A0A087X5D3_POEFO Loading...

Charged multivesicular body protein 3

AlphaFold DB , UniProt , Accession A0A087X5D3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 223 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
1H40Very low51.2Low229 Ų229154.4 Ų154.4100%1.0685%0.852SS**  097.20-98.883.5000107.9
2N39.3Very low53.8Low173 Ų173150 Ų15093%0.92582%0.818SS**  trans-132.594.5165.3-105.2-2000105.8
3M50.2Low56.6Low172 Ų172143.2 Ų143.285%0.84779%0.785SS**  trans-86.1119175-78.5-77.4-14700107.7
4G49.1Very low59Low75 Ų75136.1 Ų136.177%0.77375%0.75SS**  trans-62.5137.317700000112.2F6G4-F6 VanDerWaalsContact C-N 3.33Å; G4-F6 PolarHBondContact O-N 3.34Å
5L60Low61.2Low165 Ų165135 Ų13586%0.86473%0.734SS**SBendtrans-88.839.9-170.2-153.686000113.1
6F59.2Low63.2Low192 Ų192133.4 Ų133.484%0.84272%0.721SS**SBendtrans-145128.4173.4-82.7-84000110.2G4 R8G4-F6 VanDerWaalsContact C-N 3.33Å; G4-F6 PolarHBondContact O-N 3.34Å; F6-R8 VanDerWaalsContact C-N 3.26Å; F6-R8 PolarHBondContact O-N 3.46Å
7G47.1Very low65Low94 Ų94127.6 Ų127.697%0.96969%0.689SS**SBendtrans-67.361.3-171.100000116.7
8R49.5Very low66.6Low219 Ų219120.5 Ų120.583%0.82665%0.651SS**  trans-109.4118.2152.2-88.2177.5171.1145.6-2.7106.9F6F6-R8 VanDerWaalsContact C-N 3.26Å; F6-R8 PolarHBondContact O-N 3.46Å
9T49.5Very low68.1Low118 Ų118117.8 Ų117.872%0.72464%0.636SS**  trans-44.6134.7159.544.60000108.2D11T9-D11 PolarHBondContact O-N 2.86Å
10P49.3Very low69.5Low125 Ų125114.8 Ų114.881%0.81262%0.617SS**PPolyproline II helixtrans-57116.2177.322.3-30.1000107.4K12P10-K12 PolarHBondContact O-N 3.29Å
11D69.9Low70.8Confident136 Ų136109.3 Ų109.373%0.72759%0.588SS**PPolyproline II helixtrans-50.5129.8170.9-74-43.7000106.8T9T9-D11 PolarHBondContact O-N 2.86Å
12K82.5Confident73.5Confident102 Ų10298.8 Ų98.844%0.44354%0.54SS..PPolyproline II helixtrans-47.1137.1-179.5-71.6174.7177.1171.90108.6P10 L17 E20P10-K12 PolarHBondContact O-N 3.29Å; K12-L17 HydrophobicContact CB-CD2 3.87Å; K12-L17 HydrophobicContact CB-CG 3.95Å; K12-L17 HydrophobicContact CD-CD2 4.06Å; K12-L17 WeakPolarHBondContact O-CD1 3.33Å; K12-E20 IonicContact NZ-OE1 2.69Å; K12-E20 IonicContact NZ-OE2 3.11Å; K12-E20 PolarHBondContact NZ-OE2 3.34Å
13P89.8Confident76.3Confident61 Ų6197.1 Ų97.140%0.39653%0.527SS..PPolyproline II helixtrans-57.4144.2-176.823.9-33.3000110K15 E16 L17P13-K15 PolarHBondContact O-N 3.48Å; P13-E16 WeakPolarHBondContact CD-OE2 3.41Å; P13-E16 HydrophobicContact CG-CB 3.97Å; P13-E16 HydrophobicContact CG-CG 3.67Å; P13-E16 WeakPolarHBondContact CG-OE1 3.49Å; P13-E16 WeakPolarHBondContact O-CA 3.41Å; P13-E16 WeakPolarHBondContact O-CB 3.37Å; P13-E16 PolarHBondContact O-N 3.46Å; P13-L17 PolarHBondContact O-N 3.49Å
14P90.4Very high78.6Confident44 Ų4491.4 Ų91.429%0.28650%0.497SS..Hα-helixtrans-49.9-36.3-174-33.336.6000114.7E16 L17 I18 V100 L106P14-E16 PolarHBondContact O-N 3.33Å; P14-L17 PolarHBondContact O-N 3.11Å; P14-I18 WeakPolarHBondContact O-CD1 3.28Å; P14-I18 VanDerWaalsContact O-CG1 3.22Å; P14-I18 WeakPolarHBondContact O-CG1 3.38Å; P14-I18 PolarHBondContact O-N 3.22Å; P14-V100 HydrophobicContact CB-CG1 4.16Å; P14-V100 HydrophobicContact CB-CG2 3.84Å; P14-L106 HydrophobicContact CB-CD1 4.22Å; P14-L106 HydrophobicContact CB-CD2 4.02Å; P14-L106 HydrophobicContact CB-CG 3.91Å; P14-L106 HydrophobicContact CG-CG 4.47Å
15K92.3Very high80.9Confident120 Ų12087.9 Ų87.952%0.52246%0.461SS..Hα-helixtrans-62.6-39.8176.5-177.7179.7176.3-1700113P13 N19 L97P13-K15 PolarHBondContact O-N 3.48Å; K15-N19 VanDerWaalsContact O-CG 3.22Å; K15-N19 PolarHBondContact O-N 3.11Å; K15-N19 VanDerWaalsContact O-N 3.15Å; K15-N19 PolarHBondContact O-ND2 3.49Å; K15-N19 VanDerWaalsContact O-ND2 3.15Å; K15-L97 HydrophobicContact CB-CD2 4.38Å; K15-L97 HydrophobicContact CG-CD2 3.9Å
16E93.4Very high82.7Confident110 Ų11085.5 Ų85.551%0.51444%0.44SS..Hα-helixtrans-69.4-43.2177.6-75.3176.4-157.700111.1P13 P14 I18 N19 E20P13-E16 WeakPolarHBondContact CD-OE2 3.41Å; P13-E16 HydrophobicContact CG-CB 3.97Å; P13-E16 HydrophobicContact CG-CG 3.67Å; P13-E16 WeakPolarHBondContact CG-OE1 3.49Å; P13-E16 WeakPolarHBondContact O-CA 3.41Å; P13-E16 WeakPolarHBondContact O-CB 3.37Å; P13-E16 PolarHBondContact O-N 3.46Å; P14-E16 PolarHBondContact O-N 3.33Å; E16-I18 PolarHBondContact O-N 3.26Å; E16-N19 PolarHBondContact O-N 2.97Å; E16-E20 WeakPolarHBondContact O-CB 3.35Å; E16-E20 PolarHBondContact O-N 2.61Å
17L93.4Very high84.5Confident34 Ų3482.7 Ų82.718%0.17843%0.427CS..Hα-helixtrans-57.2-49.8174.5-69.1175.2000111.7K12 P13 P14 N19 E20 W21K12-L17 HydrophobicContact CB-CD2 3.87Å; K12-L17 HydrophobicContact CB-CG 3.95Å; K12-L17 HydrophobicContact CD-CD2 4.06Å; K12-L17 WeakPolarHBondContact O-CD1 3.33Å; P13-L17 PolarHBondContact O-N 3.49Å; P14-L17 PolarHBondContact O-N 3.11Å; L17-N19 VanDerWaalsContact C-N 3.29Å; L17-N19 PolarHBondContact O-N 3.02Å; L17-E20 PolarHBondContact O-N 2.71Å; L17-W21 HydrophobicContact CB-CD2 4.41Å; L17-W21 HydrophobicContact CB-CE3 4.35Å; L17-W21 HydrophobicContact CB-CH2 3.66Å; L17-W21 HydrophobicContact CB-CZ2 3.77Å; L17-W21 HydrophobicContact CB-CZ3 3.94Å; L17-W21 HydrophobicContact CD1-CH2 4.12Å; L17-W21 HydrophobicContact CD1-CZ2 4.23Å; L17-W21 HydrophobicContact CD2-CZ2 4.21Å; L17-W21 HydrophobicContact CG-CH2 4.4Å; L17-W21 HydrophobicContact CG-CZ2 4.3Å; L17-W21 VanDerWaalsContact O-CD2 3.22Å; L17-W21 VanDerWaalsContact O-CG 3.22Å; L17-W21 PolarHBondContact O-N 3.45Å
18I94.5Very high86.9Confident0 Ų079.1 Ų79.10%039%0.386CS..Hα-helixtrans-59.3-41.7178.4-65.5160.9000111.5P14 E16 W21 S22 M93 Q96 L97 V100 L106P14-I18 WeakPolarHBondContact O-CD1 3.28Å; P14-I18 VanDerWaalsContact O-CG1 3.22Å; P14-I18 WeakPolarHBondContact O-CG1 3.38Å; P14-I18 PolarHBondContact O-N 3.22Å; E16-I18 PolarHBondContact O-N 3.26Å; I18-W21 HydrophobicContact CG1-CE3 4.37Å; I18-W21 HydrophobicContact CG1-CZ3 4.2Å; I18-S22 WeakPolarHBondContact O-CB 3.3Å; I18-S22 PolarHBondContact O-N 3.33Å; I18-S22 PolarHBondContact O-OG 3.31Å; I18-M93 HydrophobicContact CG2-CB 3.82Å; I18-M93 HydrophobicContact CG2-CG 4.41Å; I18-M93 WeakPolarHBondContact CG2-O 3.43Å; I18-M93 HydrophobicContact CG2-SD 4.24Å; I18-Q96 HydrophobicContact CD1-CB 3.7Å; I18-Q96 HydrophobicContact CG1-CB 4.28Å; I18-L97 HydrophobicContact CB-CD2 3.97Å; I18-L97 HydrophobicContact CB-CG 4.33Å; I18-L97 HydrophobicContact CD1-CD2 3.76Å; I18-L97 HydrophobicContact CD1-CG 4.12Å; I18-L97 HydrophobicContact CG2-CD1 4.26Å; I18-L97 HydrophobicContact CG2-CD2 3.91Å; I18-L97 HydrophobicContact CG2-CG 3.73Å; I18-V100 HydrophobicContact CD1-CG2 4.12Å; I18-L106 HydrophobicContact CD1-CD2 3.64Å; I18-L106 HydrophobicContact CG1-CD2 4.02Å
19N95.2Very high89.2Confident69 Ų6969.6 Ų69.637%0.36935%0.351SS..Hα-helixtrans-65.4-43.2178.1-74.1-27.2000111.7K15 E16 L17 S22 Q23K15-N19 VanDerWaalsContact O-CG 3.22Å; K15-N19 PolarHBondContact O-N 3.11Å; K15-N19 VanDerWaalsContact O-N 3.15Å; K15-N19 PolarHBondContact O-ND2 3.49Å; K15-N19 VanDerWaalsContact O-ND2 3.15Å; E16-N19 PolarHBondContact O-N 2.97Å; L17-N19 VanDerWaalsContact C-N 3.29Å; L17-N19 PolarHBondContact O-N 3.02Å; N19-S22 PolarHBondContact O-N 3.04Å; N19-Q23 WeakPolarHBondContact O-CG 3.49Å; N19-Q23 PolarHBondContact O-N 2.83Å
20E96.1Very high91.5Very high57 Ų5770.4 Ų70.427%0.26634%0.34SS..Hα-helixtrans-62.1-50.3177.8-176.1174.5171.400111.3K12 E16 L17 S22 Q23 K24K12-E20 IonicContact NZ-OE1 2.69Å; K12-E20 IonicContact NZ-OE2 3.11Å; K12-E20 PolarHBondContact NZ-OE2 3.34Å; E16-E20 WeakPolarHBondContact O-CB 3.35Å; E16-E20 PolarHBondContact O-N 2.61Å; L17-E20 PolarHBondContact O-N 2.71Å; E20-S22 VanDerWaalsContact C-N 3.32Å; E20-S22 PolarHBondContact O-N 3.23Å; E20-Q23 WeakPolarHBondContact O-CB 3.48Å; E20-Q23 PolarHBondContact O-N 3.02Å; E20-Q23 VanDerWaalsContact O-N 3.08Å; E20-K24 PolarHBondContact O-N 2.95Å; E20-K24 IonicContact OE1-NZ 3.97Å
21W96.1Very high93.7Very high1 Ų166 Ų660%0.00431%0.311CS..Hα-helixtrans-59.5-43.7175.5-60-30.2000111.8L17 I18 Q23 K24 I25 M93 L106 L132 E135 M136 A139 I141L17-W21 HydrophobicContact CB-CD2 4.41Å; L17-W21 HydrophobicContact CB-CE3 4.35Å; L17-W21 HydrophobicContact CB-CH2 3.66Å; L17-W21 HydrophobicContact CB-CZ2 3.77Å; L17-W21 HydrophobicContact CB-CZ3 3.94Å; L17-W21 HydrophobicContact CD1-CH2 4.12Å; L17-W21 HydrophobicContact CD1-CZ2 4.23Å; L17-W21 HydrophobicContact CD2-CZ2 4.21Å; L17-W21 HydrophobicContact CG-CH2 4.4Å; L17-W21 HydrophobicContact CG-CZ2 4.3Å; L17-W21 VanDerWaalsContact O-CD2 3.22Å; L17-W21 VanDerWaalsContact O-CG 3.22Å; L17-W21 PolarHBondContact O-N 3.45Å; I18-W21 HydrophobicContact CG1-CE3 4.37Å; I18-W21 HydrophobicContact CG1-CZ3 4.2Å; W21-Q23 PolarHBondContact O-N 3.11Å; W21-K24 PolarHBondContact O-N 3.01Å; W21-I25 VanDerWaalsContact O-CG1 3.31Å; W21-I25 WeakPolarHBondContact O-CG1 3.41Å; W21-I25 PolarHBondContact O-N 2.84Å; W21-M93 HydrophobicContact CE3-SD 3.87Å; W21-L106 HydrophobicContact CH2-CD1 4.4Å; W21-L132 HydrophobicContact CB-CD2 4.04Å; W21-L132 HydrophobicContact CG-CD2 3.92Å; W21-E135 HydrophobicContact CZ2-CB 4.2Å; W21-E135 PolarHBondContact NE1-OE2 3.4Å; W21-M136 HydrophobicContact CB-CE 3.74Å; W21-M136 HydrophobicContact CD2-CE 3.98Å; W21-M136 HydrophobicContact CD2-CG 4.05Å; W21-M136 HydrophobicContact CE3-CE 4.07Å; W21-M136 HydrophobicContact CE3-CG 4.09Å; W21-M136 HydrophobicContact CG-CE 3.87Å; W21-M136 HydrophobicContact CH2-CG 4.37Å; W21-M136 HydrophobicContact CZ2-CG 4.28Å; W21-M136 HydrophobicContact CZ3-CG 4.3Å; W21-A139 HydrophobicContact CH2-CB 3.46Å; W21-A139 VanDerWaalsContact CH2-CB 3.46Å; W21-A139 HydrophobicContact CZ2-CB 3.96Å; W21-I141 HydrophobicContact CE3-CD1 4.17Å; W21-I141 HydrophobicContact CH2-CD1 3.99Å; W21-I141 HydrophobicContact CZ3-CD1 3.35Å
22S97.4Very high95Very high7 Ų759.5 Ų59.55%0.04928%0.276CS..Hα-helixtrans-64.4-28.4177.6-59.10000112.6I18 N19 E20 R26 M93I18-S22 WeakPolarHBondContact O-CB 3.3Å; I18-S22 PolarHBondContact O-N 3.33Å; I18-S22 PolarHBondContact O-OG 3.31Å; N19-S22 PolarHBondContact O-N 3.04Å; E20-S22 VanDerWaalsContact C-N 3.32Å; E20-S22 PolarHBondContact O-N 3.23Å; S22-R26 VanDerWaalsContact CB-NH1 3.28Å; S22-R26 WeakPolarHBondContact O-CB 3.35Å; S22-R26 VanDerWaalsContact O-CG 3.25Å; S22-R26 WeakPolarHBondContact O-CG 3.24Å; S22-R26 PolarHBondContact O-N 3.14Å; S22-R26 PolarHBondContact O-NH1 3.34Å; S22-M93 WeakPolarHBondContact OG-CB 3.31Å
23Q97.9Very high95.7Very high138 Ų13856.9 Ų56.965%0.64527%0.267SS*.Hα-helixtrans-75.2-45.7173.4-76.5179.9-4.300111.5N19 E20 W21 R26 K27N19-Q23 WeakPolarHBondContact O-CG 3.49Å; N19-Q23 PolarHBondContact O-N 2.83Å; E20-Q23 WeakPolarHBondContact O-CB 3.48Å; E20-Q23 PolarHBondContact O-N 3.02Å; E20-Q23 VanDerWaalsContact O-N 3.08Å; W21-Q23 PolarHBondContact O-N 3.11Å; Q23-R26 PolarHBondContact O-N 3.32Å; Q23-K27 PolarHBondContact O-N 2.92Å
24K97.6Very high96.1Very high53 Ų5359.2 Ų59.223%0.2327%0.268CS..Hα-helixtrans-55.2-52.3174.8-71.6178.4178.7-177.90110.2E20 W21 R26 K27 E28 E131 L132 E135E20-K24 PolarHBondContact O-N 2.95Å; E20-K24 IonicContact OE1-NZ 3.97Å; W21-K24 PolarHBondContact O-N 3.01Å; K24-R26 PolarHBondContact O-N 3.34Å; K24-K27 WeakPolarHBondContact O-CA 3.14Å; K24-K27 VanDerWaalsContact O-CB 3.27Å; K24-K27 WeakPolarHBondContact O-CB 3.36Å; K24-K27 PolarHBondContact O-N 2.94Å; K24-E28 PolarHBondContact O-N 2.88Å; K24-E28 VanDerWaalsContact O-N 3.11Å; K24-E131 IonicContact NZ-OE1 2.73Å; K24-L132 HydrophobicContact CB-CD1 4.19Å; K24-L132 HydrophobicContact CB-CD2 4.17Å; K24-L132 HydrophobicContact CD-CD2 3.62Å; K24-L132 HydrophobicContact CD-CG 4.37Å; K24-E135 IonicContact NZ-OE1 2.76Å; K24-E135 PolarHBondContact NZ-OE1 3.34Å; K24-E135 IonicContact NZ-OE2 3.28Å; K24-E135 PolarHBondContact NZ-OE2 3.4Å
25I97.4Very high96.4Very high1 Ų159.6 Ų59.61%0.00527%0.266CS..Hα-helixtrans-58.6-44178.8-64.9164.6000111.9W21 K27 E28 M29 M86 V89 L90 L132 M136W21-I25 VanDerWaalsContact O-CG1 3.31Å; W21-I25 WeakPolarHBondContact O-CG1 3.41Å; W21-I25 PolarHBondContact O-N 2.84Å; I25-K27 PolarHBondContact O-N 3.28Å; I25-E28 PolarHBondContact O-N 3.49Å; I25-M29 HydrophobicContact CG2-CG 4.49Å; I25-M29 WeakPolarHBondContact O-CG 3.19Å; I25-M29 PolarHBondContact O-N 3Å; I25-M86 HydrophobicContact CG2-CB 3.8Å; I25-M86 HydrophobicContact CG2-CG 3.98Å; I25-M86 HydrophobicContact CG2-SD 4.2Å; I25-V89 HydrophobicContact CD1-CB 4.16Å; I25-V89 HydrophobicContact CD1-CG1 3.42Å; I25-V89 VanDerWaalsContact CD1-CG1 3.42Å; I25-L90 HydrophobicContact CB-CD2 4.1Å; I25-L90 HydrophobicContact CB-CG 4.41Å; I25-L90 HydrophobicContact CG2-CD1 4.17Å; I25-L90 HydrophobicContact CG2-CD2 4.05Å; I25-L90 HydrophobicContact CG2-CG 3.8Å; I25-L132 HydrophobicContact CD1-CD1 4.49Å; I25-L132 HydrophobicContact CG1-CD1 3.73Å; I25-M136 HydrophobicContact CD1-CE 4.25Å
26R98.2Very high96.6Very high114 Ų11454.1 Ų54.143%0.4324%0.242SC..Hα-helixtrans-63.7-30.1176.5-76.3-177.5-169.496.5-2.9112.8S22 Q23 K24 R30 L90S22-R26 VanDerWaalsContact CB-NH1 3.28Å; S22-R26 WeakPolarHBondContact O-CB 3.35Å; S22-R26 VanDerWaalsContact O-CG 3.25Å; S22-R26 WeakPolarHBondContact O-CG 3.24Å; S22-R26 PolarHBondContact O-N 3.14Å; S22-R26 PolarHBondContact O-NH1 3.34Å; Q23-R26 PolarHBondContact O-N 3.32Å; K24-R26 PolarHBondContact O-N 3.34Å; R26-R30 VanDerWaalsContact C-NH1 3.26Å; R26-R30 WeakPolarHBondContact O-CG 3.49Å; R26-R30 PolarHBondContact O-N 3.14Å; R26-R30 PolarHBondContact O-NH1 3.06Å; R26-L90 HydrophobicContact CG-CD1 3.89Å; R26-L90 HydrophobicContact CG-CD2 4.22Å
27K97.9Very high96.9Very high133 Ų13354.6 Ų54.658%0.57824%0.24SC*.Hα-helixtrans-67.1-46175.2-171.8-174.3174.4-169.30110.1Q23 K24 I25 R30 V31Q23-K27 PolarHBondContact O-N 2.92Å; K24-K27 WeakPolarHBondContact O-CA 3.14Å; K24-K27 VanDerWaalsContact O-CB 3.27Å; K24-K27 WeakPolarHBondContact O-CB 3.36Å; K24-K27 PolarHBondContact O-N 2.94Å; I25-K27 PolarHBondContact O-N 3.28Å; K27-R30 WeakPolarHBondContact O-CB 3.31Å; K27-R30 PolarHBondContact O-N 3.4Å; K27-V31 PolarHBondContact O-N 3.25Å
