A0A077ZC63_TRITR Loading...

E3 ubiquitin-protein ligase UBR4 N-terminal domain-containing protein

AlphaFold DB , UniProt , Accession A0A077ZC63, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 371 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
1M72.7Confident85.3Confident116 Ų11630.9 Ų30.957%0.57117%0.165SC*.  0141.80-167.3-176.9-71.900108.8T30 A33 C34M1-T30 HydrophobicContact SD-CG2 3.67Å; M1-A33 HydrophobicContact CE-CB 3.3Å; M1-C34 WeakPolarHBondContact CE-SG 3.45Å; M1-C34 PolarHBondContact SD-SG 3.46Å
2D80.6Confident85.3Confident83 Ų8333 Ų3344%0.44418%0.184SC..  trans-100.986.7178.9-178.119.2000110.9S4 A5D2-S4 PolarHBondContact O-N 2.87Å; D2-S4 VanDerWaalsContact O-N 3.1Å; D2-S4 WeakPolarHBondContact OD1-CB 3.38Å; D2-S4 PolarHBondContact OD1-N 2.78Å; D2-A5 HydrophobicContact CB-CB 4.48Å; D2-A5 PolarHBondContact O-N 3.09Å; D2-A5 VanDerWaalsContact O-N 3.08Å
3W84.6Confident84.7Confident5 Ų534.6 Ų34.62%0.01920%0.199CC..Hα-helixtrans-58.6-24.3179-78.496.1000113.2A5 D6 V7 C34 F48 Y49 F52 H141 V142 T145 V146W3-A5 VanDerWaalsContact C-N 3.27Å; W3-A5 PolarHBondContact O-N 3.47Å; W3-D6 PolarHBondContact O-N 3.27Å; W3-V7 HydrophobicContact CE3-CG2 3.96Å; W3-V7 VanDerWaalsContact O-CB 3.29Å; W3-V7 WeakPolarHBondContact O-CB 3.24Å; W3-V7 VanDerWaalsContact O-CG2 3.3Å; W3-V7 WeakPolarHBondContact O-CG2 3.47Å; W3-V7 PolarHBondContact O-N 3.01Å; W3-C34 HydrophobicContact CH2-CB 4.12Å; W3-C34 HydrophobicContact CZ2-CB 3.85Å; W3-C34 WeakPolarHBondContact CZ2-SG 3.45Å; W3-F48 HydrophobicContact CE3-CE1 4.45Å; W3-F48 AromaticContact CE3-CZ 3.97Å; W3-F48 HydrophobicContact CE3-CZ 3.97Å; W3-F48 HydrophobicContact CH2-CE1 4.23Å; W3-F48 HydrophobicContact CZ3-CE1 4.06Å; W3-F48 AromaticContact CZ3-CZ 3.9Å; W3-F48 HydrophobicContact CZ3-CZ 3.9Å; W3-Y49 HydrophobicContact CH2-CE1 4.02Å; W3-Y49 HydrophobicContact CZ2-CE1 4.24Å; W3-F52 HydrophobicContact CE3-CE2 4.43Å; W3-F52 HydrophobicContact CE3-CZ 4.47Å; W3-F52 HydrophobicContact CH2-CD1 4.4Å; W3-F52 HydrophobicContact CH2-CE1 4.17Å; W3-F52 AromaticContact CZ3-CD1 3.96Å; W3-F52 HydrophobicContact CZ3-CD1 3.96Å; W3-F52 HydrophobicContact CZ3-CD2 4.17Å; W3-F52 AromaticContact CZ3-CE1 3.72Å; W3-F52 HydrophobicContact CZ3-CE1 3.72Å; W3-F52 AromaticContact CZ3-CE2 3.95Å; W3-F52 HydrophobicContact CZ3-CE2 3.95Å; W3-F52 HydrophobicContact CZ3-CG 4.17Å; W3-F52 AromaticContact CZ3-CZ 3.72Å; W3-F52 HydrophobicContact CZ3-CZ 3.72Å; W3-H141 AromaticContact CD1-CD2 3.91Å; W3-H141 AromaticContact NE1-CD2 3.44Å; W3-H141 PolarHBondContact NE1-CD2 3.31Å; W3-H141 AromaticContact NE1-NE2 3.67Å; W3-V142 HydrophobicContact CB-CB 4.4Å; W3-V142 HydrophobicContact CB-CG1 3.92Å; W3-V142 HydrophobicContact CB-CG2 4.42Å; W3-V142 HydrophobicContact CD2-CG1 4.47Å; W3-V142 HydrophobicContact CD2-CG2 3.77Å; W3-V142 HydrophobicContact CE3-CG2 4.42Å; W3-V142 HydrophobicContact CG-CB 4.23Å; W3-V142 HydrophobicContact CG-CG1 4.14Å; W3-V142 HydrophobicContact CG-CG2 3.77Å; W3-V142 HydrophobicContact CZ2-CG2 4.35Å; W3-T145 WeakPolarHBondContact CB-OG1 3.32Å; W3-V146 HydrophobicContact CB-CG2 4.49Å
