94Å
138A50.2Low55.3Low42 Ų42103.8 Ų103.835%0.34754%0.54SS..Hα-helixtrans-68.5-17.9177.500000114.2Y72 F134Y72-A138 WeakPolarHBondContact OH-CB 3.46Å; F134-A138 VanDerWaalsContact O-CB 3.27Å; F134-A138 WeakPolarHBondContact O-CB 3.24Å; F134-A138 PolarHBondContact O-N 3.3Å
139C44.8Very low55.1Low109 Ų109105.8 Ų105.874%0.73655%0.554SS**Hα-helixtrans-91.1-10.6175.6-1610000112.6L135 T136 C137L135-C139 VanDerWaalsContact O-CB 3.24Å; L135-C139 WeakPolarHBondContact O-CB 3.41Å; L135-C139 PolarHBondContact O-N 3.24Å; L135-C139 VanDerWaalsContact O-N 3.1Å; T136-C139 PolarHBondContact O-N 3.46Å; C137-C139 PolarHBondContact O-N 2.95Å
140I40.8Very low54.4Low138 Ų13899.1 Ų99.171%0.70854%0.541SS*.Hα-helixtrans-97.6-22.1-179.5-67.1165.8000111.5T136 C137T136-I140 HydrophobicContact CG2-CD1 3.85Å; T136-I140 WeakPolarHBondContact O-CD1 3.38Å; T136-I140 WeakPolarHBondContact O-CG1 3.44Å; T136-I140 PolarHBondContact O-N 3.09Å; C137-I140 PolarHBondContact O-N 3.04Å
141T43.2Very low54Low169 Ų169103.6 Ų103.6100%1.03757%0.567SS**  trans-81.70168-510000111.2C137C137-T141 PolarHBondContact O-N 3.13Å; C137-T141 PolarHBondContact O-OG1 2.94Å

Retrieved 141 of 141 residues in 134 ms (Link to these results)