28E97.3Very high97.1Very high20 Ų2056.4 Ų56.49%0.09325%0.249CC..Hα-helixtrans-64.9-38.2178.1-61-45.4126.100112.8K24 I25 R30 V31 I32 M86 V125 T128 M129K24-E28 PolarHBondContact O-N 2.88Å; K24-E28 VanDerWaalsContact O-N 3.11Å; I25-E28 PolarHBondContact O-N 3.49Å; E28-R30 PolarHBondContact O-N 3.1Å; E28-R30 VanDerWaalsContact O-N 3.16Å; E28-V31 WeakPolarHBondContact O-CA 3.46Å; E28-V31 VanDerWaalsContact O-CB 3.3Å; E28-V31 WeakPolarHBondContact O-CB 3.45Å; E28-V31 PolarHBondContact O-N 3.01Å; E28-I32 PolarHBondContact O-N 3.27Å; E28-M86 HydrophobicContact CB-SD 3.96Å; E28-V125 HydrophobicContact CB-CB 4.44Å; E28-V125 HydrophobicContact CB-CG1 3.83Å; E28-V125 HydrophobicContact CG-CG1 4.41Å; E28-T128 HydrophobicContact CG-CG2 4.35Å; E28-T128 WeakPolarHBondContact CG-OG1 3.34Å; E28-M129 HydrophobicContact CB-CE 3.82Å; E28-M129 HydrophobicContact CG-CE 4.05Å
29M97.9Very high97.2Very high19 Ų1958.3 Ų58.39%0.09426%0.259CS..Hα-helixtrans-54.9-36.3170.6-71.1179.575.900112.9I25 V31 I32 D33 K83 M86 N87 L90I25-M29 HydrophobicContact CG2-CG 4.49Å; I25-M29 WeakPolarHBondContact O-CG 3.19Å; I25-M29 PolarHBondContact O-N 3Å; M29-V31 VanDerWaalsContact C-N 3.34Å; M29-I32 PolarHBondContact O-N 3.47Å; M29-D33 PolarHBondContact O-N 3.36Å; M29-K83 HydrophobicContact CE-CG 3.86Å; M29-M86 HydrophobicContact CB-CE 4.29Å; M29-M86 HydrophobicContact CB-SD 4.4Å; M29-M86 HydrophobicContact CG-CB 3.79Å; M29-M86 HydrophobicContact CG-CE 3.71Å; M29-M86 HydrophobicContact CG-CG 4.32Å; M29-M86 HydrophobicContact CG-SD 3.56Å; M29-M86 VanDerWaalsContact CG-SD 3.56Å; M29-M86 HydrophobicContact SD-CB 4.25Å; M29-N87 WeakPolarHBondContact CE-OD1 3.35Å; M29-L90 HydrophobicContact SD-CD1 3.49Å; M29-L90 WeakPolarHBondContact SD-CD1 3.45Å
30R97.6Very high97.3Very high134 Ų13458.5 Ų58.551%0.50626%0.258SS..Hα-helixtrans-74.7-25176.9-63.2178.3-169.197.5-13112.7R26 K27 E28 R34R26-R30 VanDerWaalsContact C-NH1 3.26Å; R26-R30 WeakPolarHBondContact O-CG 3.49Å; R26-R30 PolarHBondContact O-N 3.14Å; R26-R30 PolarHBondContact O-NH1 3.06Å; K27-R30 WeakPolarHBondContact O-CB 3.31Å; K27-R30 PolarHBondContact O-N 3.4Å; E28-R30 PolarHBondContact O-N 3.1Å; E28-R30 VanDerWaalsContact O-N 3.16Å; R30-R34 WeakPolarHBondContact O-CG 3.27Å; R30-R34 PolarHBondContact O-N 3.37Å; R30-R34 VanDerWaalsContact O-N 3.13Å; R30-R34 PolarHBondContact O-NH1 3.38Å
31V95.9Very high97.4Very high32 Ų3262 Ų6219%0.19427%0.268CS..Hα-helixtrans-67.5-49.7171.8177.90000108.7K27 E28 M29 D33 R34 Q35K27-V31 PolarHBondContact O-N 3.25Å; E28-V31 WeakPolarHBondContact O-CA 3.46Å; E28-V31 VanDerWaalsContact O-CB 3.3Å; E28-V31 WeakPolarHBondContact O-CB 3.45Å; E28-V31 PolarHBondContact O-N 3.01Å; M29-V31 VanDerWaalsContact C-N 3.34Å; V31-D33 VanDerWaalsContact C-N 3.33Å; V31-D33 PolarHBondContact O-N 3.32Å; V31-R34 VanDerWaalsContact CG2-NH2 3.28Å; V31-R34 WeakPolarHBondContact O-CA 3.46Å; V31-R34 WeakPolarHBondContact O-CB 3.46Å; V31-R34 PolarHBondContact O-N 2.89Å; V31-Q35 PolarHBondContact O-N 3.03Å
32I96.4Very high97.4Very high0 Ų066.2 Ų66.20%029%0.289CS..Hα-helixtrans-57-46.2174.5-63.6-154.9000111.2E28 M29 R34 Q35 I36 L79 K83 M86 V125E28-I32 PolarHBondContact O-N 3.27Å; M29-I32 PolarHBondContact O-N 3.47Å; I32-R34 PolarHBondContact O-N 2.86Å; I32-Q35 PolarHBondContact O-N 3.5Å; I32-Q35 VanDerWaalsContact O-N 3.11Å; I32-I36 HydrophobicContact CG2-CD1 3.8Å; I32-I36 HydrophobicContact CG2-CG1 4.26Å; I32-I36 WeakPolarHBondContact O-CG1 3.29Å; I32-I36 PolarHBondContact O-N 3.18Å; I32-L79 HydrophobicContact CD1-CD2 4.4Å; I32-L79 HydrophobicContact CG2-CB 3.97Å; I32-L79 HydrophobicContact CG2-CD2 4.2Å; I32-L79 WeakPolarHBondContact CG2-O 3.49Å; I32-K83 HydrophobicContact CG2-CB 4.43Å; I32-M86 HydrophobicContact CB-CE 4.34Å; I32-M86 HydrophobicContact CD1-CE 3.2Å; I32-M86 HydrophobicContact CG1-CE 3.77Å; I32-V125 HydrophobicContact CD1-CG1 4.09Å; I32-V125 HydrophobicContact CG1-CG1 3.96Å
33D97.8Very high97.3Very high48 Ų4867.3 Ų67.326%0.25729%0.293SS..Hα-helixtrans-63.3-26.9177.5-77.4-29000113.7M29 V31 R37 K83M29-D33 PolarHBondContact O-N 3.36Å; V31-D33 VanDerWaalsContact C-N 3.33Å; V31-D33 PolarHBondContact O-N 3.32Å; D33-R37 WeakPolarHBondContact O-CG 3.45Å; D33-R37 PolarHBondContact O-NE 3.3Å; D33-K83 WeakPolarHBondContact OD1-CE 3.35Å; D33-K83 IonicContact OD1-NZ 3.32Å; D33-K83 PolarHBondContact OD1-NZ 3.39Å; D33-K83 IonicContact OD2-NZ 2.98Å; D33-K83 PolarHBondContact OD2-NZ 3.06Å
34R97.6Very high97.3Very high110 Ų11066 Ų6642%0.41529%0.286SS..Hα-helixtrans-72.4-48.3171-82.6-178.1-67.7-87.8-0.1110.3R30 V31 I32 I36 R37 D38R30-R34 WeakPolarHBondContact O-CG 3.27Å; R30-R34 PolarHBondContact O-N 3.37Å; R30-R34 VanDerWaalsContact O-N 3.13Å; R30-R34 PolarHBondContact O-NH1 3.38Å; V31-R34 VanDerWaalsContact CG2-NH2 3.28Å; V31-R34 WeakPolarHBondContact O-CA 3.46Å; V31-R34 WeakPolarHBondContact O-CB 3.46Å; V31-R34 PolarHBondContact O-N 2.89Å; I32-R34 PolarHBondContact O-N 2.86Å; R34-I36 PolarHBondContact O-N 3.27Å; R34-R37 WeakPolarHBondContact O-CB 3.41Å; R34-R37 PolarHBondContact O-N 3.39Å; R34-R37 VanDerWaalsContact O-N 3.09Å; R34-D38 PolarHBondContact O-N 2.98Å
35Q96.6Very high97.2Very high52 Ų5268.6 Ų68.624%0.24330%0.298CS..Hα-helixtrans-62.1-42.9-178.3-74.1164.3-30.900112.9V31 I32 R37 D38 I39 L79V31-Q35 PolarHBondContact O-N 3.03Å; I32-Q35 PolarHBondContact O-N 3.5Å; I32-Q35 VanDerWaalsContact O-N 3.11Å; Q35-R37 VanDerWaalsContact C-N 3.28Å; Q35-R37 PolarHBondContact O-N 3.43Å; Q35-D38 PolarHBondContact O-N 3.07Å; Q35-D38 VanDerWaalsContact O-N 3.1Å; Q35-I39 VanDerWaalsContact O-CG1 3.31Å; Q35-I39 WeakPolarHBondContact O-CG1 3.45Å; Q35-I39 PolarHBondContact O-N 2.87Å; Q35-L79 HydrophobicContact CB-CD1 4.11Å
36I97.4Very high97.2Very high4 Ų469.2 Ų69.22%0.02130%0.301CS..Hα-helixtrans-55.3-47.3173.3-68.7171.3000110.4I32 R34 D38 I39 Q40 I76 L79 Y80I32-I36 HydrophobicContact CG2-CD1 3.8Å; I32-I36 HydrophobicContact CG2-CG1 4.26Å; I32-I36 WeakPolarHBondContact O-CG1 3.29Å; I32-I36 PolarHBondContact O-N 3.18Å; R34-I36 PolarHBondContact O-N 3.27Å; I36-D38 VanDerWaalsContact C-N 3.32Å; I36-D38 PolarHBondContact O-N 3.12Å; I36-I39 PolarHBondContact O-N 3.09Å; I36-Q40 HydrophobicContact CG2-CG 4.43Å; I36-Q40 WeakPolarHBondContact O-CB 3.4Å; I36-Q40 WeakPolarHBondContact O-CG 3.32Å; I36-Q40 PolarHBondContact O-N 3.4Å; I36-I76 HydrophobicContact CG2-CG2 4.32Å; I36-L79 HydrophobicContact CD1-CB 4Å; I36-L79 HydrophobicContact CG1-CB 3.74Å; I36-L79 HydrophobicContact CG1-CD1 3.89Å; I36-L79 HydrophobicContact CG1-CG 4.47Å; I36-Y80 HydrophobicContact CD1-CD1 3.87Å; I36-Y80 HydrophobicContact CD1-CD2 4.42Å; I36-Y80 HydrophobicContact CD1-CE1 3.79Å; I36-Y80 HydrophobicContact CD1-CE2 4.36Å; I36-Y80 HydrophobicContact CD1-CG 4.18Å; I36-Y80 HydrophobicContact CG2-CE2 4.2Å
37R98.2Very high97Very high121 Ų12168.5 Ų68.546%0.45730%0.302SS..Hα-helixtrans-66.3-34.7178.6-75.2-178.6-69.3133.4-7.8112.7D33 R34 Q35 R41D33-R37 WeakPolarHBondContact O-CG 3.45Å; D33-R37 PolarHBondContact O-NE 3.3Å; R34-R37 WeakPolarHBondContact O-CB 3.41Å; R34-R37 PolarHBondContact O-N 3.39Å; R34-R37 VanDerWaalsContact O-N 3.09Å; Q35-R37 VanDerWaalsContact C-N 3.28Å; Q35-R37 PolarHBondContact O-N 3.43Å; R37-R41 WeakPolarHBondContact O-CG 3.41Å; R37-R41 PolarHBondContact O-N 3.48Å; R37-R41 VanDerWaalsContact O-N 3.09Å
38D97.6Very high96.9Very high71 Ų7169.8 Ų69.838%0.3830%0.303SS..Hα-helixtrans-69.3-44.2179.9-62.5-15.5000110.3R34 Q35 I36 R41 E42R34-D38 PolarHBondContact O-N 2.98Å; Q35-D38 PolarHBondContact O-N 3.07Å; Q35-D38 VanDerWaalsContact O-N 3.1Å; I36-D38 VanDerWaalsContact C-N 3.32Å; I36-D38 PolarHBondContact O-N 3.12Å; D38-R41 PolarHBondContact O-N 3.36Å; D38-R41 IonicContact OD1-CZ 3.83Å; D38-R41 VanDerWaalsContact OD1-CZ 3.28Å; D38-R41 IonicContact OD1-NH1 3.53Å; D38-R41 PolarHBondContact OD1-NH1 3.45Å; D38-R41 IonicContact OD1-NH2 3.56Å; D38-R41 PolarHBondContact OD1-NH2 2.96Å; D38-E42 PolarHBondContact O-N 2.89Å
39I96.8Very high96.9Very high41 Ų4171.5 Ų71.521%0.2132%0.317CS..Hα-helixtrans-63.6-46.5174.8-60.7164.9000110.5Q35 I36 R41 E42 E43 A75 I76 L79Q35-I39 VanDerWaalsContact O-CG1 3.31Å; Q35-I39 WeakPolarHBondContact O-CG1 3.45Å; Q35-I39 PolarHBondContact O-N 2.87Å; I36-I39 PolarHBondContact O-N 3.09Å; I39-R41 VanDerWaalsContact C-N 3.29Å; I39-R41 PolarHBondContact O-N 3.47Å; I39-E42 CarbonylContact O-C 3.55Å; I39-E42 WeakPolarHBondContact O-CA 3.37Å; I39-E42 WeakPolarHBondContact O-CB 3.27Å; I39-E42 PolarHBondContact O-N 3.29Å; I39-E43 HydrophobicContact CG2-CG 4.44Å; I39-E43 PolarHBondContact O-N 2.95Å; I39-A75 HydrophobicContact CD1-CB 4.37Å; I39-I76 HydrophobicContact CB-CD1 4.27Å; I39-I76 HydrophobicContact CB-CG1 4.08Å; I39-I76 HydrophobicContact CD1-CG1 4.42Å; I39-I76 HydrophobicContact CG2-CD1 3.78Å; I39-I76 HydrophobicContact CG2-CG1 3.76Å; I39-L79 HydrophobicContact CD1-CD1 3.66Å
40Q97.5Very high96.7Very high72 Ų7270.6 Ų70.634%0.33631%0.312SS..Hα-helixtrans-58.3-38.7177.7-75.6175.3-21.900113I36 E42 E43 E44 I76I36-Q40 HydrophobicContact CG2-CG 4.43Å; I36-Q40 WeakPolarHBondContact O-CB 3.4Å; I36-Q40 WeakPolarHBondContact O-CG 3.32Å; I36-Q40 PolarHBondContact O-N 3.4Å; Q40-E42 VanDerWaalsContact C-N 3.29Å; Q40-E42 PolarHBondContact O-N 3.1Å; Q40-E43 PolarHBondContact O-N 3.25Å; Q40-E44 PolarHBondContact O-N 2.85Å; Q40-E44 VanDerWaalsContact O-N 3.1Å; Q40-I76 HydrophobicContact CG-CD1 3.69Å
41R97.8Very high96.5Very high130 Ų13068.7 Ų68.749%0.49131%0.308SS..Hα-helixtrans-66.5-32.9174.6-75.3-166.3-50.1-100.14.1112.3R37 D38 I39R37-R41 WeakPolarHBondContact O-CG 3.41Å; R37-R41 PolarHBondContact O-N 3.48Å; R37-R41 VanDerWaalsContact O-N 3.09Å; D38-R41 PolarHBondContact O-N 3.36Å; D38-R41 IonicContact OD1-CZ 3.83Å; D38-R41 VanDerWaalsContact OD1-CZ 3.28Å; D38-R41 IonicContact OD1-NH1 3.53Å; D38-R41 PolarHBondContact OD1-NH1 3.45Å; D38-R41 IonicContact OD1-NH2 3.56Å; D38-R41 PolarHBondContact OD1-NH2 2.96Å; I39-R41 VanDerWaalsContact C-N 3.29Å; I39-R41 PolarHBondContact O-N 3.47Å
42E96.8Very high96.5Very high91 Ų9170.8 Ų70.843%0.42532%0.318SS..Hα-helixtrans-73.2-40.3175.1-160.156.7-140.300111.3D38 I39 Q40 E44 K45 V46D38-E42 PolarHBondContact O-N 2.89Å; I39-E42 CarbonylContact O-C 3.55Å; I39-E42 WeakPolarHBondContact O-CA 3.37Å; I39-E42 WeakPolarHBondContact O-CB 3.27Å; I39-E42 PolarHBondContact O-N 3.29Å; Q40-E42 VanDerWaalsContact C-N 3.29Å; Q40-E42 PolarHBondContact O-N 3.1Å; E42-E44 PolarHBondContact O-N 2.95Å; E42-K45 WeakPolarHBondContact O-CA 3.35Å; E42-K45 WeakPolarHBondContact O-CB 3.32Å; E42-K45 PolarHBondContact O-N 3.45Å; E42-K45 IonicContact OE1-NZ 2.71Å; E42-K45 WeakPolarHBondContact OE2-CE 3.43Å; E42-K45 IonicContact OE2-NZ 2.61Å; E42-K45 PolarHBondContact OE2-NZ 3.3Å; E42-V46 WeakPolarHBondContact O-CG2 3.49Å; E42-V46 PolarHBondContact O-N 2.87Å
43E96.3Very high96.4Very high29 Ų2971.1 Ų71.114%0.13632%0.321CS..Hα-helixtrans-54.4-41171.8-71.6-172.1160.800111.7I39 Q40 K45 V46 K47 M69 S72 K73 I76I39-E43 HydrophobicContact CG2-CG 4.44Å; I39-E43 PolarHBondContact O-N 2.95Å; Q40-E43 PolarHBondContact O-N 3.25Å; E43-K45 VanDerWaalsContact C-N 3.28Å; E43-K45 PolarHBondContact O-N 3.4Å; E43-V46 PolarHBondContact O-N 2.64Å; E43-K47 VanDerWaalsContact O-CB 3.3Å; E43-K47 WeakPolarHBondContact O-CB 3.31Å; E43-K47 PolarHBondContact O-N 2.89Å; E43-M69 HydrophobicContact CB-CE 4.12Å; E43-M69 HydrophobicContact CB-SD 3.96Å; E43-M69 HydrophobicContact CG-CE 4.47Å; E43-M69 HydrophobicContact CG-SD 3.87Å; E43-M69 WeakPolarHBondContact O-CE 3.35Å; E43-S72 VanDerWaalsContact OE1-CB 3.22Å; E43-S72 WeakPolarHBondContact OE1-CB 3.43Å; E43-K73 PolarHBondContact OE1-N 3.38Å; E43-I76 WeakPolarHBondContact OE1-CD1 3.38Å
44E96.3Very high96.1Very high110 Ų11069.5 Ų69.551%0.51431%0.314SS..Hα-helixtrans-60.9-35.6175.8-74.4-176.3-173.100113.2Q40 E42 R48Q40-E44 PolarHBondContact O-N 2.85Å; Q40-E44 VanDerWaalsContact O-N 3.1Å; E42-E44 PolarHBondContact O-N 2.95Å; E44-R48 WeakPolarHBondContact O-CG 3.46Å; E44-R48 PolarHBondContact O-N 2.92Å
45K96.5Very high95.9Very high109 Ų10972.4 Ų72.447%0.47433%0.33SS..Hα-helixtrans-73-46.6176-61.4179-159.4156.50110.7E42 E43 K47 R48 S49E42-K45 WeakPolarHBondContact O-CA 3.35Å; E42-K45 WeakPolarHBondContact O-CB 3.32Å; E42-K45 PolarHBondContact O-N 3.45Å; E42-K45 IonicContact OE1-NZ 2.71Å; E42-K45 WeakPolarHBondContact OE2-CE 3.43Å; E42-K45 IonicContact OE2-NZ 2.61Å; E42-K45 PolarHBondContact OE2-NZ 3.3Å; E43-K45 VanDerWaalsContact C-N 3.28Å; E43-K45 PolarHBondContact O-N 3.4Å; K45-K47 PolarHBondContact O-N 2.9Å; K45-R48 WeakPolarHBondContact O-CB 3.22Å; K45-R48 PolarHBondContact O-N 2.91Å; K45-S49 PolarHBondContact O-N 3.49Å; K45-S49 PolarHBondContact O-OG 3.26Å
46V96.3Very high95.7Very high13 Ų1376.9 Ų76.98%0.07935%0.348CS..Hα-helixtrans-56.4-41.9176175.50000110.4E42 E43 R48 S49 I50 L65 M69E42-V46 WeakPolarHBondContact O-CG2 3.49Å; E42-V46 PolarHBondContact O-N 2.87Å; E43-V46 PolarHBondContact O-N 2.64Å; V46-R48 VanDerWaalsContact C-N 3.32Å; V46-R48 PolarHBondContact O-N 3.29Å; V46-S49 WeakPolarHBondContact O-CB 3.5Å; V46-S49 PolarHBondContact O-N 2.92Å; V46-S49 VanDerWaalsContact O-N 3.14Å; V46-I50 HydrophobicContact CG1-CD1 3.95Å; V46-I50 HydrophobicContact CG1-CG1 4.36Å; V46-I50 WeakPolarHBondContact O-CG1 3.38Å; V46-I50 PolarHBondContact O-N 2.99Å; V46-L65 HydrophobicContact CG1-CB 4.21Å; V46-L65 HydrophobicContact CG1-CD2 4.33Å; V46-L65 WeakPolarHBondContact CG1-O 3.46Å; V46-M69 HydrophobicContact CB-CE 3.82Å; V46-M69 HydrophobicContact CG1-CE 3.67Å
47K95.6Very high95.3Very high99 Ų9979.1 Ų79.143%0.4337%0.373SS..Hα-helixtrans-59.6-38.4175.4-171.9175.3-175.2170.40113E43 K45 K51 M69 I174E43-K47 VanDerWaalsContact O-CB 3.3Å; E43-K47 WeakPolarHBondContact O-CB 3.31Å; E43-K47 PolarHBondContact O-N 2.89Å; K45-K47 PolarHBondContact O-N 2.9Å; K47-K51 WeakPolarHBondContact O-CG 3.48Å; K47-K51 PolarHBondContact O-N 3.08Å; K47-M69 HydrophobicContact CB-CE 4.36Å; K47-I174 HydrophobicContact CG-CD1 4.36Å; K47-I174 HydrophobicContact CG-CG1 4.28Å; K47-I174 HydrophobicContact CG-CG2 3.81Å