4S83.5Confident84.4Confident1 Ų136.7 Ų36.71%0.00722%0.222CC..Hα-helixtrans-57.5-43.7176-152.30000111.4D2 D6 K8 T145D2-S4 PolarHBondContact O-N 2.87Å; D2-S4 VanDerWaalsContact O-N 3.1Å; D2-S4 WeakPolarHBondContact OD1-CB 3.38Å; D2-S4 PolarHBondContact OD1-N 2.78Å; S4-D6 VanDerWaalsContact C-N 3.29Å; S4-D6 PolarHBondContact O-N 3.01Å; S4-K8 VanDerWaalsContact O-CB 3.26Å; S4-K8 WeakPolarHBondContact O-CB 3.3Å; S4-K8 WeakPolarHBondContact O-CD 3.4Å; S4-K8 WeakPolarHBondContact O-CG 3.47Å; S4-K8 PolarHBondContact O-N 2.97Å; S4-K8 VanDerWaalsContact O-N 3.11Å; S4-K8 WeakPolarHBondContact OG-CE 3.2Å; S4-K8 PolarHBondContact OG-NZ 3.13Å; S4-T145 WeakPolarHBondContact CB-O 2.95Å; S4-T145 PolarHBondContact OG-O 2.89Å
5A85.9Confident84.5Confident26 Ų2636.5 Ų36.522%0.21522%0.217CC..Hα-helixtrans-71.6-24.4-17800000113.2D2 W3 P9D2-A5 HydrophobicContact CB-CB 4.48Å; D2-A5 PolarHBondContact O-N 3.09Å; D2-A5 VanDerWaalsContact O-N 3.08Å; W3-A5 VanDerWaalsContact C-N 3.27Å; W3-A5 PolarHBondContact O-N 3.47Å; A5-P9 VanDerWaalsContact O-CD 3.25Å; A5-P9 WeakPolarHBondContact O-CD 3.23Å; A5-P9 WeakPolarHBondContact O-CG 3.43Å
6D87.8Confident84.4Confident3 Ų335.3 Ų35.32%0.01621%0.208CC..Hα-helixtrans-92.7-38.8179-64.6-43.7000112.5W3 S4 Y23 R26 T30 F52W3-D6 PolarHBondContact O-N 3.27Å; S4-D6 VanDerWaalsContact C-N 3.29Å; S4-D6 PolarHBondContact O-N 3.01Å; D6-Y23 PolarHBondContact O-OH 2.67Å; D6-R26 WeakPolarHBondContact OD1-CD 3.25Å; D6-R26 VanDerWaalsContact OD1-CG 3.3Å; D6-R26 WeakPolarHBondContact OD1-CG 3.32Å; D6-T30 HydrophobicContact CB-CG2 4.22Å; D6-T30 WeakPolarHBondContact OD2-CB 3.46Å; D6-T30 VanDerWaalsContact OD2-CG2 3.3Å; D6-T30 WeakPolarHBondContact OD2-CG2 3.15Å; D6-T30 PolarHBondContact OD2-OG1 3Å; D6-F52 HydrophobicContact CB-CE2 4.41Å
7V88.7Confident84.3Confident4 Ų438.3 Ų38.32%0.02424%0.238CC..Hα-helixtrans-77.2-45.5-177.5171.50000111.6W3 L10 L11 F48 F52 L133W3-V7 HydrophobicContact CE3-CG2 3.96Å; W3-V7 VanDerWaalsContact O-CB 3.29Å; W3-V7 WeakPolarHBondContact O-CB 3.24Å; W3-V7 VanDerWaalsContact O-CG2 3.3Å; W3-V7 WeakPolarHBondContact O-CG2 3.47Å; W3-V7 PolarHBondContact O-N 3.01Å; V7-L10 WeakPolarHBondContact O-CB 3.36Å; V7-L10 PolarHBondContact O-N 3.03Å; V7-L11 HydrophobicContact CG1-CD1 4.32Å; V7-L11 HydrophobicContact CG1-CD2 4.24Å; V7-L11 HydrophobicContact CG1-CG 4.23Å; V7-L11 WeakPolarHBondContact O-CG 3.49Å; V7-L11 PolarHBondContact O-N 2.8Å; V7-F48 HydrophobicContact CG2-CE2 4.17Å; V7-F48 HydrophobicContact CG2-CZ 4.16Å; V7-F52 HydrophobicContact CG2-CD2 4.19Å; V7-F52 HydrophobicContact CG2-CE2 4.36Å; V7-L133 HydrophobicContact CG1-CD2 3.99Å; V7-L133 HydrophobicContact CG1-CG 4.19Å
8K86.8Confident84.4Confident54 Ų5439.6 Ų39.624%0.23525%0.246CC..Hα-helixtrans-56-44-173.2-76.5174.1-176.2157.10113.8S4 L10 L11 E149 I150S4-K8 VanDerWaalsContact O-CB 3.26Å; S4-K8 WeakPolarHBondContact O-CB 3.3Å; S4-K8 WeakPolarHBondContact O-CD 3.4Å; S4-K8 WeakPolarHBondContact O-CG 3.47Å; S4-K8 PolarHBondContact O-N 2.97Å; S4-K8 VanDerWaalsContact O-N 3.11Å; S4-K8 WeakPolarHBondContact OG-CE 3.2Å; S4-K8 PolarHBondContact OG-NZ 3.13Å; K8-L10 VanDerWaalsContact C-N 3.26Å; K8-L10 PolarHBondContact O-N 2.9Å; K8-L11 VanDerWaalsContact O-CB 3.31Å; K8-L11 WeakPolarHBondContact O-CB 3.27Å; K8-L11 PolarHBondContact O-N 2.78Å; K8-E149 IonicContact NZ-OE1 3.84Å; K8-E149 PolarHBondContact NZ-OE1 2.89Å; K8-E149 IonicContact NZ-OE2 2.83Å; K8-E149 PolarHBondContact NZ-OE2 3.19Å; K8-I150 HydrophobicContact CG-CD1 4.4Å