48R95.9Very high95.1Very high160 Ų16077.6 Ų77.660%0.60437%0.371SS*.Hα-helixtrans-68.1-45174.3-65.5171-159.9-172.85.1110.4E44 K45 V46 I50 K51 D52E44-R48 WeakPolarHBondContact O-CG 3.46Å; E44-R48 PolarHBondContact O-N 2.92Å; K45-R48 WeakPolarHBondContact O-CB 3.22Å; K45-R48 PolarHBondContact O-N 2.91Å; V46-R48 VanDerWaalsContact C-N 3.32Å; V46-R48 PolarHBondContact O-N 3.29Å; R48-I50 VanDerWaalsContact C-N 3.34Å; R48-I50 PolarHBondContact O-N 3.11Å; R48-K51 WeakPolarHBondContact O-CB 3.45Å; R48-K51 PolarHBondContact O-N 3.37Å; R48-K51 VanDerWaalsContact O-N 3.14Å; R48-D52 PolarHBondContact O-N 3.1Å
49S95.6Very high94.7Very high56 Ų5679.8 Ų79.839%0.39238%0.377SS..Hα-helixtrans-58.9-41.9176.8-58.70000112.6K45 V46 K51 D52 A53K45-S49 PolarHBondContact O-N 3.49Å; K45-S49 PolarHBondContact O-OG 3.26Å; V46-S49 WeakPolarHBondContact O-CB 3.5Å; V46-S49 PolarHBondContact O-N 2.92Å; V46-S49 VanDerWaalsContact O-N 3.14Å; S49-K51 PolarHBondContact O-N 3.02Å; S49-D52 PolarHBondContact O-N 2.99Å; S49-A53 VanDerWaalsContact O-CB 3.28Å; S49-A53 WeakPolarHBondContact O-CB 3.21Å; S49-A53 PolarHBondContact O-N 3.37Å
50I94.4Very high94.5Very high0 Ų084.3 Ų84.30%040%0.401CS..Hα-helixtrans-60.2-46174.9-69.3166.8000110.6V46 R48 D52 A53 A54 L65 M69 L171 I174 T175V46-I50 HydrophobicContact CG1-CD1 3.95Å; V46-I50 HydrophobicContact CG1-CG1 4.36Å; V46-I50 WeakPolarHBondContact O-CG1 3.38Å; V46-I50 PolarHBondContact O-N 2.99Å; R48-I50 VanDerWaalsContact C-N 3.34Å; R48-I50 PolarHBondContact O-N 3.11Å; I50-D52 VanDerWaalsContact C-N 3.35Å; I50-D52 PolarHBondContact O-N 2.94Å; I50-A53 PolarHBondContact O-N 3.47Å; I50-A54 VanDerWaalsContact O-CB 3.24Å; I50-A54 WeakPolarHBondContact O-CB 3.21Å; I50-A54 PolarHBondContact O-N 3.42Å; I50-L65 HydrophobicContact CD1-CB 4.03Å; I50-L65 HydrophobicContact CG1-CB 3.44Å; I50-L65 VanDerWaalsContact CG1-CB 3.44Å; I50-L65 HydrophobicContact CG1-CD1 4.05Å; I50-L65 HydrophobicContact CG1-CG 4.4Å; I50-M69 HydrophobicContact CD1-CE 4.47Å; I50-L171 HydrophobicContact CG2-CD2 3.92Å; I50-I174 HydrophobicContact CB-CG2 3.98Å; I50-I174 HydrophobicContact CD1-CD1 3.61Å; I50-I174 HydrophobicContact CG2-CB 4.24Å; I50-I174 HydrophobicContact CG2-CG2 3.61Å; I50-T175 HydrophobicContact CG2-CG2 4.09Å
51K94.3Very high94.3Very high94 Ų9484 Ų8441%0.40940%0.404SS..Hα-helixtrans-63.1-41178.7-71.9177.9177.4-170.70112.3K47 R48 S49 A54 K55 I174K47-K51 WeakPolarHBondContact O-CG 3.48Å; K47-K51 PolarHBondContact O-N 3.08Å; R48-K51 WeakPolarHBondContact O-CB 3.45Å; R48-K51 PolarHBondContact O-N 3.37Å; R48-K51 VanDerWaalsContact O-N 3.14Å; S49-K51 PolarHBondContact O-N 3.02Å; K51-A54 PolarHBondContact O-N 3.38Å; K51-K55 WeakPolarHBondContact O-CG 3.45Å; K51-K55 PolarHBondContact O-N 3.34Å; K51-K55 VanDerWaalsContact O-N 3.11Å; K51-I174 WeakPolarHBondContact CE-O 3.39Å; K51-I174 HydrophobicContact CG-CG2 3.93Å
52D94.6Very high94.1Very high77 Ų7777.8 Ų77.841%0.41238%0.381SS..Hα-helixtrans-73.4-37.7-179.4-69.5-22.3000112.1R48 S49 I50 A54 K55 K56R48-D52 PolarHBondContact O-N 3.1Å; S49-D52 PolarHBondContact O-N 2.99Å; I50-D52 VanDerWaalsContact C-N 3.35Å; I50-D52 PolarHBondContact O-N 2.94Å; D52-A54 VanDerWaalsContact C-N 3.35Å; D52-K55 PolarHBondContact O-N 3.42Å; D52-K55 IonicContact OD1-NZ 2.67Å; D52-K56 WeakPolarHBondContact O-CG 3.41Å; D52-K56 PolarHBondContact O-N 3.45Å
53A93.9Very high93.9Very high6 Ų676 Ų765%0.0538%0.376CS..Hα-helixtrans-63.6-40.7171.600000111.5S49 I50 K55 K56 G57 Q58 V61S49-A53 VanDerWaalsContact O-CB 3.28Å; S49-A53 WeakPolarHBondContact O-CB 3.21Å; S49-A53 PolarHBondContact O-N 3.37Å; I50-A53 PolarHBondContact O-N 3.47Å; A53-K55 PolarHBondContact O-N 3.17Å; A53-K56 CarbonylContact O-C 3.58Å; A53-K56 PolarHBondContact O-N 3.07Å; A53-K56 VanDerWaalsContact O-N 3.11Å; A53-G57 PolarHBondContact O-N 3.09Å; A53-Q58 HydrophobicContact CB-CB 4.37Å; A53-Q58 PolarHBondContact O-N 2.96Å; A53-V61 HydrophobicContact CB-CB 4.27Å; A53-V61 HydrophobicContact CB-CG1 3.91Å
54A92.9Very high93.8Very high15 Ų1579.3 Ų79.312%0.12440%0.398CS..Hα-helixtrans-62.2-43.9177.300000112.3I50 K51 D52 K56 G57 C62 T175 L179I50-A54 VanDerWaalsContact O-CB 3.24Å; I50-A54 WeakPolarHBondContact O-CB 3.21Å; I50-A54 PolarHBondContact O-N 3.42Å; K51-A54 PolarHBondContact O-N 3.38Å; D52-A54 VanDerWaalsContact C-N 3.35Å; A54-K56 PolarHBondContact O-N 3.43Å; A54-G57 PolarHBondContact O-N 3.25Å; A54-C62 PolarHBondContact N-SG 2.89Å; A54-C62 VanDerWaalsContact N-SG 3.4Å; A54-T175 HydrophobicContact CB-CG2 3.65Å; A54-L179 HydrophobicContact CB-CD1 3.98Å; A54-L179 HydrophobicContact CB-CD2 3.91Å; A54-L179 HydrophobicContact CB-CG 3.92Å
55K91.8Very high93.7Very high170 Ų17075.9 Ų75.974%0.73938%0.383SS*.Hα-helixtrans-60.7-29.8174.6-72171-172.51660113.1K51 D52 A53 G57K51-K55 WeakPolarHBondContact O-CG 3.45Å; K51-K55 PolarHBondContact O-N 3.34Å; K51-K55 VanDerWaalsContact O-N 3.11Å; D52-K55 PolarHBondContact O-N 3.42Å; D52-K55 IonicContact OD1-NZ 2.67Å; A53-K55 PolarHBondContact O-N 3.17Å; K55-G57 VanDerWaalsContact C-N 3.3Å
56K93.1Very high93.6Very high146 Ų14670.7 Ų70.764%0.63536%0.361SS*.THydrogen-bonded Turntrans-85.2-0.4177.4-65.9172.4-174.9176.80113.1D52 A53 A54 Q58D52-K56 WeakPolarHBondContact O-CG 3.41Å; D52-K56 PolarHBondContact O-N 3.45Å; A53-K56 CarbonylContact O-C 3.58Å; A53-K56 PolarHBondContact O-N 3.07Å; A53-K56 VanDerWaalsContact O-N 3.11Å; A54-K56 PolarHBondContact O-N 3.43Å; K56-Q58 HydrophobicContact CB-CG 3.93Å; K56-Q58 PolarHBondContact O-N 3.18Å
57G89.3Confident93.4Very high52 Ų5273 Ų7354%0.53637%0.369SS..THydrogen-bonded Turntrans69.516-176.800000114.3A53 A54 K55 K59A53-G57 PolarHBondContact O-N 3.09Å; A54-G57 PolarHBondContact O-N 3.25Å; K55-G57 VanDerWaalsContact C-N 3.3Å; G57-K59 PolarHBondContact O-N 3.44Å
58Q93.1Very high93.2Very high88 Ų8872.6 Ų72.641%0.41137%0.369SS..  trans-83.276.1-176.3-65.8175.3-3.900110.9A53 K56 D60 V61 C62A53-Q58 HydrophobicContact CB-CB 4.37Å; A53-Q58 PolarHBondContact O-N 2.96Å; K56-Q58 HydrophobicContact CB-CG 3.93Å; K56-Q58 PolarHBondContact O-N 3.18Å; Q58-D60 PolarHBondContact O-N 3.03Å; Q58-V61 HydrophobicContact CB-CB 4.04Å; Q58-V61 HydrophobicContact CB-CG2 4Å; Q58-V61 PolarHBondContact O-N 2.77Å; Q58-C62 PolarHBondContact O-N 3.13Å; Q58-C62 VanDerWaalsContact O-N 3.11Å; Q58-C62 PolarHBondContact O-SG 3.09Å; Q58-C62 VanDerWaalsContact O-SG 3.33Å
59K90Very high93.2Very high118 Ų11865.4 Ų65.451%0.51334%0.342SS..Hα-helixtrans-60.4-44.2-174.1-67.5-176178.8179.50113.3G57 V61 C62 V63G57-K59 PolarHBondContact O-N 3.44Å; K59-V61 VanDerWaalsContact C-N 3.29Å; K59-V61 PolarHBondContact O-N 3.25Å; K59-C62 WeakPolarHBondContact O-CB 3.4Å; K59-C62 PolarHBondContact O-N 2.95Å; K59-C62 VanDerWaalsContact O-N 3.12Å; K59-V63 WeakPolarHBondContact O-CG2 3.33Å; K59-V63 PolarHBondContact O-N 3.02Å
60D91.9Very high93Very high135 Ų13562.8 Ų62.872%0.72232%0.324SS*.Hα-helixtrans-63.2-38.8-178.5-53.4-38.4000111.7Q58 V63 V64Q58-D60 PolarHBondContact O-N 3.03Å; D60-V63 PolarHBondContact O-N 3.28Å; D60-V64 WeakPolarHBondContact O-CG2 3.42Å; D60-V64 PolarHBondContact O-N 3.07Å; D60-V64 VanDerWaalsContact O-N 3.07Å
61V94.1Very high92.9Very high65 Ų6568.3 Ų68.339%0.39435%0.35SS..Hα-helixtrans-64.8-42.1175.7-179.90000110.7A53 Q58 K59 V63 V64 L65A53-V61 HydrophobicContact CB-CB 4.27Å; A53-V61 HydrophobicContact CB-CG1 3.91Å; Q58-V61 HydrophobicContact CB-CB 4.04Å; Q58-V61 HydrophobicContact CB-CG2 4Å; Q58-V61 PolarHBondContact O-N 2.77Å; K59-V61 VanDerWaalsContact C-N 3.29Å; K59-V61 PolarHBondContact O-N 3.25Å; V61-V63 VanDerWaalsContact C-N 3.34Å; V61-V63 PolarHBondContact O-N 3.22Å; V61-V64 PolarHBondContact O-N 2.93Å; V61-L65 HydrophobicContact CG1-CD1 3.88Å; V61-L65 HydrophobicContact CG1-CG 4.37Å; V61-L65 WeakPolarHBondContact O-CB 3.32Å; V61-L65 VanDerWaalsContact O-CG 3.29Å; V61-L65 WeakPolarHBondContact O-CG 3.32Å; V61-L65 PolarHBondContact O-N 3.46Å
62C93Very high92.9Very high0 Ų064.4 Ų64.40%034%0.335CS..Hα-helixtrans-59.1-45.2174.7-68.80000111.6A54 Q58 K59 L65 A66 L171 L179A54-C62 PolarHBondContact N-SG 2.89Å; A54-C62 VanDerWaalsContact N-SG 3.4Å; Q58-C62 PolarHBondContact O-N 3.13Å; Q58-C62 VanDerWaalsContact O-N 3.11Å; Q58-C62 PolarHBondContact O-SG 3.09Å; Q58-C62 VanDerWaalsContact O-SG 3.33Å; K59-C62 WeakPolarHBondContact O-CB 3.4Å; K59-C62 PolarHBondContact O-N 2.95Å; K59-C62 VanDerWaalsContact O-N 3.12Å; C62-L65 PolarHBondContact O-N 2.9Å; C62-A66 VanDerWaalsContact O-CB 3.27Å; C62-A66 WeakPolarHBondContact O-CB 3.34Å; C62-A66 PolarHBondContact O-N 2.75Å; C62-L171 HydrophobicContact CB-CD1 4.46Å; C62-L171 HydrophobicContact CB-CD2 3.7Å; C62-L179 HydrophobicContact CB-CD1 4.21Å
63V93.1Very high92.8Very high53 Ų5365 Ų6532%0.32133%0.334SS..Hα-helixtrans-60.1-47.6178.9170.20000111.2K59 D60 V61 L65 A66 K67 V167 L171K59-V63 WeakPolarHBondContact O-CG2 3.33Å; K59-V63 PolarHBondContact O-N 3.02Å; D60-V63 PolarHBondContact O-N 3.28Å; V61-V63 VanDerWaalsContact C-N 3.34Å; V61-V63 PolarHBondContact O-N 3.22Å; V63-L65 PolarHBondContact O-N 3.29Å; V63-A66 PolarHBondContact O-N 3.49Å; V63-K67 WeakPolarHBondContact O-CG 3.3Å; V63-K67 PolarHBondContact O-N 3.49Å; V63-V167 HydrophobicContact CG1-CG1 4.25Å; V63-L171 HydrophobicContact CG2-CD1 4.23Å
64V93.9Very high92.7Very high99 Ų9968.5 Ų68.560%0.635%0.345SS*.Hα-helixtrans-61.7-46.8178.6173.90000111.3D60 V61 A66 K67 E68D60-V64 WeakPolarHBondContact O-CG2 3.42Å; D60-V64 PolarHBondContact O-N 3.07Å; D60-V64 VanDerWaalsContact O-N 3.07Å; V61-V64 PolarHBondContact O-N 2.93Å; V64-A66 VanDerWaalsContact C-N 3.29Å; V64-A66 PolarHBondContact O-N 3.37Å; V64-K67 PolarHBondContact O-N 3.25Å; V64-E68 PolarHBondContact O-N 2.98Å
65L94.4Very high92.7Very high39 Ų3969.7 Ų69.720%0.20436%0.355CS..Hα-helixtrans-66.8-30.2178.9-68.4173.5000112.8V46 I50 V61 C62 V63 M69V46-L65 HydrophobicContact CG1-CB 4.21Å; V46-L65 HydrophobicContact CG1-CD2 4.33Å; V46-L65 WeakPolarHBondContact CG1-O 3.46Å; I50-L65 HydrophobicContact CD1-CB 4.03Å; I50-L65 HydrophobicContact CG1-CB 3.44Å; I50-L65 VanDerWaalsContact CG1-CB 3.44Å; I50-L65 HydrophobicContact CG1-CD1 4.05Å; I50-L65 HydrophobicContact CG1-CG 4.4Å; V61-L65 HydrophobicContact CG1-CD1 3.88Å; V61-L65 HydrophobicContact CG1-CG 4.37Å; V61-L65 WeakPolarHBondContact O-CB 3.32Å; V61-L65 VanDerWaalsContact O-CG 3.29Å; V61-L65 WeakPolarHBondContact O-CG 3.32Å; V61-L65 PolarHBondContact O-N 3.46Å; C62-L65 PolarHBondContact O-N 2.9Å; V63-L65 PolarHBondContact O-N 3.29Å; L65-M69 PolarHBondContact O-N 3.46Å
66A93.5Very high92.8Very high0 Ų062.2 Ų62.20%032%0.323CS..Hα-helixtrans-71.3-39.8173.700000111.8C62 V63 V64 E68 M69 I70 V167 I170 L171C62-A66 VanDerWaalsContact O-CB 3.27Å; C62-A66 WeakPolarHBondContact O-CB 3.34Å; C62-A66 PolarHBondContact O-N 2.75Å; V63-A66 PolarHBondContact O-N 3.49Å; V64-A66 VanDerWaalsContact C-N 3.29Å; V64-A66 PolarHBondContact O-N 3.37Å; A66-E68 VanDerWaalsContact C-N 3.3Å; A66-E68 PolarHBondContact O-N 3.24Å; A66-M69 WeakPolarHBondContact O-CB 3.39Å; A66-M69 PolarHBondContact O-N 2.76Å; A66-M69 VanDerWaalsContact O-N 3.17Å; A66-I70 WeakPolarHBondContact O-CG1 3.07Å; A66-I70 PolarHBondContact O-N 3.01Å; A66-I70 VanDerWaalsContact O-N 3.07Å; A66-V167 HydrophobicContact CB-CG1 3.85Å; A66-I170 HydrophobicContact CB-CG2 4.16Å; A66-L171 HydrophobicContact CB-CD1 4.45Å; A66-L171 HydrophobicContact CB-CD2 3.74Å; A66-L171 HydrophobicContact CB-CG 3.79Å
67K93.2Very high92.9Very high60 Ų6059.8 Ų59.826%0.26132%0.321SS..Hα-helixtrans-58.2-42.8170.8-71.5-176.3177-173.90111.2V63 V64 M69 I70 Q71 E161 V167V63-K67 WeakPolarHBondContact O-CG 3.3Å; V63-K67 PolarHBondContact O-N 3.49Å; V64-K67 PolarHBondContact O-N 3.25Å; K67-M69 VanDerWaalsContact C-N 3.33Å; K67-M69 PolarHBondContact O-N 3.28Å; K67-I70 WeakPolarHBondContact O-CB 3.27Å; K67-I70 PolarHBondContact O-N 2.97Å; K67-Q71 WeakPolarHBondContact O-CG 3.47Å; K67-Q71 PolarHBondContact O-N 3.39Å; K67-Q71 VanDerWaalsContact O-N 3.09Å; K67-E161 IonicContact NZ-OE1 3.97Å; K67-E161 PolarHBondContact NZ-OE1 3.01Å; K67-V167 HydrophobicContact CG-CG2 3.87Å
68E92.1Very high93.1Very high91 Ų9160.5 Ų60.543%0.42531%0.309SS..Hα-helixtrans-61.4-38.9175.1-174.562.2-161.700112.8V64 A66 I70 Q71 S72V64-E68 PolarHBondContact O-N 2.98Å; A66-E68 VanDerWaalsContact C-N 3.3Å; A66-E68 PolarHBondContact O-N 3.24Å; E68-I70 VanDerWaalsContact C-N 3.33Å; E68-I70 PolarHBondContact O-N 3.03Å; E68-Q71 PolarHBondContact O-N 3.36Å; E68-S72 WeakPolarHBondContact O-CB 3.5Å; E68-S72 PolarHBondContact O-N 3.21Å; E68-S72 PolarHBondContact O-OG 3.29Å
69M94.4Very high93.2Very high9 Ų956.5 Ų56.54%0.04429%0.291CS..Hα-helixtrans-62.6-39.3174.9-175.664.854.800112E43 V46 K47 I50 L65 A66 K67 S72 K73 I170 I174E43-M69 HydrophobicContact CB-CE 4.12Å; E43-M69 HydrophobicContact CB-SD 3.96Å; E43-M69 HydrophobicContact CG-CE 4.47Å; E43-M69 HydrophobicContact CG-SD 3.87Å; E43-M69 WeakPolarHBondContact O-CE 3.35Å; V46-M69 HydrophobicContact CB-CE 3.82Å; V46-M69 HydrophobicContact CG1-CE 3.67Å; K47-M69 HydrophobicContact CB-CE 4.36Å; I50-M69 HydrophobicContact CD1-CE 4.47Å; L65-M69 PolarHBondContact O-N 3.46Å; A66-M69 WeakPolarHBondContact O-CB 3.39Å; A66-M69 PolarHBondContact O-N 2.76Å; A66-M69 VanDerWaalsContact O-N 3.17Å; K67-M69 VanDerWaalsContact C-N 3.33Å; K67-M69 PolarHBondContact O-N 3.28Å; M69-S72 PolarHBondContact O-N 3.11Å; M69-K73 HydrophobicContact CG-CD 4.39Å; M69-K73 WeakPolarHBondContact O-CG 3.26Å; M69-K73 PolarHBondContact O-N 2.96Å; M69-I170 HydrophobicContact CB-CG2 4.25Å; M69-I170 HydrophobicContact CG-CD1 4.4Å; M69-I170 HydrophobicContact CG-CG2 4.01Å; M69-I174 HydrophobicContact CE-CD1 4.39Å; M69-I174 HydrophobicContact CG-CD1 4.43Å
70I92.6Very high93.5Very high1 Ų156.3 Ų56.31%0.00529%0.287CS..Hα-helixtrans-64.5-47.1177.2-66.2168.9000110A66 K67 E68 S72 K73 R74 A162 E166 V167 I170A66-I70 WeakPolarHBondContact O-CG1 3.07Å; A66-I70 PolarHBondContact O-N 3.01Å; A66-I70 VanDerWaalsContact O-N 3.07Å; K67-I70 WeakPolarHBondContact O-CB 3.27Å; K67-I70 PolarHBondContact O-N 2.97Å; E68-I70 VanDerWaalsContact C-N 3.33Å; E68-I70 PolarHBondContact O-N 3.03Å; I70-S72 VanDerWaalsContact C-N 3.32Å; I70-S72 PolarHBondContact O-N 3.06Å; I70-K73 PolarHBondContact O-N 3.31Å; I70-R74 HydrophobicContact CG2-CG 4.42Å; I70-R74 WeakPolarHBondContact O-CG 3.45Å; I70-R74 PolarHBondContact O-N 2.89Å; I70-A162 HydrophobicContact CB-CB 4.3Å; I70-A162 HydrophobicContact CD1-CB 3.44Å; I70-A162 VanDerWaalsContact CD1-CB 3.44Å; I70-A162 HydrophobicContact CG1-CB 4.42Å; I70-A162 HydrophobicContact CG2-CB 3.99Å; I70-E166 HydrophobicContact CD1-CB 3.98Å; I70-E166 HydrophobicContact CD1-CG 3.72Å; I70-E166 HydrophobicContact CG1-CG 4.15Å; I70-E166 WeakPolarHBondContact CG2-OE1 3.34Å; I70-V167 HydrophobicContact CD1-CB 4.49Å; I70-V167 HydrophobicContact CD1-CG2 3.74Å; I70-I170 HydrophobicContact CB-CD1 4.39Å; I70-I170 HydrophobicContact CD1-CD1 3.82Å; I70-I170 HydrophobicContact CG1-CD1 3.13Å
71Q91Very high93.7Very high116 Ų11652.4 Ų52.454%0.54227%0.274SS..Hα-helixtrans-60-43.5177.8-67.9177.817.200111.5K67 E68 K73 R74 A75K67-Q71 WeakPolarHBondContact O-CG 3.47Å; K67-Q71 PolarHBondContact O-N 3.39Å; K67-Q71 VanDerWaalsContact O-N 3.09Å; E68-Q71 PolarHBondContact O-N 3.36Å; Q71-K73 PolarHBondContact O-N 3.16Å; Q71-R74 PolarHBondContact O-N 3.01Å; Q71-A75 WeakPolarHBondContact O-CB 3.37Å; Q71-A75 PolarHBondContact O-N 3.46Å
72S94.2Very high93.6Very high13 Ų1349.6 Ų49.69%0.09126%0.257CS..Hα-helixtrans-59.5-45.1175.5-63.30000112.2E43 E68 M69 I70 R74 A75 I76E43-S72 VanDerWaalsContact OE1-CB 3.22Å; E43-S72 WeakPolarHBondContact OE1-CB 3.43Å; E68-S72 WeakPolarHBondContact O-CB 3.5Å; E68-S72 PolarHBondContact O-N 3.21Å; E68-S72 PolarHBondContact O-OG 3.29Å; M69-S72 PolarHBondContact O-N 3.11Å; I70-S72 VanDerWaalsContact C-N 3.32Å; I70-S72 PolarHBondContact O-N 3.06Å; S72-R74 PolarHBondContact O-N 3.48Å; S72-A75 PolarHBondContact O-N 3.28Å; S72-I76 WeakPolarHBondContact O-CG1 3.48Å; S72-I76 PolarHBondContact O-N 3.47Å
73K93.5Very high93.8Very high89 Ų8952 Ų5239%0.38727%0.268SS..Hα-helixtrans-62.6-42.7176.4-74.8169.4176.2-76.80112.5E43 M69 I70 Q71 I76 T77 I170E43-K73 PolarHBondContact OE1-N 3.38Å; M69-K73 HydrophobicContact CG-CD 4.39Å; M69-K73 WeakPolarHBondContact O-CG 3.26Å; M69-K73 PolarHBondContact O-N 2.96Å; I70-K73 PolarHBondContact O-N 3.31Å; Q71-K73 PolarHBondContact O-N 3.16Å; K73-I76 PolarHBondContact O-N 2.93Å; K73-T77 WeakPolarHBondContact O-CB 3.48Å; K73-T77 PolarHBondContact O-N 3.28Å; K73-T77 PolarHBondContact O-OG1 2.8Å; K73-I170 HydrophobicContact CD-CD1 4.36Å
74R91.8Very high93.9Very high79 Ų7952 Ų5230%0.29827%0.274SS..Hα-helixtrans-62.7-45175.9-70.1178.3-173.8-168.41110.6I70 Q71 S72 I76 T77 K78 E166I70-R74 HydrophobicContact CG2-CG 4.42Å; I70-R74 WeakPolarHBondContact O-CG 3.45Å; I70-R74 PolarHBondContact O-N 2.89Å; Q71-R74 PolarHBondContact O-N 3.01Å; S72-R74 PolarHBondContact O-N 3.48Å; R74-I76 PolarHBondContact O-N 2.94Å; R74-T77 WeakPolarHBondContact O-CB 3.45Å; R74-T77 PolarHBondContact O-N 3.31Å; R74-K78 PolarHBondContact O-N 3.29Å; R74-E166 IonicContact CZ-OE2 2.63Å; R74-E166 IonicContact NH2-OE2 3.23Å; R74-E166 PolarHBondContact NH2-OE2 3.15Å
75A91.7Very high93.9Very high40 Ų4050.3 Ų50.333%0.33126%0.259SS..Hα-helixtrans-59.9-47.1176.100000112.4I39 Q71 S72 T77 K78 L79I39-A75 HydrophobicContact CD1-CB 4.37Å; Q71-A75 WeakPolarHBondContact O-CB 3.37Å; Q71-A75 PolarHBondContact O-N 3.46Å; S72-A75 PolarHBondContact O-N 3.28Å; A75-T77 VanDerWaalsContact C-N 3.3Å; A75-T77 PolarHBondContact O-N 2.99Å; A75-K78 PolarHBondContact O-N 2.86Å; A75-L79 WeakPolarHBondContact O-CG 3.46Å; A75-L79 PolarHBondContact O-N 3.31Å
76I95.8Very high94.1Very high13 Ų1348.5 Ų48.57%0.06725%0.25CC..Hα-helixtrans-58.8-42.3174.9-71.8169.5000111.2I36 I39 Q40 E43 S72 K73 R74 L79 Y80I36-I76 HydrophobicContact CG2-CG2 4.32Å; I39-I76 HydrophobicContact CB-CD1 4.27Å; I39-I76 HydrophobicContact CB-CG1 4.08Å; I39-I76 HydrophobicContact CD1-CG1 4.42Å; I39-I76 HydrophobicContact CG2-CD1 3.78Å; I39-I76 HydrophobicContact CG2-CG1 3.76Å; Q40-I76 HydrophobicContact CG-CD1 3.69Å; E43-I76 WeakPolarHBondContact OE1-CD1 3.38Å; S72-I76 WeakPolarHBondContact O-CG1 3.48Å; S72-I76 PolarHBondContact O-N 3.47Å; K73-I76 PolarHBondContact O-N 2.93Å; R74-I76 PolarHBondContact O-N 2.94Å; I76-L79 PolarHBondContact O-N 3.4Å; I76-Y80 HydrophobicContact CG2-CD2 3.58Å; I76-Y80 HydrophobicContact CG2-CE2 3.36Å; I76-Y80 VanDerWaalsContact O-CD2 3.26Å; I76-Y80 WeakPolarHBondContact O-CD2 3.42Å; I76-Y80 PolarHBondContact O-N 3.46Å
77T95Very high94.3Very high95 Ų9552.3 Ų52.358%0.58327%0.27SS*.Hα-helixtrans-63-45.1179.5-58.50000111.2K73 R74 A75 L79 Y80 A81K73-T77 WeakPolarHBondContact O-CB 3.48Å; K73-T77 PolarHBondContact O-N 3.28Å; K73-T77 PolarHBondContact O-OG1 2.8Å; R74-T77 WeakPolarHBondContact O-CB 3.45Å; R74-T77 PolarHBondContact O-N 3.31Å; A75-T77 VanDerWaalsContact C-N 3.3Å; A75-T77 PolarHBondContact O-N 2.99Å; T77-L79 PolarHBondContact O-N 3.49Å; T77-Y80 PolarHBondContact O-N 2.93Å; T77-A81 PolarHBondContact O-N 3.5Å
78K92.9Very high94.4Very high67 Ų6751.6 Ų51.629%0.29127%0.273SS..Hα-helixtrans-58.4-47.3174.2-170.3172.8-62.6-1600111.1R74 A75 Y80 A81 S82 I122 D155 E158R74-K78 PolarHBondContact O-N 3.29Å; A75-K78 PolarHBondContact O-N 2.86Å; K78-Y80 PolarHBondContact O-N 2.93Å; K78-A81 WeakPolarHBondContact O-CB 3.4Å; K78-A81 PolarHBondContact O-N 2.93Å; K78-A81 VanDerWaalsContact O-N 3.12Å; K78-S82 PolarHBondContact O-N 3.17Å; K78-S82 PolarHBondContact O-OG 3.46Å; K78-I122 HydrophobicContact CD-CD1 4.22Å; K78-I122 HydrophobicContact CG-CD1 4.01Å; K78-D155 IonicContact NZ-OD1 2.95Å; K78-D155 PolarHBondContact NZ-OD1 3.17Å; K78-D155 VanDerWaalsContact NZ-OD1 3.11Å; K78-E158 WeakPolarHBondContact CE-OE1 3.44Å; K78-E158 IonicContact NZ-OE1 3.01Å; K78-E158 PolarHBondContact NZ-OE1 2.98Å; K78-E158 IonicContact NZ-OE2 3.41Å; K78-E158 PolarHBondContact NZ-OE2 3.37Å
79L94.8Very high94.6Very high5 Ų547.2 Ų47.23%0.02625%0.252CS..Hα-helixtrans-60.7-39.6177.3-72.3174.5000113.2I32 Q35 I36 I39 A75 I76 T77 S82 K83I32-L79 HydrophobicContact CD1-CD2 4.4Å; I32-L79 HydrophobicContact CG2-CB 3.97Å; I32-L79 HydrophobicContact CG2-CD2 4.2Å; I32-L79 WeakPolarHBondContact CG2-O 3.49Å; Q35-L79 HydrophobicContact CB-CD1 4.11Å; I36-L79 HydrophobicContact CD1-CB 4Å; I36-L79 HydrophobicContact CG1-CB 3.74Å; I36-L79 HydrophobicContact CG1-CD1 3.89Å; I36-L79 HydrophobicContact CG1-CG 4.47Å; I39-L79 HydrophobicContact CD1-CD1 3.66Å; A75-L79 WeakPolarHBondContact O-CG 3.46Å; A75-L79 PolarHBondContact O-N 3.31Å; I76-L79 PolarHBondContact O-N 3.4Å; T77-L79 PolarHBondContact O-N 3.49Å; L79-S82 WeakPolarHBondContact O-CB 3.12Å; L79-S82 PolarHBondContact O-N 3.34Å; L79-K83 PolarHBondContact O-N 3.01Å
80Y97.1Very high94.7Very high113 Ų11347.8 Ų47.844%0.44326%0.255SS..Hα-helixtrans-65.2-41173.2-82.5-59.1000112.4I36 I76 T77 K78 S82 K83 A84I36-Y80 HydrophobicContact CD1-CD1 3.87Å; I36-Y80 HydrophobicContact CD1-CD2 4.42Å; I36-Y80 HydrophobicContact CD1-CE1 3.79Å; I36-Y80 HydrophobicContact CD1-CE2 4.36Å; I36-Y80 HydrophobicContact CD1-CG 4.18Å; I36-Y80 HydrophobicContact CG2-CE2 4.2Å; I76-Y80 HydrophobicContact CG2-CD2 3.58Å; I76-Y80 HydrophobicContact CG2-CE2 3.36Å; I76-Y80 VanDerWaalsContact O-CD2 3.26Å; I76-Y80 WeakPolarHBondContact O-CD2 3.42Å; I76-Y80 PolarHBondContact O-N 3.46Å; T77-Y80 PolarHBondContact O-N 2.93Å; K78-Y80 PolarHBondContact O-N 2.93Å; Y80-S82 VanDerWaalsContact C-N 3.34Å; Y80-K83 WeakPolarHBondContact O-CB 3.37Å; Y80-K83 PolarHBondContact O-N 3.01Å; Y80-A84 PolarHBondContact O-N 3.46Å
81A94.8Very high95Very high54 Ų5453.5 Ų53.545%0.44629%0.285SS..Hα-helixtrans-60.6-44.9174.200000110.9T77 K78 K83 A84 Q85T77-A81 PolarHBondContact O-N 3.5Å; K78-A81 WeakPolarHBondContact O-CB 3.4Å; K78-A81 PolarHBondContact O-N 2.93Å; K78-A81 VanDerWaalsContact O-N 3.12Å; A81-K83 VanDerWaalsContact C-N 3.31Å; A81-K83 PolarHBondContact O-N 2.63Å; A81-A84 WeakPolarHBondContact O-CB 3.3Å; A81-A84 PolarHBondContact O-N 2.95Å; A81-A84 VanDerWaalsContact O-N 3.09Å; A81-Q85 WeakPolarHBondContact O-CG 3.29Å; A81-Q85 PolarHBondContact O-N 3.39Å
82S93.6Very high95.1Very high5 Ų548.3 Ų48.34%0.03526%0.262CS..Hα-helixtrans-57.9-42.2173.8-45.50000111.9K78 L79 Y80 A84 Q85 M86 L119 I122K78-S82 PolarHBondContact O-N 3.17Å; K78-S82 PolarHBondContact O-OG 3.46Å; L79-S82 WeakPolarHBondContact O-CB 3.12Å; L79-S82 PolarHBondContact O-N 3.34Å; Y80-S82 VanDerWaalsContact C-N 3.34Å; S82-A84 VanDerWaalsContact C-N 3.32Å; S82-A84 PolarHBondContact O-N 3.09Å; S82-Q85 PolarHBondContact O-N 3.48Å; S82-M86 PolarHBondContact O-N 2.76Å; S82-L119 WeakPolarHBondContact O-CD2 3.43Å; S82-I122 WeakPolarHBondContact OG-CD1 3.21Å; S82-I122 VanDerWaalsContact OG-CG1 3.27Å; S82-I122 WeakPolarHBondContact OG-CG1 3.37Å
83K96.4Very high95.2Very high50 Ų5047.7 Ų47.722%0.21726%0.257CS..Hα-helixtrans-62.2-39.1175.5-170.2179.3-177.4176.80112.3M29 I32 D33 L79 Y80 A81 M86 N87M29-K83 HydrophobicContact CE-CG 3.86Å; I32-K83 HydrophobicContact CG2-CB 4.43Å; D33-K83 WeakPolarHBondContact OD1-CE 3.35Å; D33-K83 IonicContact OD1-NZ 3.32Å; D33-K83 PolarHBondContact OD1-NZ 3.39Å; D33-K83 IonicContact OD2-NZ 2.98Å; D33-K83 PolarHBondContact OD2-NZ 3.06Å; L79-K83 PolarHBondContact O-N 3.01Å; Y80-K83 WeakPolarHBondContact O-CB 3.37Å; Y80-K83 PolarHBondContact O-N 3.01Å; A81-K83 VanDerWaalsContact C-N 3.31Å; A81-K83 PolarHBondContact O-N 2.63Å; K83-M86 PolarHBondContact O-N 3.15Å; K83-N87 PolarHBondContact O-N 3.29Å; K83-N87 PolarHBondContact O-ND2 3.38Å
84A96.3Very high95.3Very high55 Ų5550.6 Ų50.646%0.45527%0.27SS..Hα-helixtrans-63.6-42.4174.600000111.7Y80 A81 S82 M86 N87 S88Y80-A84 PolarHBondContact O-N 3.46Å; A81-A84 WeakPolarHBondContact O-CB 3.3Å; A81-A84 PolarHBondContact O-N 2.95Å; A81-A84 VanDerWaalsContact O-N 3.09Å; S82-A84 VanDerWaalsContact C-N 3.32Å; S82-A84 PolarHBondContact O-N 3.09Å; A84-M86 PolarHBondContact O-N 3.05Å; A84-N87 WeakPolarHBondContact O-CB 3.4Å; A84-N87 PolarHBondContact O-N 3.3Å; A84-S88 PolarHBondContact O-N 3.07Å
85Q94.1Very high95.5Very high63 Ų6351.2 Ų51.229%0.29428%0.279SS..Hα-helixtrans-60.8-44.1174.5-61.6-56.9-3200111.8A81 S82 N87 S88 V89 A115 N118 L119A81-Q85 WeakPolarHBondContact O-CG 3.29Å; A81-Q85 PolarHBondContact O-N 3.39Å; S82-Q85 PolarHBondContact O-N 3.48Å; Q85-N87 VanDerWaalsContact C-N 3.33Å; Q85-N87 PolarHBondContact O-N 3.19Å; Q85-S88 VanDerWaalsContact O-CB 3.31Å; Q85-S88 WeakPolarHBondContact O-CB 3.22Å; Q85-S88 PolarHBondContact O-N 2.94Å; Q85-S88 VanDerWaalsContact O-N 3.14Å; Q85-V89 PolarHBondContact O-N 3.43Å; Q85-A115 HydrophobicContact CB-CB 4.38Å; Q85-N118 HydrophobicContact CG-CB 4.47Å; Q85-L119 HydrophobicContact CB-CD1 4.17Å; Q85-L119 HydrophobicContact CB-CD2 3.93Å; Q85-L119 HydrophobicContact CB-CG 3.9Å
86M96.9Very high95.6Very high0 Ų049.4 Ų49.40%026%0.264CS..Hα-helixtrans-61.1-39174.9-78.2-170.8-77.900113I25 E28 M29 I32 S82 K83 A84 S88 V89 L90 L119 M129I25-M86 HydrophobicContact CG2-CB 3.8Å; I25-M86 HydrophobicContact CG2-CG 3.98Å; I25-M86 HydrophobicContact CG2-SD 4.2Å; E28-M86 HydrophobicContact CB-SD 3.96Å; M29-M86 HydrophobicContact CB-CE 4.29Å; M29-M86 HydrophobicContact CB-SD 4.4Å; M29-M86 HydrophobicContact CG-CB 3.79Å; M29-M86 HydrophobicContact CG-CE 3.71Å; M29-M86 HydrophobicContact CG-CG 4.32Å; M29-M86 HydrophobicContact CG-SD 3.56Å; M29-M86 VanDerWaalsContact CG-SD 3.56Å; M29-M86 HydrophobicContact SD-CB 4.25Å; I32-M86 HydrophobicContact CB-CE 4.34Å; I32-M86 HydrophobicContact CD1-CE 3.2Å; I32-M86 HydrophobicContact CG1-CE 3.77Å; S82-M86 PolarHBondContact O-N 2.76Å; K83-M86 PolarHBondContact O-N 3.15Å; A84-M86 PolarHBondContact O-N 3.05Å; M86-S88 VanDerWaalsContact C-N 3.33Å; M86-V89 PolarHBondContact O-N 3.49Å; M86-L90 WeakPolarHBondContact O-CG 3.31Å; M86-L90 PolarHBondContact O-N 3.23Å; M86-L119 HydrophobicContact CG-CD1 3.75Å; M86-L119 HydrophobicContact CG-CD2 3.71Å; M86-L119 HydrophobicContact CG-CG 4.41Å; M86-M129 HydrophobicContact CG-CE 3.8Å; M86-M129 HydrophobicContact SD-CE 3.46Å; M86-M129 WeakPolarHBondContact SD-CE 3.26Å
87N97.4Very high95.5Very high80 Ų8050.2 Ų50.243%0.42827%0.268SS..Hα-helixtrans-63.4-39.5174.1-81.1-44.8000112.1M29 K83 A84 Q85 L90 L91M29-N87 WeakPolarHBondContact CE-OD1 3.35Å; K83-N87 PolarHBondContact O-N 3.29Å; K83-N87 PolarHBondContact O-ND2 3.38Å; A84-N87 WeakPolarHBondContact O-CB 3.4Å; A84-N87 PolarHBondContact O-N 3.3Å; Q85-N87 VanDerWaalsContact C-N 3.33Å; Q85-N87 PolarHBondContact O-N 3.19Å; N87-L90 PolarHBondContact O-N 2.98Å; N87-L91 PolarHBondContact O-N 3.3Å
88S95.9Very high95.5Very high45 Ų4547.7 Ų47.732%0.31526%0.257SS..Hα-helixtrans-59.1-47.7174-174.50000111.2A84 Q85 M86 L90 L91 S92A84-S88 PolarHBondContact O-N 3.07Å; Q85-S88 VanDerWaalsContact O-CB 3.31Å; Q85-S88 WeakPolarHBondContact O-CB 3.22Å; Q85-S88 PolarHBondContact O-N 2.94Å; Q85-S88 VanDerWaalsContact O-N 3.14Å; M86-S88 VanDerWaalsContact C-N 3.33Å; S88-L90 VanDerWaalsContact C-N 3.34Å; S88-L90 PolarHBondContact O-N 2.94Å; S88-L91 PolarHBondContact O-N 2.97Å; S88-L91 VanDerWaalsContact O-N 3.16Å; S88-S92 PolarHBondContact O-N 2.75Å
89V96.1Very high95.5Very high0 Ų045.3 Ų45.30%025%0.248CC..Hα-helixtrans-60-43.8175.8-178.10000111.1I25 Q85 M86 L91 S92 M93 V112 A115 M116 L119 M136I25-V89 HydrophobicContact CD1-CB 4.16Å; I25-V89 HydrophobicContact CD1-CG1 3.42Å; I25-V89 VanDerWaalsContact CD1-CG1 3.42Å; Q85-V89 PolarHBondContact O-N 3.43Å; M86-V89 PolarHBondContact O-N 3.49Å; V89-L91 VanDerWaalsContact C-N 3.32Å; V89-L91 PolarHBondContact O-N 3.14Å; V89-S92 PolarHBondContact O-N 3.23Å; V89-M93 HydrophobicContact CG1-CE 4.2Å; V89-M93 HydrophobicContact CG1-CG 4.37Å; V89-M93 VanDerWaalsContact O-CG 3.32Å; V89-M93 WeakPolarHBondContact O-CG 3.42Å; V89-M93 PolarHBondContact O-N 2.67Å; V89-V112 HydrophobicContact CG1-CG1 4.23Å; V89-A115 HydrophobicContact CG2-CB 3.58Å; V89-M116 HydrophobicContact CG1-CE 4.38Å; V89-L119 HydrophobicContact CG2-CD1 4.25Å; V89-M136 HydrophobicContact CG1-CE 4.26Å