9P89.4Confident84.3Confident25 Ų2545.6 Ų45.616%0.16226%0.264CS..Hα-helixtrans-60.8-36.7178.9-25.338.3000112.4A5 L11 S12 F15 Y23A5-P9 VanDerWaalsContact O-CD 3.25Å; A5-P9 WeakPolarHBondContact O-CD 3.23Å; A5-P9 WeakPolarHBondContact O-CG 3.43Å; P9-L11 PolarHBondContact O-N 3.08Å; P9-S12 PolarHBondContact O-N 2.98Å; P9-F15 HydrophobicContact CB-CD1 3.43Å; P9-F15 VanDerWaalsContact CB-CD1 3.43Å; P9-F15 HydrophobicContact CB-CD2 3.87Å; P9-F15 HydrophobicContact CB-CE1 3.3Å; P9-F15 HydrophobicContact CB-CE2 3.75Å; P9-F15 HydrophobicContact CB-CG 3.73Å; P9-F15 HydrophobicContact CB-CZ 3.47Å; P9-F15 VanDerWaalsContact CB-CZ 3.47Å; P9-F15 HydrophobicContact CG-CE1 4.49Å; P9-F15 HydrophobicContact CG-CZ 4.32Å; P9-F15 WeakPolarHBondContact O-CB 3.43Å; P9-F15 WeakPolarHBondContact O-CD1 3.35Å; P9-F15 WeakPolarHBondContact O-CG 3.24Å; P9-Y23 HydrophobicContact CB-CD2 4.37Å; P9-Y23 HydrophobicContact CB-CE1 4.41Å; P9-Y23 HydrophobicContact CB-CE2 3.79Å; P9-Y23 HydrophobicContact CG-CD2 4.06Å; P9-Y23 HydrophobicContact CG-CE2 3.53Å
10L90.5Very high84.5Confident0 Ų046.6 Ų46.60%027%0.268CS..Hα-helixtrans-68.6-12.6176.4-55177.2000113.9V7 K8 F16 Y23 F52 L55 S130 L133V7-L10 WeakPolarHBondContact O-CB 3.36Å; V7-L10 PolarHBondContact O-N 3.03Å; K8-L10 VanDerWaalsContact C-N 3.26Å; K8-L10 PolarHBondContact O-N 2.9Å; L10-F16 HydrophobicContact CB-CZ 4.21Å; L10-F16 HydrophobicContact CD2-CE1 3.96Å; L10-F16 HydrophobicContact CD2-CZ 3.9Å; L10-F16 WeakPolarHBondContact O-CE2 2.86Å; L10-Y23 HydrophobicContact CD2-CE1 4.35Å; L10-Y23 WeakPolarHBondContact CD2-OH 3.46Å; L10-Y23 VanDerWaalsContact CG-OH 3.25Å; L10-Y23 WeakPolarHBondContact CG-OH 3.42Å; L10-F52 HydrophobicContact CD1-CD2 3.79Å; L10-F52 HydrophobicContact CD1-CE2 3.83Å; L10-L55 HydrophobicContact CB-CB 4.27Å; L10-L55 HydrophobicContact CB-CD1 4.19Å; L10-L55 HydrophobicContact CD1-CB 4.14Å; L10-L55 HydrophobicContact CD2-CB 4.33Å; L10-L55 HydrophobicContact CG-CB 4.47Å; L10-S130 PolarHBondContact O-OG 3.24Å; L10-L133 HydrophobicContact CB-CD2 4.4Å
11L87.5Confident84.6Confident23 Ų2346.9 Ų46.912%0.1227%0.272CS..THydrogen-bonded Turntrans-83.5-14.4177.3-59.6-172.7000113.4V7 K8 P9 L133 K134 I150V7-L11 HydrophobicContact CG1-CD1 4.32Å; V7-L11 HydrophobicContact CG1-CD2 4.24Å; V7-L11 HydrophobicContact CG1-CG 4.23Å; V7-L11 WeakPolarHBondContact O-CG 3.49Å; V7-L11 PolarHBondContact O-N 2.8Å; K8-L11 VanDerWaalsContact O-CB 3.31Å; K8-L11 WeakPolarHBondContact O-CB 3.27Å; K8-L11 PolarHBondContact O-N 2.78Å; P9-L11 PolarHBondContact O-N 3.08Å; L11-L133 HydrophobicContact CD2-CB 3.8Å; L11-L133 HydrophobicContact CD2-CD2 3.79Å; L11-L133 HydrophobicContact CD2-CG 3.81Å; L11-K134 HydrophobicContact CD1-CG 4.09Å; L11-K134 HydrophobicContact CD2-CG 3.89Å; L11-K134 HydrophobicContact CG-CG 4.44Å; L11-K134 WeakPolarHBondContact O-CE 3.34Å; L11-K134 PolarHBondContact O-NZ 3.46Å; L11-I150 HydrophobicContact CD1-CD1 4.08Å
12S85.4Confident85.4Confident56 Ų5644.5 Ų44.539%0.39227%0.27SS..  trans-102.9112.7179.1179.40000109.6P9 A14 F15 F16P9-S12 PolarHBondContact O-N 2.98Å; S12-A14 PolarHBondContact O-N 3.17Å; S12-F15 VanDerWaalsContact O-CB 3.26Å; S12-F15 WeakPolarHBondContact O-CB 3.49Å; S12-F15 PolarHBondContact O-N 2.99Å; S12-F16 WeakPolarHBondContact O-CD2 3.41Å
13S78.1Confident85.9Confident54 Ų5441 Ų4138%0.37825%0.251SS..G310 helixtrans-59.1-30.3176.358.20000112.4F15 F16S13-F15 VanDerWaalsContact C-N 3.27Å; S13-F15 PolarHBondContact O-N 3.25Å; S13-F16 PolarHBondContact O-N 2.98Å
14A80.3Confident86.2Confident64 Ų6440.9 Ų40.953%0.52925%0.25SS..G310 helixtrans-67.9-26.4175.900000112.8S12 F16 A17S12-A14 PolarHBondContact O-N 3.17Å; A14-F16 VanDerWaalsContact C-N 3.27Å; A14-F16 PolarHBondContact O-N 3.09Å; A14-A17 PolarHBondContact O-N 3.38Å
15F85.3Confident86.6Confident34 Ų3443.8 Ų43.815%0.14926%0.263CS..G310 helixtrans-67.7-28.1-179.9-175.4-96.3000112.4P9 S12 S13 A17 T18 N20 Y23 Y59P9-F15 HydrophobicContact CB-CD1 3.43Å; P9-F15 VanDerWaalsContact CB-CD1 3.43Å; P9-F15 HydrophobicContact CB-CD2 3.87Å; P9-F15 HydrophobicContact CB-CE1 3.3Å; P9-F15 HydrophobicContact CB-CE2 3.75Å; P9-F15 HydrophobicContact CB-CG 3.73Å; P9-F15 HydrophobicContact CB-CZ 3.47Å; P9-F15 VanDerWaalsContact CB-CZ 3.47Å; P9-F15 HydrophobicContact CG-CE1 4.49Å; P9-F15 HydrophobicContact CG-CZ 4.32Å; P9-F15 WeakPolarHBondContact O-CB 3.43Å; P9-F15 WeakPolarHBondContact O-CD1 3.35Å; P9-F15 WeakPolarHBondContact O-CG 3.24Å; S12-F15 VanDerWaalsContact O-CB 3.26Å; S12-F15 WeakPolarHBondContact O-CB 3.49Å; S12-F15 PolarHBondContact O-N 2.99Å; S13-F15 VanDerWaalsContact C-N 3.27Å; S13-F15 PolarHBondContact O-N 3.25Å; F15-A17 PolarHBondContact O-N 3.12Å; F15-T18 WeakPolarHBondContact CD2-OG1 3.3Å; F15-T18 WeakPolarHBondContact CE2-OG1 3.49Å; F15-T18 WeakPolarHBondContact O-CA 3.48Å; F15-T18 WeakPolarHBondContact O-CB 2.89Å; F15-T18 PolarHBondContact O-N 3.04Å; F15-T18 PolarHBondContact O-OG1 3.24Å; F15-N20 HydrophobicContact CZ-CB 4.48Å; F15-Y23 AromaticContact CE1-CD1 3.49Å; F15-Y23 HydrophobicContact CE1-CD1 3.49Å; F15-Y23 VanDerWaalsContact CE1-CD1 3.49Å; F15-Y23 AromaticContact CE1-CE1 3.5Å; F15-Y23 HydrophobicContact CE1-CE1 3.5Å; F15-Y23 VanDerWaalsContact CE1-CE1 3.5Å; F15-Y23 HydrophobicContact CE1-CG 4.05Å; F15-Y23 AromaticContact CZ-CD1 3.63Å; F15-Y23 HydrophobicContact CZ-CD1 3.63Å; F15-Y23 HydrophobicContact CZ-CD2 4.21Å; F15-Y23 HydrophobicContact CZ-CE1 4.05Å; F15-Y23 AromaticContact CZ-CG 3.72Å; F15-Y23 HydrophobicContact CZ-CG 3.72Å; F15-Y59 HydrophobicContact CD1-CD2 4.27Å; F15-Y59 AromaticContact CD1-CE2 3.88Å; F15-Y59 HydrophobicContact CD1-CE2 3.88Å; F15-Y59 HydrophobicContact CE1-CD2 4.05Å; F15-Y59 AromaticContact CE1-CE2 3.41Å; F15-Y59 HydrophobicContact CE1-CE2 3.41Å; F15-Y59 VanDerWaalsContact CE1-CE2 3.41Å; F15-Y59 AromaticContact CE1-CZ 3.9Å; F15-Y59 HydrophobicContact CZ-CE2 4.24Å
16F83.7Confident86.9Confident16 Ų1648.4 Ų48.47%0.0728%0.275CS..G310 helixtrans-67.4-18.5175.9-64.8-88.7000113.2L10 S12 S13 A14 T18 L55 H58 Y59 H63 I126L10-F16 HydrophobicContact CB-CZ 4.21Å; L10-F16 HydrophobicContact CD2-CE1 3.96Å; L10-F16 HydrophobicContact CD2-CZ 3.9Å; L10-F16 WeakPolarHBondContact O-CE2 2.86Å; S12-F16 WeakPolarHBondContact O-CD2 3.41Å; S13-F16 PolarHBondContact O-N 2.98Å; A14-F16 VanDerWaalsContact C-N 3.27Å; A14-F16 PolarHBondContact O-N 3.09Å; F16-T18 VanDerWaalsContact C-N 3.34Å; F16-L55 HydrophobicContact CE1-CB 4.49Å; F16-L55 HydrophobicContact CE1-CD2 4.34Å; F16-L55 HydrophobicContact CZ-CB 4.23Å; F16-L55 HydrophobicContact CZ-CD2 3.81Å; F16-L55 