90L97.7Very high95.5Very high21 Ų2146.3 Ų46.311%0.1125%0.254CS..Hα-helixtrans-61.1-38.2176.7-75.9175.1000113.2I25 R26 M29 M86 N87 S88 M93 K94I25-L90 HydrophobicContact CB-CD2 4.1Å; I25-L90 HydrophobicContact CB-CG 4.41Å; I25-L90 HydrophobicContact CG2-CD1 4.17Å; I25-L90 HydrophobicContact CG2-CD2 4.05Å; I25-L90 HydrophobicContact CG2-CG 3.8Å; R26-L90 HydrophobicContact CG-CD1 3.89Å; R26-L90 HydrophobicContact CG-CD2 4.22Å; M29-L90 HydrophobicContact SD-CD1 3.49Å; M29-L90 WeakPolarHBondContact SD-CD1 3.45Å; M86-L90 WeakPolarHBondContact O-CG 3.31Å; M86-L90 PolarHBondContact O-N 3.23Å; N87-L90 PolarHBondContact O-N 2.98Å; S88-L90 VanDerWaalsContact C-N 3.34Å; S88-L90 PolarHBondContact O-N 2.94Å; L90-M93 PolarHBondContact O-N 3.1Å; L90-K94 PolarHBondContact O-N 2.82Å
91L97.2Very high95.2Very high120 Ų12049.6 Ų49.663%0.62827%0.266SS*.Hα-helixtrans-66.3-43.3175.6-179.259.8000110.8N87 S88 V89 M93 K94 N95N87-L91 PolarHBondContact O-N 3.3Å; S88-L91 PolarHBondContact O-N 2.97Å; S88-L91 VanDerWaalsContact O-N 3.16Å; V89-L91 VanDerWaalsContact C-N 3.32Å; V89-L91 PolarHBondContact O-N 3.14Å; L91-M93 VanDerWaalsContact C-N 3.35Å; L91-M93 PolarHBondContact O-N 2.9Å; L91-K94 WeakPolarHBondContact O-CB 3.38Å; L91-K94 PolarHBondContact O-N 3.07Å; L91-K94 VanDerWaalsContact O-N 3.15Å; L91-N95 PolarHBondContact O-N 2.73Å
92S94.8Very high95.1Very high7 Ų753.4 Ų53.45%0.04928%0.284CS..Hα-helixtrans-64.2-38.9175-174.50000112S88 V89 K94 N95 Q96 S109 V112S88-S92 PolarHBondContact O-N 2.75Å; V89-S92 PolarHBondContact O-N 3.23Å; S92-K94 VanDerWaalsContact C-N 3.31Å; S92-K94 PolarHBondContact O-N 3.18Å; S92-N95 CarbonylContact O-C 3.49Å; S92-N95 WeakPolarHBondContact O-CA 3.44Å; S92-N95 VanDerWaalsContact O-CB 3.3Å; S92-N95 WeakPolarHBondContact O-CB 3.45Å; S92-N95 PolarHBondContact O-N 3Å; S92-Q96 WeakPolarHBondContact O-CG 3.15Å; S92-Q96 PolarHBondContact O-N 2.9Å; S92-S109 PolarHBondContact OG-OG 3.37Å; S92-V112 WeakPolarHBondContact OG-CG2 3.08Å
93M95.3Very high95Very high0 Ų056.3 Ų56.30%031%0.307CS..Hα-helixtrans-58.7-41.7171.6-71.6-50106.900112I18 W21 S22 V89 L90 L91 N95 Q96 L97 V112 M136 I141I18-M93 HydrophobicContact CG2-CB 3.82Å; I18-M93 HydrophobicContact CG2-CG 4.41Å; I18-M93 WeakPolarHBondContact CG2-O 3.43Å; I18-M93 HydrophobicContact CG2-SD 4.24Å; W21-M93 HydrophobicContact CE3-SD 3.87Å; S22-M93 WeakPolarHBondContact OG-CB 3.31Å; V89-M93 HydrophobicContact CG1-CE 4.2Å; V89-M93 HydrophobicContact CG1-CG 4.37Å; V89-M93 VanDerWaalsContact O-CG 3.32Å; V89-M93 WeakPolarHBondContact O-CG 3.42Å; V89-M93 PolarHBondContact O-N 2.67Å; L90-M93 PolarHBondContact O-N 3.1Å; L91-M93 VanDerWaalsContact C-N 3.35Å; L91-M93 PolarHBondContact O-N 2.9Å; M93-N95 VanDerWaalsContact C-N 3.3Å; M93-N95 PolarHBondContact O-N 2.98Å; M93-Q96 PolarHBondContact O-N 3.19Å; M93-L97 PolarHBondContact O-N 3.08Å; M93-L97 VanDerWaalsContact O-N 3.09Å; M93-V112 HydrophobicContact CE-CG1 4.09Å; M93-V112 HydrophobicContact CE-CG2 3.85Å; M93-M136 HydrophobicContact CE-CE 3.88Å; M93-M136 HydrophobicContact CE-SD 4.09Å; M93-M136 HydrophobicContact SD-CE 3.87Å; M93-I141 HydrophobicContact CE-CD1 4.27Å; M93-I141 HydrophobicContact CE-CG2 4.32Å; M93-I141 HydrophobicContact SD-CD1 4.48Å
94K95.9Very high94.6Very high150 Ų15056.6 Ų56.665%0.65233%0.325SS*.Hα-helixtrans-62.3-39173.6-175.7-177.6177.1-176.20111.6L90 L91 S92 L97 A98L90-K94 PolarHBondContact O-N 2.82Å; L91-K94 WeakPolarHBondContact O-CB 3.38Å; L91-K94 PolarHBondContact O-N 3.07Å; L91-K94 VanDerWaalsContact O-N 3.15Å; S92-K94 VanDerWaalsContact C-N 3.31Å; S92-K94 PolarHBondContact O-N 3.18Å; K94-L97 PolarHBondContact O-N 3.39Å; K94-A98 PolarHBondContact O-N 2.97Å
95N95.3Very high94.2Very high92 Ų9256.5 Ų56.549%0.49232%0.324SS..Hα-helixtrans-63.3-45.2173.4-175.249.1000111.5L91 S92 M93 L97 A98 V99L91-N95 PolarHBondContact O-N 2.73Å; S92-N95 CarbonylContact O-C 3.49Å; S92-N95 WeakPolarHBondContact O-CA 3.44Å; S92-N95 VanDerWaalsContact O-CB 3.3Å; S92-N95 WeakPolarHBondContact O-CB 3.45Å; S92-N95 PolarHBondContact O-N 3Å; M93-N95 VanDerWaalsContact C-N 3.3Å; M93-N95 PolarHBondContact O-N 2.98Å; N95-L97 PolarHBondContact O-N 2.89Å; N95-A98 WeakPolarHBondContact O-CA 3.27Å; N95-A98 WeakPolarHBondContact O-CB 3.31Å; N95-A98 PolarHBondContact O-N 3.29Å; N95-V99 WeakPolarHBondContact O-CG2 3.46Å; N95-V99 PolarHBondContact O-N 2.99Å
96Q94.2Very high94.1Very high3 Ų355 Ų551%0.01432%0.318CS..Hα-helixtrans-57.9-35.4176.6-67.5-64.9-23.400112.5I18 S92 M93 A98 V99 V100 L106 Q107 I141I18-Q96 HydrophobicContact CD1-CB 3.7Å; I18-Q96 HydrophobicContact CG1-CB 4.28Å; S92-Q96 WeakPolarHBondContact O-CG 3.15Å; S92-Q96 PolarHBondContact O-N 2.9Å; M93-Q96 PolarHBondContact O-N 3.19Å; Q96-A98 VanDerWaalsContact C-N 3.3Å; Q96-A98 PolarHBondContact O-N 2.9Å; Q96-V99 PolarHBondContact O-N 2.92Å; Q96-V100 WeakPolarHBondContact O-CB 3.33Å; Q96-V100 VanDerWaalsContact O-CG2 3.26Å; Q96-V100 WeakPolarHBondContact O-CG2 3.2Å; Q96-V100 PolarHBondContact O-N 3.24Å; Q96-L106 HydrophobicContact CB-CD2 4.31Å; Q96-Q107 PolarHBondContact NE2-O 3.39Å; Q96-Q107 PolarHBondContact OE1-O 3.02Å; Q96-I141 HydrophobicContact CG-CD1 4.38Å
97L94.3Very high93.9Very high30 Ų3060.1 Ų60.116%0.15734%0.342CS..Hα-helixtrans-62.5-35.6172.6-72.4174.7000112.9K15 I18 M93 K94 N95 R101K15-L97 HydrophobicContact CB-CD2 4.38Å; K15-L97 HydrophobicContact CG-CD2 3.9Å; I18-L97 HydrophobicContact CB-CD2 3.97Å; I18-L97 HydrophobicContact CB-CG 4.33Å; I18-L97 HydrophobicContact CD1-CD2 3.76Å; I18-L97 HydrophobicContact CD1-CG 4.12Å; I18-L97 HydrophobicContact CG2-CD1 4.26Å; I18-L97 HydrophobicContact CG2-CD2 3.91Å; I18-L97 HydrophobicContact CG2-CG 3.73Å; M93-L97 PolarHBondContact O-N 3.08Å; M93-L97 VanDerWaalsContact O-N 3.09Å; K94-L97 PolarHBondContact O-N 3.39Å; N95-L97 PolarHBondContact O-N 2.89Å; L97-R101 WeakPolarHBondContact O-CG 3.25Å; L97-R101 PolarHBondContact O-N 3.32Å
98A94.6Very high93.7Very high42 Ų4262.7 Ų62.735%0.34735%0.349SS..Hα-helixtrans-71.3-44.3175.200000110.8K94 N95 Q96 V100 R101 V102K94-A98 PolarHBondContact O-N 2.97Å; N95-A98 WeakPolarHBondContact O-CA 3.27Å; N95-A98 WeakPolarHBondContact O-CB 3.31Å; N95-A98 PolarHBondContact O-N 3.29Å; Q96-A98 VanDerWaalsContact C-N 3.3Å; Q96-A98 PolarHBondContact O-N 2.9Å; A98-V100 PolarHBondContact O-N 2.69Å; A98-R101 WeakPolarHBondContact O-CB 3.45Å; A98-R101 PolarHBondContact O-N 3.05Å; A98-R101 VanDerWaalsContact O-N 3.13Å; A98-V102 PolarHBondContact O-N 2.93Å
99V93.3Very high93.5Very high17 Ų1761.3 Ų61.310%0.10334%0.34CS..Hα-helixtrans-57.5-47.8175.5174.90000111.1N95 Q96 R101 V102 A103 A105 Q107N95-V99 WeakPolarHBondContact O-CG2 3.46Å; N95-V99 PolarHBondContact O-N 2.99Å; Q96-V99 PolarHBondContact O-N 2.92Å; V99-R101 VanDerWaalsContact C-N 3.26Å; V99-R101 PolarHBondContact O-N 2.95Å; V99-V102 PolarHBondContact O-N 3.38Å; V99-V102 VanDerWaalsContact O-N 3.09Å; V99-A103 HydrophobicContact CG1-CB 4.28Å; V99-A103 WeakPolarHBondContact O-CB 3.19Å; V99-A103 PolarHBondContact O-N 3.11Å; V99-A105 WeakPolarHBondContact CG1-O 3.37Å; V99-Q107 HydrophobicContact CG1-CB 4.12Å; V99-Q107 VanDerWaalsContact CG1-CD 3.49Å; V99-Q107 HydrophobicContact CG1-CG 3.59Å
100V93.5Very high93.2Very high26 Ų2666.2 Ų66.216%0.15837%0.37CS..Hα-helixtrans-60.1-35.3177.6169.20000112P14 I18 Q96 A98 V102 G104 L106P14-V100 HydrophobicContact CB-CG1 4.16Å; P14-V100 HydrophobicContact CB-CG2 3.84Å; I18-V100 HydrophobicContact CD1-CG2 4.12Å; Q96-V100 WeakPolarHBondContact O-CB 3.33Å; Q96-V100 VanDerWaalsContact O-CG2 3.26Å; Q96-V100 WeakPolarHBondContact O-CG2 3.2Å; Q96-V100 PolarHBondContact O-N 3.24Å; A98-V100 PolarHBondContact O-N 2.69Å; V100-V102 VanDerWaalsContact C-N 3.35Å; V100-G104 WeakPolarHBondContact O-CA 3.49Å; V100-G104 PolarHBondContact O-N 2.92Å; V100-L106 HydrophobicContact CG2-CD2 3.68Å; V100-L106 HydrophobicContact CG2-CG 4.35Å
101R91.4Very high92.9Very high181 Ų18171.4 Ų71.468%0.68339%0.393SS*.Hα-helixtrans-68.6-33.3177.1-73.2178.9-163.8116.4-2.1113L97 A98 V99L97-R101 WeakPolarHBondContact O-CG 3.25Å; L97-R101 PolarHBondContact O-N 3.32Å; A98-R101 WeakPolarHBondContact O-CB 3.45Å; A98-R101 PolarHBondContact O-N 3.05Å; A98-R101 VanDerWaalsContact O-N 3.13Å; V99-R101 VanDerWaalsContact C-N 3.26Å; V99-R101 PolarHBondContact O-N 2.95Å
102V93.8Very high92.7Very high135 Ų13565.7 Ų65.782%0.81836%0.364SS*.Hα-helixtrans-93-50-174.7177.10000111.3A98 V99 V100A98-V102 PolarHBondContact O-N 2.93Å; V99-V102 PolarHBondContact O-N 3.38Å; V99-V102 VanDerWaalsContact O-N 3.09Å; V100-V102 VanDerWaalsContact C-N 3.35Å
103A91.1Very high92.6Very high65 Ų6567.6 Ų67.654%0.53737%0.372SS..Hα-helixtrans-96.3-12-174.700000113.6V99 A105V99-A103 HydrophobicContact CG1-CB 4.28Å; V99-A103 WeakPolarHBondContact O-CB 3.19Å; V99-A103 PolarHBondContact O-N 3.11Å; A103-A105 PolarHBondContact O-N 3.3Å
104G88.2Confident92.4Very high57 Ų5774.7 Ų74.759%0.58840%0.403SS*.SBendtrans74.7-4179.900000115.3V100V100-G104 WeakPolarHBondContact O-CA 3.49Å; V100-G104 PolarHBondContact O-N 2.92Å
105A87.9Confident92.3Very high53 Ų5367.6 Ų67.644%0.43837%0.373SS..SBendtrans-134.7161.8-17500000112V99 A103V99-A105 WeakPolarHBondContact CG1-O 3.37Å; A103-A105 PolarHBondContact O-N 3.3Å
106L91.3Very high92.2Very high32 Ų3263.3 Ų63.317%0.16835%0.349CS..  trans-75.9148.5169.1-65.7171.8000110P14 I18 W21 Q96 V100 A139 I141P14-L106 HydrophobicContact CB-CD1 4.22Å; P14-L106 HydrophobicContact CB-CD2 4.02Å; P14-L106 HydrophobicContact CB-CG 3.91Å; P14-L106 HydrophobicContact CG-CG 4.47Å; I18-L106 HydrophobicContact CD1-CD2 3.64Å; I18-L106 HydrophobicContact CG1-CD2 4.02Å; W21-L106 HydrophobicContact CH2-CD1 4.4Å; Q96-L106 HydrophobicContact CB-CD2 4.31Å; V100-L106 HydrophobicContact CG2-CD2 3.68Å; V100-L106 HydrophobicContact CG2-CG 4.35Å; L106-A139 HydrophobicContact CD1-CB 3.82Å; L106-A139 WeakPolarHBondContact CD1-O 3.45Å; L106-I141 HydrophobicContact CB-CG1 4.07Å; L106-I141 HydrophobicContact CD1-CD1 4.08Å; L106-I141 HydrophobicContact CD1-CG1 4.06Å; L106-I141 HydrophobicContact CD2-CD1 4.03Å; L106-I141 HydrophobicContact CD2-CG1 4.34Å; L106-I141 HydrophobicContact CG-CD1 4.48Å; L106-I141 HydrophobicContact CG-CG1 4.38Å
107Q92.3Very high92Very high106 Ų10665.6 Ų65.650%0.49536%0.36SS..  trans-114.8149.2174-78.5-178.5-40.300111.2Q96 V99Q96-Q107 PolarHBondContact NE2-O 3.39Å; Q96-Q107 PolarHBondContact OE1-O 3.02Å; V99-Q107 HydrophobicContact CG1-CB 4.12Å; V99-Q107 VanDerWaalsContact CG1-CD 3.49Å; V99-Q107 HydrophobicContact CG1-CG 3.59Å
108K93.6Very high91.8Very high135 Ų13566.6 Ų66.659%0.58737%0.366SS*.  trans-62142.5172.6-67.3172.3166.3-166.70110.9G140 I141 E143K108-G140 WeakPolarHBondContact CG-O 3.22Å; K108-I141 CarbonylContact C-O 3.55Å; K108-I141 VanDerWaalsContact CA-O 3.28Å; K108-I141 WeakPolarHBondContact CA-O 3.36Å; K108-E143 HydrophobicContact CD-CG 3.83Å; K108-E143 VanDerWaalsContact CD-OE1 3.25Å; K108-E143 WeakPolarHBondContact CD-OE1 3.41Å; K108-E143 WeakPolarHBondContact CE-OE1 3.31Å; K108-E143 HydrophobicContact CG-CG 4.32Å; K108-E143 IonicContact NZ-OE1 2.71Å; K108-E143 PolarHBondContact NZ-OE1 2.99Å
109S92.6Very high91.7Very high16 Ų1664.7 Ų64.711%0.11235%0.35CS..  trans-138.7106.4179.1-177.60000110.5S92 E111 V112 M113 I141S92-S109 PolarHBondContact OG-OG 3.37Å; S109-E111 PolarHBondContact O-N 3.22Å; S109-V112 PolarHBondContact O-N 3.21Å; S109-V112 WeakPolarHBondContact OG-CG2 3.45Å; S109-V112 PolarHBondContact OG-N 2.95Å; S109-M113 PolarHBondContact O-N 3.22Å; S109-M113 VanDerWaalsContact O-N 3.07Å; S109-I141 PolarHBondContact N-O 2.95Å
110T90.1Very high91.5Very high103 Ų10364.9 Ų64.963%0.63235%0.351SS*.Hα-helixtrans-64.6-30.3174.654.60000111.9M113 K114T110-M113 WeakPolarHBondContact O-CB 3.34Å; T110-M113 PolarHBondContact O-N 3.42Å; T110-K114 WeakPolarHBondContact O-CB 3.48Å; T110-K114 PolarHBondContact O-N 3.39Å
111E91.1Very high91.3Very high129 Ų12967.7 Ų67.760%0.60336%0.361SS*.Hα-helixtrans-63.8-45.8173.9-64.8-177.5168.800111.9S109 M113 K114 A115S109-E111 PolarHBondContact O-N 3.22Å; E111-M113 VanDerWaalsContact C-N 3.33Å; E111-K114 PolarHBondContact O-N 2.89Å; E111-A115 VanDerWaalsContact O-CB 3.31Å; E111-A115 WeakPolarHBondContact O-CB 3.39Å; E111-A115 PolarHBondContact O-N 3.37Å
112V92.9Very high91.2Very high1 Ų159.8 Ų59.81%0.00633%0.332CS..Hα-helixtrans-64-42.8176.1172.40000110.4V89 S92 M93 S109 A115 M116 M136 I141 I142V89-V112 HydrophobicContact CG1-CG1 4.23Å; S92-V112 WeakPolarHBondContact OG-CG2 3.08Å; M93-V112 HydrophobicContact CE-CG1 4.09Å; M93-V112 HydrophobicContact CE-CG2 3.85Å; S109-V112 PolarHBondContact O-N 3.21Å; S109-V112 WeakPolarHBondContact OG-CG2 3.45Å; S109-V112 PolarHBondContact OG-N 2.95Å; V112-A115 PolarHBondContact O-N 2.96Å; V112-M116 WeakPolarHBondContact O-CB 3.24Å; V112-M116 PolarHBondContact O-N 3.48Å; V112-M136 HydrophobicContact CG1-SD 3.72Å; V112-I141 HydrophobicContact CB-CG2 4.34Å; V112-I141 HydrophobicContact CG1-CG2 4.14Å; V112-I142 HydrophobicContact CG1-CD1 3.96Å; V112-I142 HydrophobicContact CG1-CG1 3.97Å
113M92.2Very high90.9Very high47 Ų4757.9 Ų57.923%0.23232%0.323CS..Hα-helixtrans-57.1-52.1176.6178.3-176.1-175.700111.4S109 T110 E111 M116 Q117 I142 M145S109-M113 PolarHBondContact O-N 3.22Å; S109-M113 VanDerWaalsContact O-N 3.07Å; T110-M113 WeakPolarHBondContact O-CB 3.34Å; T110-M113 PolarHBondContact O-N 3.42Å; E111-M113 VanDerWaalsContact C-N 3.33Å; M113-M116 PolarHBondContact O-N 2.97Å; M113-Q117 WeakPolarHBondContact O-CB 3.1Å; M113-Q117 PolarHBondContact O-N 3.34Å; M113-I142 HydrophobicContact CB-CG2 4.01Å; M113-I142 HydrophobicContact CG-CG2 3.9Å; M113-M145 HydrophobicContact CE-CB 4.42Å; M113-M145 HydrophobicContact CE-CG 3.38Å; M113-M145 HydrophobicContact CE-SD 4.45Å
114K92Very high90.8Very high149 Ų14958.4 Ų58.465%0.64831%0.314SS*.Hα-helixtrans-63.7-44.6179.7-174.1176.2-178.9176.50112.2T110 E111 M116 Q117 N118T110-K114 WeakPolarHBondContact O-CB 3.48Å; T110-K114 PolarHBondContact O-N 3.39Å; E111-K114 PolarHBondContact O-N 2.89Å; K114-M116 VanDerWaalsContact C-N 3.34Å; K114-M116 PolarHBondContact O-N 3.41Å; K114-Q117 PolarHBondContact O-N 3.25Å; K114-N118 PolarHBondContact O-N 3.09Å; K114-N118 VanDerWaalsContact O-N 3.15Å