HydrophobicContact CZ-CG 4.46Å; F16-H58 AromaticContact CD1-CD2 3.53Å; F16-H58 AromaticContact CE1-CD2 3.81Å; F16-Y59 HydrophobicContact CD1-CD2 4.1Å; F16-H63 PolarHBondContact O-CE1 3.03Å; F16-H63 PolarHBondContact O-NE2 3.39Å; F16-H63 VanDerWaalsContact O-NE2 3.15Å; F16-I126 HydrophobicContact CD2-CG2 3.61Å; F16-I126 HydrophobicContact CE1-CG2 4.45Å; F16-I126 HydrophobicContact CE2-CG2 3.48Å; F16-I126 VanDerWaalsContact CE2-CG2 3.48Å; F16-I126 HydrophobicContact CG-CG2 4.16Å; F16-I126 HydrophobicContact CZ-CG2 3.94Å
17A82.9Confident87.2Confident87 Ų8748.2 Ų48.272%0.71927%0.274SS*.G310 helixtrans-82.5-16.2169.400000112.2A14 F15A14-A17 PolarHBondContact O-N 3.38Å; F15-A17 PolarHBondContact O-N 3.12Å
18T84.8Confident87.5Confident61 Ų6148 Ų4837%0.37427%0.273SS..SBendtrans-85.2121.8-177.168.70000111F15 F16 N20 Y59F15-T18 WeakPolarHBondContact CD2-OG1 3.3Å; F15-T18 WeakPolarHBondContact CE2-OG1 3.49Å; F15-T18 WeakPolarHBondContact O-CA 3.48Å; F15-T18 WeakPolarHBondContact O-CB 2.89Å; F15-T18 PolarHBondContact O-N 3.04Å; F15-T18 PolarHBondContact O-OG1 3.24Å; F16-T18 VanDerWaalsContact C-N 3.34Å; T18-N20 PolarHBondContact O-N 3.2Å; T18-Y59 PolarHBondContact O-OH 3.25Å
19R83.8Confident87.9Confident155 Ų15549.8 Ų49.859%0.58528%0.282SS*.  trans-8686.9-178.8-166.4178.4-134.3-136-9.4109.9P21 A65 T66R19-P21 WeakPolarHBondContact O-CD 3.45Å; R19-A65 VanDerWaalsContact NH2-C 3.25Å; R19-T66 HydrophobicContact CG-CG2 3.08Å; R19-T66 VanDerWaalsContact NH2-N 3.14Å
20N87.8Confident88.1Confident64 Ų6448.9 Ų48.934%0.34228%0.276SS..  trans-109.8101.2-179.7-172.4-23.3000111.9F15 T18 A22 Y23 L24 Y59F15-N20 HydrophobicContact CZ-CB 4.48Å; T18-N20 PolarHBondContact O-N 3.2Å; N20-A22 VanDerWaalsContact C-N 3.35Å; N20-A22 PolarHBondContact O-N 2.87Å; N20-A22 WeakPolarHBondContact OD1-CB 3.41Å; N20-A22 PolarHBondContact OD1-N 3.16Å; N20-A22 VanDerWaalsContact OD1-N 3.09Å; N20-Y23 PolarHBondContact O-N 3.19Å; N20-Y23 PolarHBondContact OD1-N 2.63Å; N20-L24 PolarHBondContact O-N 3.36Å; N20-Y59 PolarHBondContact N-OH 2.78Å; N20-Y59 PolarHBondContact O-OH 3.26Å
21P86Confident88.3Confident54 Ų5448.9 Ų48.935%0.35128%0.276SS..Hα-helixtrans-67.7-32.2-178.826-33.3000112.9R19 L24 K25 L70R19-P21 WeakPolarHBondContact O-CD 3.45Å; P21-L24 WeakPolarHBondContact O-CB 3.1Å; P21-L24 PolarHBondContact O-N 3.19Å; P21-K25 PolarHBondContact O-N 3.25Å; P21-L70 HydrophobicContact CB-CD2 3.97Å
22A89Confident88.7Confident66 Ų6649.9 Ų49.955%0.54528%0.284SS..Hα-helixtrans-67.3-38.917700000111.5N20 R26N20-A22 VanDerWaalsContact C-N 3.35Å; N20-A22 PolarHBondContact O-N 2.87Å; N20-A22 WeakPolarHBondContact OD1-CB 3.41Å; N20-A22 PolarHBondContact OD1-N 3.16Å; N20-A22 VanDerWaalsContact OD1-N 3.09Å; A22-R26 WeakPolarHBondContact O-CB 3.27Å; A22-R26 PolarHBondContact O-N 3.14Å