115A92.6Very high91Very high1 Ų155.8 Ų55.81%0.00829%0.287CS..Hα-helixtrans-63-42.6178.400000111.3Q85 V89 E111 V112 Q117 N118 L119Q85-A115 HydrophobicContact CB-CB 4.38Å; V89-A115 HydrophobicContact CG2-CB 3.58Å; E111-A115 VanDerWaalsContact O-CB 3.31Å; E111-A115 WeakPolarHBondContact O-CB 3.39Å; E111-A115 PolarHBondContact O-N 3.37Å; V112-A115 PolarHBondContact O-N 2.96Å; A115-Q117 PolarHBondContact O-N 3.12Å; A115-N118 PolarHBondContact O-N 2.99Å; A115-L119 WeakPolarHBondContact O-CB 3.49Å; A115-L119 WeakPolarHBondContact O-CG 3.49Å; A115-L119 PolarHBondContact O-N 3.43Å
116M92.6Very high91.2Very high1 Ų157.5 Ų57.51%0.00529%0.286CS..Hα-helixtrans-65-39.2177.4-163.961.872.200111.8V89 V112 M113 K114 N118 L119 V120 M129 L132 M136 I142V89-M116 HydrophobicContact CG1-CE 4.38Å; V112-M116 WeakPolarHBondContact O-CB 3.24Å; V112-M116 PolarHBondContact O-N 3.48Å; M113-M116 PolarHBondContact O-N 2.97Å; K114-M116 VanDerWaalsContact C-N 3.34Å; K114-M116 PolarHBondContact O-N 3.41Å; M116-N118 VanDerWaalsContact C-N 3.29Å; M116-N118 PolarHBondContact O-N 3.31Å; M116-L119 PolarHBondContact O-N 3.1Å; M116-L119 VanDerWaalsContact O-N 3.11Å; M116-V120 WeakPolarHBondContact O-CG1 3.35Å; M116-V120 PolarHBondContact O-N 3.45Å; M116-M129 HydrophobicContact CE-SD 4.31Å; M116-M129 HydrophobicContact SD-CB 3.74Å; M116-M129 HydrophobicContact SD-CG 4.28Å; M116-M129 VanDerWaalsContact SD-O 3.33Å; M116-M129 HydrophobicContact SD-SD 3.7Å; M116-L132 HydrophobicContact CE-CB 4.02Å; M116-L132 HydrophobicContact SD-CB 4.47Å; M116-M136 HydrophobicContact CE-CE 4.15Å; M116-M136 HydrophobicContact CE-SD 3.89Å; M116-I142 HydrophobicContact CB-CD1 4.27Å; M116-I142 HydrophobicContact CG-CD1 4.38Å
117Q90.8Very high91.3Very high52 Ų5259.7 Ų59.724%0.24331%0.308CS..Hα-helixtrans-61.8-36.1176-17754.433.300112.8M113 K114 A115 V120 M145M113-Q117 WeakPolarHBondContact O-CB 3.1Å; M113-Q117 PolarHBondContact O-N 3.34Å; K114-Q117 PolarHBondContact O-N 3.25Å; A115-Q117 PolarHBondContact O-N 3.12Å; Q117-V120 WeakPolarHBondContact O-CG2 3.46Å; Q117-M145 HydrophobicContact CG-CE 4.13Å; Q117-M145 PolarHBondContact OE1-SD 3.26Å
118N90.7Very high91.4Very high51 Ų5156.5 Ų56.527%0.27330%0.296SS..Hα-helixtrans-73.6-35.1174.2-69.9-22.5000111.8Q85 K114 A115 M116 K121Q85-N118 HydrophobicContact CG-CB 4.47Å; K114-N118 PolarHBondContact O-N 3.09Å; K114-N118 VanDerWaalsContact O-N 3.15Å; A115-N118 PolarHBondContact O-N 2.99Å; M116-N118 VanDerWaalsContact C-N 3.29Å; M116-N118 PolarHBondContact O-N 3.31Å; N118-K121 WeakPolarHBondContact O-CB 3.5Å; N118-K121 PolarHBondContact O-N 2.78Å
119L90.9Very high91.4Very high1 Ų150.1 Ų50.11%0.00527%0.268CS..Hα-helixtrans-71.2-30.4-179.1-72.8169.5000113.6S82 Q85 M86 V89 A115 M116 K121 I122 M129S82-L119 WeakPolarHBondContact O-CD2 3.43Å; Q85-L119 HydrophobicContact CB-CD1 4.17Å; Q85-L119 HydrophobicContact CB-CD2 3.93Å; Q85-L119 HydrophobicContact CB-CG 3.9Å; M86-L119 HydrophobicContact CG-CD1 3.75Å; M86-L119 HydrophobicContact CG-CD2 3.71Å; M86-L119 HydrophobicContact CG-CG 4.41Å; V89-L119 HydrophobicContact CG2-CD1 4.25Å; A115-L119 WeakPolarHBondContact O-CB 3.49Å; A115-L119 WeakPolarHBondContact O-CG 3.49Å; A115-L119 PolarHBondContact O-N 3.43Å; M116-L119 PolarHBondContact O-N 3.1Å; M116-L119 VanDerWaalsContact O-N 3.11Å; L119-K121 PolarHBondContact O-N 3.41Å; L119-I122 WeakPolarHBondContact O-CB 3.46Å; L119-I122 PolarHBondContact O-N 2.82Å; L119-M129 HydrophobicContact CB-CB 4.16Å; L119-M129 HydrophobicContact CB-CG 3.86Å; L119-M129 HydrophobicContact CB-SD 4.15Å; L119-M129 HydrophobicContact CD1-CE 4.45Å; L119-M129 HydrophobicContact CD1-SD 3.94Å
120V91.1Very high91.5Very high22 Ų2254.5 Ų54.513%0.13329%0.288CS..THydrogen-bonded Turntrans-68.3-15.2175.3-65.30000113.3M116 Q117 I122 Q126 M129 M130M116-V120 WeakPolarHBondContact O-CG1 3.35Å; M116-V120 PolarHBondContact O-N 3.45Å; Q117-V120 WeakPolarHBondContact O-CG2 3.46Å; V120-I122 VanDerWaalsContact C-N 3.29Å; V120-Q126 VanDerWaalsContact O-CG 3.22Å; V120-Q126 WeakPolarHBondContact O-CG 3.43Å; V120-M129 HydrophobicContact CG1-CB 3.98Å; V120-M130 HydrophobicContact CG1-CB 4.29Å
121K87.8Confident91.7Very high85 Ų8554.5 Ų54.537%0.3728%0.281SS..THydrogen-bonded Turntrans-81.2-9.3174.9-59.2179.2-179.4-178.50113.1N118 L119 P123N118-K121 WeakPolarHBondContact O-CB 3.5Å; N118-K121 PolarHBondContact O-N 2.78Å; L119-K121 PolarHBondContact O-N 3.41Å; K121-P123 WeakPolarHBondContact O-CD 3.5Å
122I89.3Confident91.8Very high14 Ų1448.4 Ų48.47%0.07225%0.253CS..  trans-93.5108.6-174.1-54.1-59.8000108.8K78 S82 L119 V120 E124 V125 Q126K78-I122 HydrophobicContact CD-CD1 4.22Å; K78-I122 HydrophobicContact CG-CD1 4.01Å; S82-I122 WeakPolarHBondContact OG-CD1 3.21Å; S82-I122 VanDerWaalsContact OG-CG1 3.27Å; S82-I122 WeakPolarHBondContact OG-CG1 3.37Å; L119-I122 WeakPolarHBondContact O-CB 3.46Å; L119-I122 PolarHBondContact O-N 2.82Å; V120-I122 VanDerWaalsContact C-N 3.29Å; I122-E124 WeakPolarHBondContact CG2-OE2 3.47Å; I122-E124 PolarHBondContact O-N 3.18Å; I122-V125 HydrophobicContact CB-CG2 3.77Å; I122-V125 HydrophobicContact CG2-CG2 3.88Å; I122-V125 PolarHBondContact O-N 3.26Å; I122-Q126 WeakPolarHBondContact O-CA 3.32Å; I122-Q126 VanDerWaalsContact O-CB 3.31Å; I122-Q126 WeakPolarHBondContact O-CB 3.31Å; I122-Q126 PolarHBondContact O-N 3.33Å
123P88.9Confident91.8Very high96 Ų9649.2 Ų49.262%0.62326%0.258SS*.THydrogen-bonded Turntrans-52.8-35.2-170.8-28.235.4000113.9K121 V125K121-P123 WeakPolarHBondContact O-CD 3.5Å; P123-V125 VanDerWaalsContact C-N 3.29Å; P123-V125 PolarHBondContact O-N 2.94Å
124E88.8Confident91.8Very high76 Ų7653.4 Ų53.436%0.35528%0.275SS..THydrogen-bonded Turntrans-71.2-23.8-173.6-56.690.316500113.5I122I122-E124 WeakPolarHBondContact CG2-OE2 3.47Å; I122-E124 PolarHBondContact O-N 3.18Å
125V92.3Very high91.9Very high2 Ų248.8 Ų48.81%0.01226%0.256CS..THydrogen-bonded Turntrans-124.7-4.5-179.4-58.80000113.1E28 I32 I122 P123 A127 T128 M129E28-V125 HydrophobicContact CB-CB 4.44Å; E28-V125 HydrophobicContact CB-CG1 3.83Å; E28-V125 HydrophobicContact CG-CG1 4.41Å; I32-V125 HydrophobicContact CD1-CG1 4.09Å; I32-V125 HydrophobicContact CG1-CG1 3.96Å; I122-V125 HydrophobicContact CB-CG2 3.77Å; I122-V125 HydrophobicContact CG2-CG2 3.88Å; I122-V125 PolarHBondContact O-N 3.26Å; P123-V125 VanDerWaalsContact C-N 3.29Å; P123-V125 PolarHBondContact O-N 2.94Å; V125-A127 PolarHBondContact O-N 3.38Å; V125-T128 PolarHBondContact O-N 3.42Å; V125-T128 VanDerWaalsContact O-N 3.1Å; V125-T128 PolarHBondContact O-OG1 2.9Å; V125-M129 HydrophobicContact CB-CE 4.15Å; V125-M129 HydrophobicContact CB-CG 3.98Å; V125-M129 HydrophobicContact CG2-CE 4.33Å; V125-M129 HydrophobicContact CG2-CG 3.83Å; V125-M129 VanDerWaalsContact O-CG 3.31Å; V125-M129 WeakPolarHBondContact O-CG 3.4Å; V125-M129 PolarHBondContact O-N 3.32Å
126Q91.6Very high91.9Very high89 Ų8948.7 Ų48.742%0.41626%0.256SS..Hα-helixtrans-47-54.2-172.2171174.333.100113.3V120 I122 T128 M129 M130V120-Q126 VanDerWaalsContact O-CG 3.22Å; V120-Q126 WeakPolarHBondContact O-CG 3.43Å; I122-Q126 WeakPolarHBondContact O-CA 3.32Å; I122-Q126 VanDerWaalsContact O-CB 3.31Å; I122-Q126 WeakPolarHBondContact O-CB 3.31Å; I122-Q126 PolarHBondContact O-N 3.33Å; Q126-T128 VanDerWaalsContact C-N 3.33Å; Q126-T128 PolarHBondContact O-N 3.24Å; Q126-M129 PolarHBondContact O-N 3.11Å; Q126-M130 WeakPolarHBondContact O-CB 3.27Å; Q126-M130 PolarHBondContact O-N 2.98Å
127A93.2Very high91.9Very high78 Ų7851.3 Ų51.365%0.64527%0.268SS*.Hα-helixtrans-59.2-45.5-176.300000111.8V125 M130 E131V125-A127 PolarHBondContact O-N 3.38Å; A127-M130 PolarHBondContact O-N 3.48Å; A127-E131 PolarHBondContact O-N 2.98Å; A127-E131 VanDerWaalsContact O-N 3.14Å
128T94.2Very high91.9Very high39 Ų3957 Ų5724%0.23929%0.292CS..Hα-helixtrans-69.7-38-17966.30000112.3E28 V125 Q126 E131 L132E28-T128 HydrophobicContact CG-CG2 4.35Å; E28-T128 WeakPolarHBondContact CG-OG1 3.34Å; V125-T128 PolarHBondContact O-N 3.42Å; V125-T128 VanDerWaalsContact O-N 3.1Å; V125-T128 PolarHBondContact O-OG1 2.9Å; Q126-T128 VanDerWaalsContact C-N 3.33Å; Q126-T128 PolarHBondContact O-N 3.24Å; T128-E131 PolarHBondContact O-N 3.29Å; T128-L132 WeakPolarHBondContact O-CB 3.38Å; T128-L132 VanDerWaalsContact O-CG 3.29Å; T128-L132 WeakPolarHBondContact O-CG 3.37Å; T128-L132 PolarHBondContact O-N 3.22Å
129M94.7Very high91.9Very high0 Ų055.9 Ų55.90%029%0.29CS..Hα-helixtrans-72.2-33.5179.7-64.8-65.4168.400111.2E28 M86 M116 L119 V120 V125 Q126 L132 S133E28-M129 HydrophobicContact CB-CE 3.82Å; E28-M129 HydrophobicContact CG-CE 4.05Å; M86-M129 HydrophobicContact CG-CE 3.8Å; M86-M129 HydrophobicContact SD-CE 3.46Å; M86-M129 WeakPolarHBondContact SD-CE 3.26Å; M116-M129 HydrophobicContact CE-SD 4.31Å; M116-M129 HydrophobicContact SD-CB 3.74Å; M116-M129 HydrophobicContact SD-CG 4.28Å; M116-M129 VanDerWaalsContact SD-O 3.33Å; M116-M129 HydrophobicContact SD-SD 3.7Å; L119-M129 HydrophobicContact CB-CB 4.16Å; L119-M129 HydrophobicContact CB-CG 3.86Å; L119-M129 HydrophobicContact CB-SD 4.15Å; L119-M129 HydrophobicContact CD1-CE 4.45Å; L119-M129 HydrophobicContact CD1-SD 3.94Å; V120-M129 HydrophobicContact CG1-CB 3.98Å; V125-M129 HydrophobicContact CB-CE 4.15Å; V125-M129 HydrophobicContact CB-CG 3.98Å; V125-M129 HydrophobicContact CG2-CE 4.33Å; V125-M129 HydrophobicContact CG2-CG 3.83Å; V125-M129 VanDerWaalsContact O-CG 3.31Å; V125-M129 WeakPolarHBondContact O-CG 3.4Å; V125-M129 PolarHBondContact O-N 3.32Å; Q126-M129 PolarHBondContact O-N 3.11Å; M129-L132 HydrophobicContact SD-CD1 4.12Å; M129-S133 VanDerWaalsContact O-CB 3.24Å; M129-S133 WeakPolarHBondContact O-CB 3.41Å; M129-S133 PolarHBondContact O-N 3.15Å
130M93.6Very high91.8Very high109 Ų10957.3 Ų57.354%0.53731%0.305SS..Hα-helixtrans-66.6-42.5173.5-171.4-177.9-6700111.8V120 Q126 A127 S133 K134V120-M130 HydrophobicContact CG1-CB 4.29Å; Q126-M130 WeakPolarHBondContact O-CB 3.27Å; Q126-M130 PolarHBondContact O-N 2.98Å; A127-M130 PolarHBondContact O-N 3.48Å; M130-S133 PolarHBondContact O-N 3.02Å; M130-K134 PolarHBondContact O-N 3.37Å; M130-K134 VanDerWaalsContact O-N 3.1Å
131E94.4Very high91.8Very high103 Ų10356.3 Ų56.348%0.48130%0.299SS..Hα-helixtrans-62.6-49.3174.2-173.7-172.8168.500111.3K24 A127 T128 S133 K134 E135K24-E131 IonicContact NZ-OE1 2.73Å; A127-E131 PolarHBondContact O-N 2.98Å; A127-E131 VanDerWaalsContact O-N 3.14Å; T128-E131 PolarHBondContact O-N 3.29Å; E131-S133 VanDerWaalsContact C-N 3.32Å; E131-S133 PolarHBondContact O-N 3.49Å; E131-K134 PolarHBondContact O-N 3.5Å; E131-E135 PolarHBondContact O-N 3.15Å
132L93.7Very high92Very high1 Ų152.5 Ų52.51%0.00528%0.283CS..Hα-helixtrans-58.8-42.3176.3-76.6175.5000112.1W21 K24 I25 M116 T128 M129 K134 E135 M136W21-L132 HydrophobicContact CB-CD2 4.04Å; W21-L132 HydrophobicContact CG-CD2 3.92Å; K24-L132 HydrophobicContact CB-CD1 4.19Å; K24-L132 HydrophobicContact CB-CD2 4.17Å; K24-L132 HydrophobicContact CD-CD2 3.62Å; K24-L132 HydrophobicContact CD-CG 4.37Å; I25-L132 HydrophobicContact CD1-CD1 4.49Å; I25-L132 HydrophobicContact CG1-CD1 3.73Å; M116-L132 HydrophobicContact CE-CB 4.02Å; M116-L132 HydrophobicContact SD-CB 4.47Å; T128-L132 WeakPolarHBondContact O-CB 3.38Å; T128-L132 VanDerWaalsContact O-CG 3.29Å; T128-L132 WeakPolarHBondContact O-CG 3.37Å; T128-L132 PolarHBondContact O-N 3.22Å; M129-L132 HydrophobicContact SD-CD1 4.12Å; L132-K134 VanDerWaalsContact C-N 3.33Å; L132-K134 PolarHBondContact O-N 2.68Å; L132-E135 PolarHBondContact O-N 3.28Å; L132-M136 WeakPolarHBondContact O-CB 3.35Å; L132-M136 VanDerWaalsContact O-CG 3.27Å; L132-M136 WeakPolarHBondContact O-CG 3.48Å; L132-M136 PolarHBondContact O-N 3.34Å
133S92.5Very high91.8Very high18 Ų1856 Ų5613%0.12630%0.299CS..Hα-helixtrans-57.6-46.9176.2-171.20000111.1M129 M130 E131 M136 M137M129-S133 VanDerWaalsContact O-CB 3.24Å; M129-S133 WeakPolarHBondContact O-CB 3.41Å; M129-S133 PolarHBondContact O-N 3.15Å; M130-S133 PolarHBondContact O-N 3.02Å; E131-S133 VanDerWaalsContact C-N 3.32Å; E131-S133 PolarHBondContact O-N 3.49Å; S133-M136 PolarHBondContact O-N 3.04Å; S133-M137 VanDerWaalsContact O-CB 3.26Å; S133-M137 WeakPolarHBondContact O-CB 3.21Å; S133-M137 PolarHBondContact O-N 3.48Å
134K93Very high91.1Very high135 Ų13559.3 Ų59.359%0.58731%0.306SS*.Hα-helixtrans-64.5-40.7177.2-179.6174.8-80.3175.60112.4M130 E131 L132 K138M130-K134 PolarHBondContact O-N 3.37Å; M130-K134 VanDerWaalsContact O-N 3.1Å; E131-K134 PolarHBondContact O-N 3.5Å; L132-K134 VanDerWaalsContact C-N 3.33Å; L132-K134 PolarHBondContact O-N 2.68Å; K134-K138 WeakPolarHBondContact O-CG 3.49Å; K134-K138 PolarHBondContact O-N 3.38Å; K134-K138 VanDerWaalsContact O-N 3.08Å
135E93Very high89.8Confident51 Ų5158.5 Ų58.524%0.23830%0.303CS..Hα-helixtrans-64-45.7175.3-71.5-179.8175.400111.7W21 K24 E131 L132 M137 K138 A139W21-E135 HydrophobicContact CZ2-CB 4.2Å; W21-E135 PolarHBondContact NE1-OE2 3.4Å; K24-E135 IonicContact NZ-OE1 2.76Å; K24-E135 PolarHBondContact NZ-OE1 3.34Å; K24-E135 IonicContact NZ-OE2 3.28Å; K24-E135 PolarHBondContact NZ-OE2 3.4Å; E131-E135 PolarHBondContact O-N 3.15Å; L132-E135 PolarHBondContact O-N 3.28Å; E135-M137 VanDerWaalsContact C-N 3.34Å; E135-M137 PolarHBondContact O-N 2.96Å; E135-K138 PolarHBondContact O-N 2.83Å; E135-A139 WeakPolarHBondContact O-CB 3.43Å; E135-A139 PolarHBondContact O-N 3.21Å