23Y91.7Very high89.1Confident10 Ų1050.3 Ų50.34%0.03929%0.291CS..Hα-helixtrans-69.7-39.5173.5-179-97.6000111.8D6 P9 L10 F15 N20 K25 R26 L27 Y59D6-Y23 PolarHBondContact O-OH 2.67Å; P9-Y23 HydrophobicContact CB-CD2 4.37Å; P9-Y23 HydrophobicContact CB-CE1 4.41Å; P9-Y23 HydrophobicContact CB-CE2 3.79Å; P9-Y23 HydrophobicContact CG-CD2 4.06Å; P9-Y23 HydrophobicContact CG-CE2 3.53Å; L10-Y23 HydrophobicContact CD2-CE1 4.35Å; L10-Y23 WeakPolarHBondContact CD2-OH 3.46Å; L10-Y23 VanDerWaalsContact CG-OH 3.25Å; L10-Y23 WeakPolarHBondContact CG-OH 3.42Å; F15-Y23 AromaticContact CE1-CD1 3.49Å; F15-Y23 HydrophobicContact CE1-CD1 3.49Å; F15-Y23 VanDerWaalsContact CE1-CD1 3.49Å; F15-Y23 AromaticContact CE1-CE1 3.5Å; F15-Y23 HydrophobicContact CE1-CE1 3.5Å; F15-Y23 VanDerWaalsContact CE1-CE1 3.5Å; F15-Y23 HydrophobicContact CE1-CG 4.05Å; F15-Y23 AromaticContact CZ-CD1 3.63Å; F15-Y23 HydrophobicContact CZ-CD1 3.63Å; F15-Y23 HydrophobicContact CZ-CD2 4.21Å; F15-Y23 HydrophobicContact CZ-CE1 4.05Å; F15-Y23 AromaticContact CZ-CG 3.72Å; F15-Y23 HydrophobicContact CZ-CG 3.72Å; N20-Y23 PolarHBondContact O-N 3.19Å; N20-Y23 PolarHBondContact OD1-N 2.63Å; Y23-K25 PolarHBondContact O-N 3.24Å; Y23-R26 PolarHBondContact O-N 3.24Å; Y23-L27 HydrophobicContact CE1-CB 4.3Å; Y23-L27 HydrophobicContact CE1-CD2 3.98Å; Y23-L27 VanDerWaalsContact O-CB 3.28Å; Y23-L27 WeakPolarHBondContact O-CB 3.26Å; Y23-L27 PolarHBondContact O-N 3.38Å; Y23-Y59 HydrophobicContact CD1-CD1 4Å; Y23-Y59 AromaticContact CD1-CE1 3.45Å; Y23-Y59 HydrophobicContact CD1-CE1 3.45Å; Y23-Y59 VanDerWaalsContact CD1-CE1 3.45Å; Y23-Y59 HydrophobicContact CD1-CE2 4.14Å; Y23-Y59 AromaticContact CD1-CZ 3.53Å; Y23-Y59 AromaticContact CE1-CD1 3.98Å; Y23-Y59 HydrophobicContact CE1-CD1 3.98Å; Y23-Y59 HydrophobicContact CE1-CD2 4.41Å; Y23-Y59 AromaticContact CE1-CE1 3.91Å; Y23-Y59 HydrophobicContact CE1-CE1 3.91Å; Y23-Y59 HydrophobicContact CE1-CE2 4.32Å; Y23-Y59 HydrophobicContact CE1-CG 4.25Å
24L91.7Very high89.8Confident1 Ų147.8 Ų47.81%0.00527%0.273CS..Hα-helixtrans-56-50.3175.117960.7000111.7N20 P21 L27 A28 Y59 I60 H63 T66 L70 I78N20-L24 PolarHBondContact O-N 3.36Å; P21-L24 WeakPolarHBondContact O-CB 3.1Å; P21-L24 PolarHBondContact O-N 3.19Å; L24-L27 PolarHBondContact O-N 3.01Å; L24-A28 PolarHBondContact O-N 3.2Å; L24-A28 VanDerWaalsContact O-N 3.16Å; L24-Y59 HydrophobicContact CB-CE1 4.09Å; L24-Y59 HydrophobicContact CD1-CD1 4.22Å; L24-Y59 HydrophobicContact CD1-CE1 4.21Å; L24-I60 HydrophobicContact CD1-CB 4.1Å; L24-I60 HydrophobicContact CD1-CG1 3.68Å; L24-I60 HydrophobicContact CD1-CG2 4.35Å; L24-H63 HydrophobicContact CD2-CB 4.45Å; L24-T66 WeakPolarHBondContact CD2-OG1 3.15Å; L24-L70 HydrophobicContact CD2-CD1 4.02Å; L24-I78 HydrophobicContact CD1-CD1 4.5Å; L24-I78 HydrophobicContact CD2-CD1 4.14Å; L24-I78 HydrophobicContact CG-CD1 4.09Å
25K91.5Very high90.4Very high63 Ų6350.3 Ų50.327%0.27427%0.269SS..Hα-helixtrans-55.9-51.9173.9172.5-177.9-1741360111.5P21 Y23 L27 A28 Q29 D74P21-K25 PolarHBondContact O-N 3.25Å; Y23-K25 PolarHBondContact O-N 3.24Å; K25-L27 PolarHBondContact O-N 3.06Å; K25-A28 PolarHBondContact O-N 2.59Å; K25-Q29 WeakPolarHBondContact O-CG 3.47Å; K25-Q29 PolarHBondContact O-N 3.43Å; K25-D74 VanDerWaalsContact CD-OD1 3.24Å; K25-D74 WeakPolarHBondContact CD-OD1 3.42Å; K25-D74 WeakPolarHBondContact CD-OD2 3.45Å; K25-D74 WeakPolarHBondContact CE-OD1 3.31Å; K25-D74 WeakPolarHBondContact CE-OD2 3.29Å; K25-D74 HydrophobicContact CG-CB 4.46Å; K25-D74 WeakPolarHBondContact CG-OD1 3.47Å; K25-D74 IonicContact NZ-OD1 2.8Å; K25-D74 PolarHBondContact NZ-OD1 3.15Å; K25-D74 IonicContact NZ-OD2 3.86Å; K25-D74 PolarHBondContact NZ-OD2 3.4Å
26R92.5Very high90.8Very high122 Ų12254.1 Ų54.146%0.4629%0.288SS..Hα-helixtrans-58.8-47.7-178.6-177.5-173.9-66.6-173.3-3.6111.6D6 A22 Y23 A28 Q29 T30D6-R26 WeakPolarHBondContact OD1-CD 3.25Å; D6-R26 VanDerWaalsContact OD1-CG 3.3Å; D6-R26 WeakPolarHBondContact OD1-CG 3.32Å; A22-R26 WeakPolarHBondContact O-CB 3.27Å; A22-R26 PolarHBondContact O-N 3.14Å; Y23-R26 PolarHBondContact O-N 3.24Å; R26-A28 VanDerWaalsContact C-N 3.33Å; R26-A28 PolarHBondContact O-N 3.15Å; R26-Q29 WeakPolarHBondContact O-CB 3.37Å; R26-Q29 PolarHBondContact O-N 3.34Å; R26-Q29 VanDerWaalsContact O-N 3.14Å; R26-T30 WeakPolarHBondContact O-CB 3.26Å; R26-T30 PolarHBondContact O-N 2.99Å; R26-T30 PolarHBondContact O-OG1 3.35Å
27L94.5Very high91.1Very high0 Ų056.5 Ų56.50%030%0.299CS..Hα-helixtrans-59.6-44-178.6178.863.4000111.5Y23 L24 K25 T30 I31 F52 Y59 I60Y23-L27 HydrophobicContact CE1-CB 4.3Å; Y23-L27 HydrophobicContact CE1-CD2 3.98Å; Y23-L27 VanDerWaalsContact O-CB 3.28Å; Y23-L27 WeakPolarHBondContact O-CB 3.26Å; Y23-L27 PolarHBondContact O-N 3.38Å; L24-L27 PolarHBondContact O-N 3.01Å; K25-L27 PolarHBondContact O-N 3.06Å; L27-T30 PolarHBondContact O-N 3.12Å; L27-I31 HydrophobicContact CD1-CD1 4.35Å; L27-I31 HydrophobicContact CG-CD1 4.25Å; L27-I31 VanDerWaalsContact O-CG1 3.32Å; L27-I31 WeakPolarHBondContact O-CG1 3.44Å; L27-I31 PolarHBondContact O-N 3.23Å; L27-F52 HydrophobicContact CD1-CE2 4.14Å; L27-F52 HydrophobicContact CD1-CZ 3.86Å; L27-Y59 HydrophobicContact CD2-CD1 3.93Å; L27-Y59 HydrophobicContact CD2-CG 4.38Å; L27-I60 HydrophobicContact CD2-CD1 4.24Å; L27-I60 HydrophobicContact CD2-CG1 4.04Å; L27-I60 HydrophobicContact CG-CD1 4.33Å
28A94.2Very high91.6Very high0 Ų052.4 Ų52.40%027%0.265CS..Hα-helixtrans-61.1-45.7175.100000111.7L24 K25 R26 T30 I31 C32 A77 I78 A81L24-A28 PolarHBondContact O-N 3.2Å; L24-A28 VanDerWaalsContact O-N 3.16Å; K25-A28 PolarHBondContact O-N 2.59Å; R26-A28 VanDerWaalsContact C-N 3.33Å; R26-A28 PolarHBondContact O-N 3.15Å; A28-T30 PolarHBondContact O-N 3.47Å; A28-I31 PolarHBondContact O-N 2.9Å; A28-C32 PolarHBondContact O-N 3.29Å; A28-C32 VanDerWaalsContact O-N 3.08Å; A28-C32 PolarHBondContact O-SG 3.19Å; A28-C32 VanDerWaalsContact O-SG 3.42Å; A28-A77 HydrophobicContact CB-CB 4.49Å; A28-I78 HydrophobicContact CB-CG1 3.9Å; A28-A81 HydrophobicContact CB-CB 4.09Å
29Q94.4Very high91.9Very high90 Ų9051.5 Ų51.542%0.42126%0.256SS..Hα-helixtrans-62.4-41.9176.8-69.1175.2-13.200112.3K25 R26 C32 A33 A77K25-Q29 WeakPolarHBondContact O-CG 3.47Å; K25-Q29 PolarHBondContact O-N 3.43Å; R26-Q29 WeakPolarHBondContact O-CB 3.37Å; R26-Q29 PolarHBondContact O-N 3.34Å; R26-Q29 VanDerWaalsContact O-N 3.14Å; Q29-C32 PolarHBondContact O-N 3.01Å; Q29-A33 VanDerWaalsContact O-CB 3.29Å; Q29-A33 WeakPolarHBondContact O-CB 3.25Å; Q29-A33 PolarHBondContact O-N 3.36Å; Q29-A77 HydrophobicContact CG-CB 4.48Å
30T94.5Very high92.1Very high7 Ų748.8 Ų48.84%0.04326%0.257CS..Hα-helixtrans-60.4-47.6175.8-73.90000111.3M1 D6 R26 L27 A28 C32 A33 C34 F52M1-T30 HydrophobicContact SD-CG2 3.67Å; D6-T30 HydrophobicContact CB-CG2 4.22Å; D6-T30 WeakPolarHBondContact OD2-CB 3.46Å; D6-T30 VanDerWaalsContact OD2-CG2 3.3Å; D6-T30 WeakPolarHBondContact OD2-CG2 3.15Å; D6-T30 PolarHBondContact OD2-OG1 3Å; R26-T30 WeakPolarHBondContact O-CB 3.26Å; R26-T30 PolarHBondContact O-N 2.99Å; R26-T30 PolarHBondContact O-OG1 3.35Å; L27-T30 PolarHBondContact O-N 3.12Å; A28-T30 PolarHBondContact O-N 3.47Å; T30-C32 VanDerWaalsContact C-N 3.3Å; T30-C32 PolarHBondContact O-N 3.12Å; T30-A33 PolarHBondContact O-N 3.39Å; T30-C34 WeakPolarHBondContact O-CB 3.44Å; T30-C34 PolarHBondContact O-N 2.54Å; T30-F52 HydrophobicContact CG2-CZ 4.04Å