136M92.5Very high87.8Confident0 Ų065.5 Ų65.50%034%0.339CS..Hα-helixtrans-68.2-32179.1-71.8-177.1-175.600112.7W21 I25 V89 M93 V112 M116 L132 S133 A139 G140 I141 I142W21-M136 HydrophobicContact CB-CE 3.74Å; W21-M136 HydrophobicContact CD2-CE 3.98Å; W21-M136 HydrophobicContact CD2-CG 4.05Å; W21-M136 HydrophobicContact CE3-CE 4.07Å; W21-M136 HydrophobicContact CE3-CG 4.09Å; W21-M136 HydrophobicContact CG-CE 3.87Å; W21-M136 HydrophobicContact CH2-CG 4.37Å; W21-M136 HydrophobicContact CZ2-CG 4.28Å; W21-M136 HydrophobicContact CZ3-CG 4.3Å; I25-M136 HydrophobicContact CD1-CE 4.25Å; V89-M136 HydrophobicContact CG1-CE 4.26Å; M93-M136 HydrophobicContact CE-CE 3.88Å; M93-M136 HydrophobicContact CE-SD 4.09Å; M93-M136 HydrophobicContact SD-CE 3.87Å; V112-M136 HydrophobicContact CG1-SD 3.72Å; M116-M136 HydrophobicContact CE-CE 4.15Å; M116-M136 HydrophobicContact CE-SD 3.89Å; L132-M136 WeakPolarHBondContact O-CB 3.35Å; L132-M136 VanDerWaalsContact O-CG 3.27Å; L132-M136 WeakPolarHBondContact O-CG 3.48Å; L132-M136 PolarHBondContact O-N 3.34Å; S133-M136 PolarHBondContact O-N 3.04Å; M136-A139 PolarHBondContact O-N 2.98Å; M136-G140 PolarHBondContact O-N 3.37Å; M136-I141 HydrophobicContact CB-CB 4.32Å; M136-I141 PolarHBondContact O-N 3.14Å; M136-I142 HydrophobicContact CB-CB 4.48Å; M136-I142 HydrophobicContact CB-CD1 3.59Å; M136-I142 HydrophobicContact CB-CG1 3.85Å; M136-I142 HydrophobicContact CG-CD1 4.43Å; M136-I142 PolarHBondContact O-N 3.4Å; M136-I142 HydrophobicContact SD-CD1 4.05Å
137M92.2Very high86Confident55 Ų5569.6 Ų69.627%0.27136%0.359SS..Hα-helixtrans-65.6-48.7172.5-176.9-175.5-7100111.1S133 E135 A139 G140 I142 E144S133-M137 VanDerWaalsContact O-CB 3.26Å; S133-M137 WeakPolarHBondContact O-CB 3.21Å; S133-M137 PolarHBondContact O-N 3.48Å; E135-M137 VanDerWaalsContact C-N 3.34Å; E135-M137 PolarHBondContact O-N 2.96Å; M137-A139 PolarHBondContact O-N 3.09Å; M137-G140 PolarHBondContact O-N 3.15Å; M137-I142 WeakPolarHBondContact CA-O 3.03Å; M137-I142 HydrophobicContact CB-CB 4.39Å; M137-E144 HydrophobicContact CG-CG 4.12Å; M137-E144 HydrophobicContact SD-CB 4.48Å; M137-E144 HydrophobicContact SD-CG 3.77Å
138K91.3Very high84.1Confident171 Ų17172.9 Ų72.974%0.74337%0.365SS*.Hα-helixtrans-59.3-35.2174.6-72.8174.9-177.8179.70112.7K134 E135 G140K134-K138 WeakPolarHBondContact O-CG 3.49Å; K134-K138 PolarHBondContact O-N 3.38Å; K134-K138 VanDerWaalsContact O-N 3.08Å; E135-K138 PolarHBondContact O-N 2.83Å; K138-G140 VanDerWaalsContact C-N 3.25Å; K138-G140 PolarHBondContact O-N 3.01Å
139A90.6Very high82Confident29 Ų2974.7 Ų74.724%0.2438%0.377CS..THydrogen-bonded Turntrans-81-0.9178.200000114W21 L106 E135 M136 M137 I141W21-A139 HydrophobicContact CH2-CB 3.46Å; W21-A139 VanDerWaalsContact CH2-CB 3.46Å; W21-A139 HydrophobicContact CZ2-CB 3.96Å; L106-A139 HydrophobicContact CD1-CB 3.82Å; L106-A139 WeakPolarHBondContact CD1-O 3.45Å; E135-A139 WeakPolarHBondContact O-CB 3.43Å; E135-A139 PolarHBondContact O-N 3.21Å; M136-A139 PolarHBondContact O-N 2.98Å; M137-A139 PolarHBondContact O-N 3.09Å; A139-I141 PolarHBondContact O-N 3.16Å
140G89.7Confident79.6Confident31 Ų3184.3 Ų84.332%0.3242%0.419SS..THydrogen-bonded Turntrans76.615.5176.200000115.2K108 M136 M137 K138K108-G140 WeakPolarHBondContact CG-O 3.22Å; M136-G140 PolarHBondContact O-N 3.37Å; M137-G140 PolarHBondContact O-N 3.15Å; K138-G140 VanDerWaalsContact C-N 3.25Å; K138-G140 PolarHBondContact O-N 3.01Å
141I90.8Very high77.7Confident0 Ų087.9 Ų87.90%043%0.434CS..SBendtrans-81.9-39.1172.4-63.3179.6000110.5W21 M93 Q96 L106 K108 S109 V112 M136 A139W21-I141 HydrophobicContact CE3-CD1 4.17Å; W21-I141 HydrophobicContact CH2-CD1 3.99Å; W21-I141 HydrophobicContact CZ3-CD1 3.35Å; M93-I141 HydrophobicContact CE-CD1 4.27Å; M93-I141 HydrophobicContact CE-CG2 4.32Å; M93-I141 HydrophobicContact SD-CD1 4.48Å; Q96-I141 HydrophobicContact CG-CD1 4.38Å; L106-I141 HydrophobicContact CB-CG1 4.07Å; L106-I141 HydrophobicContact CD1-CD1 4.08Å; L106-I141 HydrophobicContact CD1-CG1 4.06Å; L106-I141 HydrophobicContact CD2-CD1 4.03Å; L106-I141 HydrophobicContact CD2-CG1 4.34Å; L106-I141 HydrophobicContact CG-CD1 4.48Å; L106-I141 HydrophobicContact CG-CG1 4.38Å; K108-I141 CarbonylContact C-O 3.55Å; K108-I141 VanDerWaalsContact CA-O 3.28Å; K108-I141 WeakPolarHBondContact CA-O 3.36Å; S109-I141 PolarHBondContact N-O 2.95Å; V112-I141 HydrophobicContact CB-CG2 4.34Å; V112-I141 HydrophobicContact CG1-CG2 4.14Å; M136-I141 HydrophobicContact CB-CB 4.32Å; M136-I141 PolarHBondContact O-N 3.14Å; A139-I141 PolarHBondContact O-N 3.16Å
142I91.2Very high75.5Confident5 Ų586.6 Ų86.63%0.02644%0.437CS..SBendtrans-107.7137.2179.1-61.8177.1000107.8V112 M113 M116 M136 M137V112-I142 HydrophobicContact CG1-CD1 3.96Å; V112-I142 HydrophobicContact CG1-CG1 3.97Å; M113-I142 HydrophobicContact CB-CG2 4.01Å; M113-I142 HydrophobicContact CG-CG2 3.9Å; M116-I142 HydrophobicContact CB-CD1 4.27Å; M116-I142 HydrophobicContact CG-CD1 4.38Å; M136-I142 HydrophobicContact CB-CB 4.48Å; M136-I142 HydrophobicContact CB-CD1 3.59Å; M136-I142 HydrophobicContact CB-CG1 3.85Å; M136-I142 HydrophobicContact CG-CD1 4.43Å; M136-I142 PolarHBondContact O-N 3.4Å; M136-I142 HydrophobicContact SD-CD1 4.05Å; M137-I142 WeakPolarHBondContact CA-O 3.03Å; M137-I142 HydrophobicContact CB-CB 4.39Å
143E85.3Confident73.1Confident87 Ų8794.9 Ų94.941%0.40748%0.477SS..  trans-76.8151.3173-62.9-168.4138.800110.4K108 M145K108-E143 HydrophobicContact CD-CG 3.83Å; K108-E143 VanDerWaalsContact CD-OE1 3.25Å; K108-E143 WeakPolarHBondContact CD-OE1 3.41Å; K108-E143 WeakPolarHBondContact CE-OE1 3.31Å; K108-E143 HydrophobicContact CG-CG 4.32Å; K108-E143 IonicContact NZ-OE1 2.71Å; K108-E143 PolarHBondContact NZ-OE1 2.99Å; E143-M145 PolarHBondContact O-N 3.22Å
144E74.1Confident71Confident167 Ų167102.8 Ų102.878%0.7851%0.512SS*.  trans-55.8113.8169.4-79.2-176.4169.100108.1M137 L146M137-E144 HydrophobicContact CG-CG 4.12Å; M137-E144 HydrophobicContact SD-CB 4.48Å; M137-E144 HydrophobicContact SD-CG 3.77Å; E144-L146 PolarHBondContact O-N 2.94Å
145M62.2Low68.9Low59 Ų59100.5 Ų100.529%0.29151%0.506SS..  trans-64.6106174.1-80.4-177.754.600107.7M113 Q117 E143 E147 T149M113-M145 HydrophobicContact CE-CB 4.42Å; M113-M145 HydrophobicContact CE-CG 3.38Å; M113-M145 HydrophobicContact CE-SD 4.45Å; Q117-M145 HydrophobicContact CG-CE 4.13Å; Q117-M145 PolarHBondContact OE1-SD 3.26Å; E143-M145 PolarHBondContact O-N 3.22Å; M145-E147 PolarHBondContact O-N 3.1Å; M145-T149 HydrophobicContact CE-CG2 3.61Å
146L49.7Very low66.6Low148 Ų148101.2 Ų101.278%0.77553%0.528SS*.  trans-56.9129.6152.2-94.2141.9000106E144 D148E144-L146 PolarHBondContact O-N 2.94Å; L146-D148 PolarHBondContact O-N 3.01Å
147E55.1Low64.2Low176 Ų176108 Ų10882%0.82256%0.559SS**SBendtrans-70.145.1-171.3-157.3158.5-157.800112.1M145 T149M145-E147 PolarHBondContact O-N 3.1Å; E147-T149 PolarHBondContact O-N 3.23Å; E147-T149 VanDerWaalsContact O-N 3.12Å
148D51.8Low62.1Low146 Ų146111.2 Ų111.278%0.78157%0.574SS**  trans-84.340.9172.9-73.4-17.3000110.4L146 F150L146-D148 PolarHBondContact O-N 3.01Å; D148-F150 VanDerWaalsContact C-N 3.26Å; D148-F150 PolarHBondContact O-N 3.36Å
149T49.9Very low59.9Low78 Ų78111.9 Ų111.948%0.47958%0.582SS.*THydrogen-bonded Turntrans-90.657175.350.20000111.2M145 E147M145-T149 HydrophobicContact CE-CG2 3.61Å; E147-T149 PolarHBondContact O-N 3.23Å; E147-T149 VanDerWaalsContact O-N 3.12Å
150F45.3Very low58.2Low201 Ų201116 Ų11688%0.88260%0.596SS**THydrogen-bonded Turntrans-107-5.6165.9-115.2-85.5000114.3D148D148-F150 VanDerWaalsContact C-N 3.26Å; D148-F150 PolarHBondContact O-N 3.36Å
151E53.1Low56.8Low185 Ų185121.6 Ų121.686%0.86461%0.614SS**  trans-129.587.9-179.4-78-178.7165.700113.2
152S49Very low55.7Low76 Ų76122.1 Ų122.153%0.53162%0.618SS.*  trans-153.576.9131.628.30000106.1E154S152-E154 PolarHBondContact O-N 3.49Å
153M44Very low55.1Low175 Ų175124.7 Ų124.786%0.86264%0.64SS**THydrogen-bonded Turntrans-64.263.3172-168.6171.884.500109.7
154E47.3Very low54.9Low184 Ų184128.1 Ų128.186%0.8666%0.656SS**THydrogen-bonded Turntrans-116.8-15.4167.3-86.4-175.3166.300112.3S152S152-E154 PolarHBondContact O-N 3.49Å
155D49.5Very low55.5Low86 Ų86126.5 Ų126.546%0.4665%0.648SS.*SBendtrans-96.69.7172.5-87.3-34.6000112.4K78 E157K78-D155 IonicContact NZ-OD1 2.95Å; K78-D155 PolarHBondContact NZ-OD1 3.17Å; K78-D155 VanDerWaalsContact NZ-OD1 3.11Å; D155-E157 VanDerWaalsContact C-N 3.27Å; D155-E157 PolarHBondContact O-N 2.85Å
156G43.8Very low56.7Low67 Ų67126.7 Ų126.769%0.69165%0.649SS**THydrogen-bonded Turntrans-76.5-5.1-179.900000115.3
157E42.8Very low58.6Low141 Ų141119.9 Ų119.966%0.65961%0.613SS**THydrogen-bonded Turntrans-131.925-172.9-64.4-173.9166.500113.4D155 M159 E160D155-E157 VanDerWaalsContact C-N 3.27Å; D155-E157 PolarHBondContact O-N 2.85Å; E157-M159 PolarHBondContact O-N 2.84Å; E157-E160 HydrophobicContact CB-CG 4.45Å; E157-E160 PolarHBondContact O-N 3.26Å
158E47.2Very low60.2Low124 Ų124116.3 Ų116.358%0.57960%0.6SS**THydrogen-bonded Turntrans-7929.4174.8-73.8-163.115000114.6K78K78-E158 WeakPolarHBondContact CE-OE1 3.44Å; K78-E158 IonicContact NZ-OE1 3.01Å; K78-E158 PolarHBondContact NZ-OE1 2.98Å; K78-E158 IonicContact NZ-OE2 3.41Å; K78-E158 PolarHBondContact NZ-OE2 3.37Å
159M46.7Very low62.1Low184 Ų184114.9 Ų114.991%0.90659%0.587SS**THydrogen-bonded Turntrans-126.636.5154.1-160.3-178.4-71.700110.2E157 E161E157-M159 PolarHBondContact O-N 2.84Å; M159-E161 PolarHBondContact O-N 3.08Å
160E54.5Low64Low117 Ų117111.7 Ų111.755%0.54757%0.566SS.*  trans-62.5105.7156-80.8-171.8156.900107.6E157 A162E157-E160 HydrophobicContact CB-CG 4.45Å; E157-E160 PolarHBondContact O-N 3.26Å; E160-A162 PolarHBondContact O-N 3.44Å
161E59.4Low66.2Low148 Ų148102.8 Ų102.869%0.69253%0.528SS*.  trans-47.2115.9160.6-162.7172.9-165.900106.5K67 M159 A163K67-E161 IonicContact NZ-OE1 3.97Å; K67-E161 PolarHBondContact NZ-OE1 3.01Å; M159-E161 PolarHBondContact O-N 3.08Å; E161-A163 PolarHBondContact O-N 2.97Å
162A67.4Low68Low11 Ų11100.3 Ų100.39%0.09151%0.514CS..  trans-49.2124.6-173.500000109I70 E160 E164 V167I70-A162 HydrophobicContact CB-CB 4.3Å; I70-A162 HydrophobicContact CD1-CB 3.44Å; I70-A162 VanDerWaalsContact CD1-CB 3.44Å; I70-A162 HydrophobicContact CG1-CB 4.42Å; I70-A162 HydrophobicContact CG2-CB 3.99Å; E160-A162 PolarHBondContact O-N 3.44Å; A162-E164 PolarHBondContact O-N 3.27Å; A162-V167 HydrophobicContact CB-CG2 4.05Å
163A78.3Confident69.9Low58 Ų58103.3 Ų103.348%0.47952%0.52SS..  trans-49.7134.6-173.900000108.7E161 E165 E166 V167E161-A163 PolarHBondContact O-N 2.97Å; A163-E165 PolarHBondContact O-N 2.81Å; A163-E166 HydrophobicContact CB-CB 4.45Å; A163-E166 WeakPolarHBondContact O-CA 3.48Å; A163-E166 WeakPolarHBondContact O-CB 3.43Å; A163-E166 PolarHBondContact O-N 2.86Å; A163-V167 PolarHBondContact O-N 3.33Å
164E81.8Confident72.1Confident159 Ų15995.8 Ų95.874%0.74348%0.483SS*.Hα-helixtrans-51.9-34.7-177.3-66-176.3160.800111A162 E166 V167 D168A162-E164 PolarHBondContact O-N 3.27Å; E164-E166 PolarHBondContact O-N 3.49Å; E164-V167 PolarHBondContact O-N 2.94Å; E164-D168 WeakPolarHBondContact O-CB 3.34Å; E164-D168 PolarHBondContact O-N 3.26Å
165E86.6Confident74Confident133 Ų13387.7 Ų87.762%0.62145%0.446SS*.Hα-helixtrans-61.5-38.6172.7-61.7-171.5-176.100114.7A163 K169A163-E165 PolarHBondContact O-N 2.81Å; E165-K169 WeakPolarHBondContact O-CB 3.42Å; E165-K169 VanDerWaalsContact O-CD 3.3Å; E165-K169 WeakPolarHBondContact O-CD 3.17Å; E165-K169 WeakPolarHBondContact O-CG 3.45Å; E165-K169 PolarHBondContact O-N 3.29Å; E165-K169 IonicContact OE2-NZ 3.64Å; E165-K169 PolarHBondContact OE2-NZ 3.35Å
166E87.1Confident75.6Confident64 Ų6488 Ų8830%0.29946%0.461SS..Hα-helixtrans-68.9-40.1178.2-165-177.2-179.300110.4I70 R74 A163 E164 K169 I170I70-E166 HydrophobicContact CD1-CB 3.98Å; I70-E166 HydrophobicContact CD1-CG 3.72Å; I70-E166 HydrophobicContact CG1-CG 4.15Å; I70-E166 WeakPolarHBondContact CG2-OE1 3.34Å; R74-E166 IonicContact CZ-OE2 2.63Å; R74-E166 IonicContact NH2-OE2 3.23Å; R74-E166 PolarHBondContact NH2-OE2 3.15Å; A163-E166 HydrophobicContact CB-CB 4.45Å; A163-E166 WeakPolarHBondContact O-CA 3.48Å; A163-E166 WeakPolarHBondContact O-CB 3.43Å; A163-E166 PolarHBondContact O-N 2.86Å; E164-E166 PolarHBondContact O-N 3.49Å; E166-K169 PolarHBondContact O-N 3.36Å; E166-I170 WeakPolarHBondContact O-CG1 3.47Å; E166-I170 PolarHBondContact O-N 3.45Å; E166-I170 VanDerWaalsContact O-N 3.09Å
167V89.4Confident77Confident5 Ų585.5 Ų85.53%0.0344%0.436CS..Hα-helixtrans-61.6-49.5173.9176.70000110.5V63 A66 K67 I70 A162 A163 E164 K169 I170 L171V63-V167 HydrophobicContact CG1-CG1 4.25Å; A66-V167 HydrophobicContact CB-CG1 3.85Å; K67-V167 HydrophobicContact CG-CG2 3.87Å; I70-V167 HydrophobicContact CD1-CB 4.49Å; I70-V167 HydrophobicContact CD1-CG2 3.74Å; A162-V167 HydrophobicContact CB-CG2 4.05Å; A163-V167 PolarHBondContact O-N 3.33Å; E164-V167 PolarHBondContact O-N 2.94Å; V167-K169 PolarHBondContact O-N 2.87Å; V167-I170 PolarHBondContact O-N 3.48Å; V167-L171 HydrophobicContact CG1-CD1 4.08Å; V167-L171 HydrophobicContact CG1-CG 4.48Å; V167-L171 WeakPolarHBondContact O-CG 3.28Å; V167-L171 PolarHBondContact O-N 3.44Å
168D89.6Confident78.2Confident101 Ų10182.9 Ų82.954%0.5444%0.438SS..Hα-helixtrans-62.6-41.1179.7-79.4-14.4000112.3E164 I170 L171 F172E164-D168 WeakPolarHBondContact O-CB 3.34Å; E164-D168 PolarHBondContact O-N 3.26Å; D168-I170 PolarHBondContact O-N 2.94Å; D168-L171 PolarHBondContact O-N 3.4Å; D168-F172 WeakPolarHBondContact O-CB 3.47Å; D168-F172 PolarHBondContact O-N 3.33Å
169K91.1Very high79Confident116 Ų11679 Ų7950%0.50442%0.421SS..Hα-helixtrans-57.9-48.6174.3-75.9162.8-165.9161.60111.1E165 E166 V167 L171 F172 E173E165-K169 WeakPolarHBondContact O-CB 3.42Å; E165-K169 VanDerWaalsContact O-CD 3.3Å; E165-K169 WeakPolarHBondContact O-CD 3.17Å; E165-K169 WeakPolarHBondContact O-CG 3.45Å; E165-K169 PolarHBondContact O-N 3.29Å; E165-K169 IonicContact OE2-NZ 3.64Å; E165-K169 PolarHBondContact OE2-NZ 3.35Å; E166-K169 PolarHBondContact O-N 3.36Å; V167-K169 PolarHBondContact O-N 2.87Å; K169-L171 PolarHBondContact O-N 2.89Å; K169-F172 PolarHBondContact O-N 2.83Å; K169-E173 WeakPolarHBondContact O-CB 3.3Å; K169-E173 VanDerWaalsContact O-CG 3.32Å; K169-E173 WeakPolarHBondContact O-CG 3.44Å; K169-E173 PolarHBondContact O-N 3.4Å
170I90.4Very high79.4Confident10 Ų1072.8 Ų72.85%0.05140%0.404CS..Hα-helixtrans-65.2-41.9179.7-74.8173.4000111.9A66 M69 I70 K73 E166 V167 D168 F172 E173 I174A66-I170 HydrophobicContact CB-CG2 4.16Å; M69-I170 HydrophobicContact CB-CG2 4.25Å; M69-I170 HydrophobicContact CG-CD1 4.4Å; M69-I170 HydrophobicContact CG-CG2 4.01Å; I70-I170 HydrophobicContact CB-CD1 4.39Å; I70-I170 HydrophobicContact CD1-CD1 3.82Å; I70-I170 HydrophobicContact CG1-CD1 3.13Å; K73-I170 HydrophobicContact CD-CD1 4.36Å; E166-I170 WeakPolarHBondContact O-CG1 3.47Å; E166-I170 PolarHBondContact O-N 3.45Å; E166-I170 VanDerWaalsContact O-N 3.09Å; V167-I170 PolarHBondContact O-N 3.48Å; D168-I170 PolarHBondContact O-N 2.94Å; I170-F172 VanDerWaalsContact C-N 3.33Å; I170-F172 PolarHBondContact O-N 3.31Å; I170-E173 PolarHBondContact O-N 3.09Å; I170-I174 HydrophobicContact CG2-CD1 3.55Å; I170-I174 HydrophobicContact CG2-CG1 4.31Å; I170-I174 WeakPolarHBondContact O-CB 3.14Å; I170-I174 VanDerWaalsContact O-CG1 3.27Å; I170-I174 WeakPolarHBondContact O-CG1 3.5Å; I170-I174 PolarHBondContact O-N 3.25Å
171L91.2Very high78.8Confident14 Ų1477 Ų777%0.07342%0.42CS..Hα-helixtrans-61.6-43.7175.9-74.2178.9000111.5I50 C62 V63 A66 V167 D168 K169 T175 L179I50-L171 HydrophobicContact CG2-CD2 3.92Å; C62-L171 HydrophobicContact CB-CD1 4.46Å; C62-L171 HydrophobicContact CB-CD2 3.7Å; V63-L171 HydrophobicContact CG2-CD1 4.23Å; A66-L171 HydrophobicContact CB-CD1 4.45Å; A66-L171 HydrophobicContact CB-CD2 3.74Å; A66-L171 HydrophobicContact CB-CG 3.79Å; V167-L171 HydrophobicContact CG1-CD1 4.08Å; V167-L171 HydrophobicContact CG1-CG 4.48Å; V167-L171 WeakPolarHBondContact O-CG 3.28Å; V167-L171 PolarHBondContact O-N 3.44Å; D168-L171 PolarHBondContact O-N 3.4Å; K169-L171 PolarHBondContact O-N 2.89Å; L171-T175 VanDerWaalsContact O-CB 3.31Å; L171-T175 WeakPolarHBondContact O-CB 3.26Å; L171-T175 WeakPolarHBondContact O-CG2 3.45Å; L171-T175 PolarHBondContact O-N 2.95Å; L171-T175 PolarHBondContact O-OG1 3.47Å; L171-L179 HydrophobicContact CB-CD1 4.24Å; L171-L179 HydrophobicContact CD2-CD1 4.07Å
172F91.2Very high78Confident133 Ų13373 Ų7358%0.58341%0.412SS*.Hα-helixtrans-62-48.8176.4-175.8-94000111.8D168 K169 I170 I174 A176 G177D168-F172 WeakPolarHBondContact O-CB 3.47Å; D168-F172 PolarHBondContact O-N 3.33Å; K169-F172 PolarHBondContact O-N 2.83Å; I170-F172 VanDerWaalsContact C-N 3.33Å; I170-F172 PolarHBondContact O-N 3.31Å; F172-I174 PolarHBondContact O-N 2.81Å; F172-A176 VanDerWaalsContact O-CA 3.32Å; F172-A176 WeakPolarHBondContact O-CA 3.46Å; F172-A176 PolarHBondContact O-N 2.95Å; F172-G177 VanDerWaalsContact CE2-CA 3.5Å; F172-G177 PolarHBondContact O-N 3.23Å; F172-G177 VanDerWaalsContact O-N 3.08Å
173E89.6Confident76.8Confident140 Ų14077.4 Ų77.465%0.65444%0.44SS*.Hα-helixtrans-60.7-42.2178.7-75178.1-17100112.8K169 I170K169-E173 WeakPolarHBondContact O-CB 3.3Å; K169-E173 VanDerWaalsContact O-CG 3.32Å; K169-E173 WeakPolarHBondContact O-CG 3.44Å; K169-E173 PolarHBondContact O-N 3.4Å; I170-E173 PolarHBondContact O-N 3.09Å
174I89Confident75.1Confident16 Ų1679.6 Ų79.68%0.08245%0.452CS..Hα-helixtrans-77-38.1-176.6-68.5175.6000111.6K47 I50 K51 M69 I170 F172K47-I174 HydrophobicContact CG-CD1 4.36Å; K47-I174 HydrophobicContact CG-CG1 4.28Å; K47-I174 HydrophobicContact CG-CG2 3.81Å; I50-I174 HydrophobicContact CB-CG2 3.98Å; I50-I174 HydrophobicContact CD1-CD1 3.61Å; I50-I174 HydrophobicContact CG2-CB 4.24Å; I50-I174 HydrophobicContact CG2-CG2 3.61Å; K51-I174 WeakPolarHBondContact CE-O 3.39Å; K51-I174 HydrophobicContact CG-CG2 3.93Å; M69-I174 HydrophobicContact CE-CD1 4.39Å; M69-I174 HydrophobicContact CG-CD1 4.43Å; I170-I174 HydrophobicContact CG2-CD1 3.55Å; I170-I174 HydrophobicContact CG2-CG1 4.31Å; I170-I174 WeakPolarHBondContact O-CB 3.14Å; I170-I174 VanDerWaalsContact O-CG1 3.27Å; I170-I174 WeakPolarHBondContact O-CG1 3.5Å; I170-I174 PolarHBondContact O-N 3.25Å; F172-I174 PolarHBondContact O-N 2.81Å
175T86.6Confident73.2Confident14 Ų1481.4 Ų81.49%0.08646%0.457CS..Hα-helixtrans-93.10.9-177.168.80000113.6I50 A54 L171 G177 A178 L179I50-T175 HydrophobicContact CG2-CG2 4.09Å; A54-T175 HydrophobicContact CB-CG2 3.65Å; L171-T175 VanDerWaalsContact O-CB 3.31Å; L171-T175 WeakPolarHBondContact O-CB 3.26Å; L171-T175 WeakPolarHBondContact O-CG2 3.45Å; L171-T175 PolarHBondContact O-N 2.95Å; L171-T175 PolarHBondContact O-OG1 3.47Å; T175-G177 PolarHBondContact O-N 3.45Å; T175-A178 WeakPolarHBondContact O-CB 3.42Å; T175-A178 PolarHBondContact O-N 3.04Å; T175-L179 HydrophobicContact CG2-CD1 3.61Å; T175-L179 HydrophobicContact CG2-CG 4.01Å
176A84Confident70.8Confident92 Ų9280.3 Ų80.376%0.7646%0.459SS*.THydrogen-bonded Turntrans51.439-174.800000112.3F172 A178F172-A176 VanDerWaalsContact O-CA 3.32Å; F172-A176 WeakPolarHBondContact O-CA 3.46Å; F172-A176 PolarHBondContact O-N 2.95Å; A176-A178 VanDerWaalsContact C-N 3.28Å; A176-A178 PolarHBondContact O-N 2.96Å
177G72.3Confident68.7Low16 Ų1683.4 Ų83.417%0.16548%0.482CS..THydrogen-bonded Turntrans74.57.7-177.800000115.6F172 T175 L179 G180F172-G177 VanDerWaalsContact CE2-CA 3.5Å; F172-G177 PolarHBondContact O-N 3.23Å; F172-G177 VanDerWaalsContact O-N 3.08Å; T175-G177 PolarHBondContact O-N 3.45Å; G177-L179 PolarHBondContact O-N 3.26Å; G177-L179 VanDerWaalsContact O-N 3.1Å; G177-G180 PolarHBondContact O-N 2.77Å; G177-G180 VanDerWaalsContact O-O 3.08Å
178A67.9Low66.2Low86 Ų8691 Ų9171%0.71152%0.517SS*.THydrogen-bonded Turntrans-61.5-19.5175.800000113.3T175 A176T175-A178 WeakPolarHBondContact O-CB 3.42Å; T175-A178 PolarHBondContact O-N 3.04Å; A176-A178 VanDerWaalsContact C-N 3.28Å; A176-A178 PolarHBondContact O-N 2.96Å
179L65.8Low63.8Low43 Ų4391.9 Ų91.923%0.22553%0.529CS..THydrogen-bonded Turntrans-90.7-7.4172.4-70.6173.6000114.3A54 C62 L171 T175 G177A54-L179 HydrophobicContact CB-CD1 3.98Å; A54-L179 HydrophobicContact CB-CD2 3.91Å; A54-L179 HydrophobicContact CB-CG 3.92Å; C62-L179 HydrophobicContact CB-CD1 4.21Å; L171-L179 HydrophobicContact CB-CD1 4.24Å; L171-L179 HydrophobicContact CD2-CD1 4.07Å; T175-L179 HydrophobicContact CG2-CD1 3.61Å; T175-L179 HydrophobicContact CG2-CG 4.01Å; G177-L179 PolarHBondContact O-N 3.26Å; G177-L179 VanDerWaalsContact O-N 3.1Å
180G53.2Low61.3Low52 Ų5293.6 Ų93.654%0.53654%0.543SS..  trans-105.3129177.600000111.4G177G177-G180 PolarHBondContact O-N 2.77Å; G177-G180 VanDerWaalsContact O-O 3.08Å
181K42.4Very low58.8Low207 Ų20799 Ų9990%0.958%0.578SS**  cis-104.8120.624.1-64.1170.4177.2179.20111.9
182A43.4Very low56.2Low63 Ų63105.8 Ų105.852%0.52162%0.615SS.*  trans-77.7125.2152.300000107.2S184A182-S184 PolarHBondContact O-N 3.45Å
183P42Very low53.7Low104 Ų104107.7 Ų107.768%0.67563%0.63SS**  trans-57138.8161.324.9-30.3000107.7K185P183-K185 PolarHBondContact O-N 3.01Å
184S42.4Very low51.1Low103 Ų103109.6 Ų109.672%0.7264%0.639SS**  trans-39131.2162.551.90000108.3A182 V186A182-S184 PolarHBondContact O-N 3.45Å; S184-V186 PolarHBondContact O-N 3.2Å
185K40.8Very low48.5Very low198 Ų198113.9 Ų113.986%0.86167%0.668SS**  trans-27.8100.6169.7-76.7173174.1170.20109.4P183 T187P183-K185 PolarHBondContact O-N 3.01Å; K185-T187 PolarHBondContact O-N 3.45Å
186V37.8Very low46.3Very low109 Ų109119.7 Ų119.766%0.66171%0.706SS**  trans-69103.8158.1-1800000101.3S184 E188S184-V186 PolarHBondContact O-N 3.2Å; V186-E188 HydrophobicContact CG1-CG 4.14Å; V186-E188 PolarHBondContact O-N 3.28Å
187T42.8Very low43.9Very low129 Ų129118.9 Ų118.979%0.79171%0.706SS**  trans-5584154.416.60000106.1K185 P189K185-T187 PolarHBondContact O-N 3.45Å; T187-P189 WeakPolarHBondContact O-CD 3.4Å
188E36.7Very low41.8Very low164 Ų164123.1 Ų123.177%0.76674%0.74SS**  trans-63.1112.7156.5-76.9-179.2161.500104.9V186 L190V186-E188 HydrophobicContact CG1-CG 4.14Å; V186-E188 PolarHBondContact O-N 3.28Å; E188-L190 PolarHBondContact O-N 3.27Å
189P39.8Very low40.1Very low120 Ų120124.8 Ų124.878%0.77975%0.746SS**  trans-62.4128.7164.229.2-30.5000106.3T187T187-P189 WeakPolarHBondContact O-CD 3.4Å
190L37Very low38.4Very low153 Ų153127 Ų12780%0.80177%0.771SS**  trans-43.7138.8172.7-76137000110.4E188 D192E188-L190 PolarHBondContact O-N 3.27Å; L190-D192 PolarHBondContact O-N 2.93Å
191P39.4Very low37.3Very low122 Ų122129.3 Ų129.379%0.79279%0.785SS**  trans-65.6108.3170.5-10.224.1000108.2L193P191-L193 PolarHBondContact O-N 2.98Å
192D35.8Very low36.8Very low158 Ų158124 Ų12485%0.84578%0.78SS**  trans-63.9121.7167.7-97.9-24.2000108.6L190 Q194L190-D192 PolarHBondContact O-N 2.93Å; D192-Q194 PolarHBondContact O-N 3.22Å
193L39.1Very low36.2Very low173 Ų173126.7 Ų126.791%0.90680%0.795SS**  trans-60.6106.4172.6-73.7158.2000109P191P191-L193 PolarHBondContact O-N 2.98Å
194Q33.7Very low35.8Very low180 Ų180129 Ų12984%0.84180%0.801SS**PPolyproline II helixtrans-74.8131.2175.3-167.1151.74000111.3D192D192-Q194 PolarHBondContact O-N 3.22Å
195P35.8Very low35.8Very low105 Ų105132.8 Ų132.868%0.68281%0.808SS**PPolyproline II helixtrans-86.1149.8152.831.8-25.5000110.1
196P39Very low35.9Very low136 Ų136130.8 Ų130.888%0.88380%0.802SS**PPolyproline II helixtrans-83.5133.4-163.332.9-32.8000112.1
197G34.5Very low36.7Very low75 Ų75128.5 Ų128.577%0.77379%0.79SS**  trans156.2125.3163.100000114.6
198A29.2Very low37.1Very low105 Ų105130.6 Ų130.687%0.86879%0.791SS**  trans86.695.4164.600000118.6
199S31.6Very low37.9Very low121 Ų121130.1 Ų130.185%0.84679%0.789SS**  trans-20.2129.3147168.40000117
200A30.4Very low38.9Very low89 Ų89128.8 Ų128.874%0.73678%0.775SS**  166.3126.4109.600000112.1
201A30.4Very low40.3Very low101 Ų101125.5 Ų125.584%0.83576%0.757SS**  trans24.1128.7147.600000121.5
202A31.9Very low41.9Very low97 Ų97126.4 Ų126.480%0.80275%0.751SS**  154.1122.998.800000111.9
203S29.6Very low43.7Very low119 Ų119121.6 Ų121.683%0.83273%0.733SS**  167.793.7125.162.10000109.9
204D34.3Very low45.2Very low151 Ų151119 Ų11981%0.80772%0.718SS**SBendtrans-130.6122.2155.2-106.9-19.3000106.6
205E42.5Very low47.1Very low183 Ų183116.5 Ų116.586%0.85571%0.706SS**  trans4585.8151.8-56.8-175.5166.200117.7S207E205-S207 PolarHBondContact O-N 3.49Å
206E43Very low49Very low157 Ų157115.1 Ų115.173%0.73470%0.699SS**  trans-74114.8160.8-71.6-175.5167.700109.3
207S53.1Low50.6Low60 Ų60118.3 Ų118.342%0.4269%0.694SS.*  trans-82.5156.3174.962.50000111E205 E209 D210E205-S207 PolarHBondContact O-N 3.49Å; S207-E209 PolarHBondContact O-N 2.79Å; S207-D210 PolarHBondContact O-N 3.07Å
208E52.8Low52.4Low174 Ų174120 Ų12081%0.81368%0.684SS**Hα-helixtrans-55.5-22-177.5-68.3-178.2154.700113.8
209E52.5Low54.4Low154 Ų154118 Ų11872%0.7267%0.668SS**Hα-helixtrans-69.8-30.7177.5-65.3-177.5167.800113S207 A213S207-E209 PolarHBondContact O-N 2.79Å; E209-A213 PolarHBondContact O-N 3.41Å
210D61.2Low56.4Low92 Ų92115.6 Ų115.649%0.49266%0.655SS.*Hα-helixtrans-75.8-29.4-179.8-75.8-28.9000112.2S207 M214S207-D210 PolarHBondContact O-N 3.07Å; D210-M214 PolarHBondContact O-N 3.45Å; D210-M214 VanDerWaalsContact O-N 3.15Å
211I67Low58Low83 Ų83118.2 Ų118.243%0.42666%0.656SS.*Hα-helixtrans-71-40.4176.7-59-179.4000110.4M214 Q215I211-M214 PolarHBondContact O-N 3.18Å; I211-Q215 WeakPolarHBondContact O-CG 3.25Å; I211-Q215 PolarHBondContact O-N 3.41Å
212E72.9Confident59.4Low142 Ų142124.7 Ų124.766%0.66466%0.659SS**Hα-helixtrans-65.7-39.4175.5-88.5-171.7158.500112.4M214 Q215 S216E212-M214 VanDerWaalsContact C-N 3.28Å; E212-M214 PolarHBondContact O-N 3.42Å; E212-Q215 PolarHBondContact O-N 3Å; E212-S216 PolarHBondContact O-N 3.18Å
213A73.9Confident60.4Low56 Ų56127.9 Ų127.946%0.46368%0.676SS.*Hα-helixtrans-61.9-36.5174.700000112E209 S216 R217E209-A213 PolarHBondContact O-N 3.41Å; A213-S216 PolarHBondContact O-OG 2.91Å; A213-R217 PolarHBondContact O-N 3.13Å
214M70.3Confident61.9Low119 Ų119128.4 Ų128.459%0.58667%0.668SS**Hα-helixtrans-72.2-38177.2-161.2180-60.800112.5D210 I211 E212 R217 L218D210-M214 PolarHBondContact O-N 3.45Å; D210-M214 VanDerWaalsContact O-N 3.15Å; I211-M214 PolarHBondContact O-N 3.18Å; E212-M214 VanDerWaalsContact C-N 3.28Å; E212-M214 PolarHBondContact O-N 3.42Å; M214-R217 PolarHBondContact O-N 3.46Å; M214-L218 PolarHBondContact O-N 2.79Å
215Q72.1Confident63.4Low127 Ų127127.2 Ų127.259%0.59366%0.66SS**Hα-helixtrans-67.3-40.6178.5-72.4179.212.200112.7I211 E212 R217 L218 A219I211-Q215 WeakPolarHBondContact O-CG 3.25Å; I211-Q215 PolarHBondContact O-N 3.41Å; E212-Q215 PolarHBondContact O-N 3Å; Q215-R217 VanDerWaalsContact C-N 3.28Å; Q215-R217 PolarHBondContact O-N 2.74Å; Q215-L218 PolarHBondContact O-N 3.39Å; Q215-A219 PolarHBondContact O-N 3.09Å; Q215-A219 VanDerWaalsContact O-N 3.09Å
216S77.8Confident64.6Low77 Ų77124.1 Ų124.154%0.53865%0.649SS.*Hα-helixtrans-62.8-35.7176.466.70000112.4E212 A213 A219 A220E212-S216 PolarHBondContact O-N 3.18Å; A213-S216 PolarHBondContact O-OG 2.91Å; S216-A219 PolarHBondContact O-N 3.27Å; S216-A220 PolarHBondContact O-N 3.01Å
217R71.8Confident65.8Low202 Ų202122.1 Ų122.176%0.76265%0.645SS**Hα-helixtrans-71.3-34.1178.7-144.9174.8-173169.51.9112.9A213 M214 Q215A213-R217 PolarHBondContact O-N 3.13Å; M214-R217 PolarHBondContact O-N 3.46Å; Q215-R217 VanDerWaalsContact C-N 3.28Å; Q215-R217 PolarHBondContact O-N 2.74Å
218L71.1Confident66.6Low111 Ų111126 Ų12658%0.58166%0.659SS**Hα-helixtrans-73.3-32.7174.5-74.3171.2000112.6M214 Q215 L221M214-L218 PolarHBondContact O-N 2.79Å; Q215-L218 PolarHBondContact O-N 3.39Å; L218-L221 PolarHBondContact O-N 2.73Å
219A73.2Confident67.5Low63 Ų63122.8 Ų122.852%0.52165%0.648SS.*Hα-helixtrans-66.8-37.1175.400000112.1Q215 S216 L221 R222Q215-A219 PolarHBondContact O-N 3.09Å; Q215-A219 VanDerWaalsContact O-N 3.09Å; S216-A219 PolarHBondContact O-N 3.27Å; A219-L221 PolarHBondContact O-N 3.12Å; A219-R222 PolarHBondContact O-N 2.71Å; A219-R222 VanDerWaalsContact O-N 3.1Å
220A72.1Confident68.6Low70 Ų70120.6 Ų120.658%0.57964%0.643SS**THydrogen-bonded Turntrans-67.3-16.3176.900000114.3S216S216-A220 PolarHBondContact O-N 3.01Å
221L64.8Low69.2Low145 Ų145122.8 Ų122.876%0.75966%0.655SS**THydrogen-bonded Turntrans-93.6-3.7174.8-74.1166.3000113.1L218 A219L218-L221 PolarHBondContact O-N 2.73Å; A219-L221 PolarHBondContact O-N 3.12Å
222R60.3Low69.4Low237 Ų237126.1 Ų126.189%0.89467%0.674SS**  trans-107.46.8177.4-80.4-172.3174.2177.40.3113.8A219A219-R222 PolarHBondContact O-N 2.71Å; A219-R222 VanDerWaalsContact O-N 3.1Å
223S52.3Low69Low164 Ų164124.6 Ų124.6100%1.14768%0.675SS**  trans-105.30168.671.60000111.7

Retrieved 223 of 223 residues in 404 ms (Link to these results)

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