31I95.6Very high92.2Very high0 Ų047.3 Ų47.30%025%0.248CC..Hα-helixtrans-58.4-44.6176.9-69.3167.2000110.6L27 A28 I38 F52 L53 I60 A81 L84 V85L27-I31 HydrophobicContact CD1-CD1 4.35Å; L27-I31 HydrophobicContact CG-CD1 4.25Å; L27-I31 VanDerWaalsContact O-CG1 3.32Å; L27-I31 WeakPolarHBondContact O-CG1 3.44Å; L27-I31 PolarHBondContact O-N 3.23Å; A28-I31 PolarHBondContact O-N 2.9Å; I31-I38 HydrophobicContact CG2-CD1 4.39Å; I31-F52 HydrophobicContact CG1-CE1 4.04Å; I31-F52 HydrophobicContact CG1-CZ 4.47Å; I31-L53 HydrophobicContact CD1-CD2 4.36Å; I31-L53 HydrophobicContact CG1-CD2 4.09Å; I31-L53 HydrophobicContact CG2-CD2 4.15Å; I31-I60 HydrophobicContact CD1-CD1 3.94Å; I31-A81 HydrophobicContact CB-CB 4.01Å; I31-A81 HydrophobicContact CD1-CB 4.44Å; I31-A81 HydrophobicContact CG2-CB 3.89Å; I31-L84 HydrophobicContact CG2-CB 4.46Å; I31-L84 HydrophobicContact CG2-CD1 4.36Å; I31-L84 HydrophobicContact CG2-CD2 3.99Å; I31-L84 VanDerWaalsContact O-CD1 3.24Å; I31-L84 WeakPolarHBondContact O-CD1 3.42Å; I31-V85 HydrophobicContact CG2-CG2 4.39Å
32C95Very high92.3Very high44 Ų4446.5 Ų46.530%0.29725%0.245SC..Hα-helixtrans-65.2-44.3177.9-70.90000113.1A28 Q29 T30 C34 R35 A81A28-C32 PolarHBondContact O-N 3.29Å; A28-C32 VanDerWaalsContact O-N 3.08Å; A28-C32 PolarHBondContact O-SG 3.19Å; A28-C32 VanDerWaalsContact O-SG 3.42Å; Q29-C32 PolarHBondContact O-N 3.01Å; T30-C32 VanDerWaalsContact C-N 3.3Å; T30-C32 PolarHBondContact O-N 3.12Å; C32-C34 VanDerWaalsContact C-N 3.35Å; C32-R35 WeakPolarHBondContact O-CB 3.21Å; C32-R35 PolarHBondContact O-N 3.24Å; C32-A81 PolarHBondContact SG-N 3.3Å; C32-A81 VanDerWaalsContact SG-N 3.37Å
33A93.8Very high92.2Very high64 Ų6448 Ų4853%0.52925%0.25SC..Hα-helixtrans-72.5-28.7-17700000112.4M1 Q29 T30 R35M1-A33 HydrophobicContact CE-CB 3.3Å; Q29-A33 VanDerWaalsContact O-CB 3.29Å; Q29-A33 WeakPolarHBondContact O-CB 3.25Å; Q29-A33 PolarHBondContact O-N 3.36Å; T30-A33 PolarHBondContact O-N 3.39Å; A33-R35 VanDerWaalsContact C-N 3.28Å; A33-R35 PolarHBondContact O-N 2.96Å
34C92.2Very high92Very high1 Ų152.3 Ų52.31%0.00727%0.27CS..THydrogen-bonded Turntrans-90.223.1176.2-76.30000114.4M1 W3 T30 C32 E36 E37 I38M1-C34 WeakPolarHBondContact CE-SG 3.45Å; M1-C34 PolarHBondContact SD-SG 3.46Å; W3-C34 HydrophobicContact CH2-CB 4.12Å; W3-C34 HydrophobicContact CZ2-CB 3.85Å; W3-C34 WeakPolarHBondContact CZ2-SG 3.45Å; T30-C34 WeakPolarHBondContact O-CB 3.44Å; T30-C34 PolarHBondContact O-N 2.54Å; C32-C34 VanDerWaalsContact C-N 3.35Å; C34-E36 PolarHBondContact O-N 3.07Å; C34-E37 WeakPolarHBondContact CA-OE2 3.28Å; C34-E37 PolarHBondContact O-N 2.8Å; C34-I38 HydrophobicContact CB-CD1 4.15Å; C34-I38 HydrophobicContact CB-CG1 4.42Å; C34-I38 WeakPolarHBondContact O-CB 3.37Å; C34-I38 WeakPolarHBondContact O-CD1 3.48Å; C34-I38 WeakPolarHBondContact O-CG1 3.45Å; C34-I38 PolarHBondContact O-N 2.71Å
35R94.2Very high91.9Very high118 Ų11853.9 Ų53.945%0.44528%0.277SS..Hα-helixtrans-55-50.9-177.3-179.6179.8171.7-163.5-7.9112.2C32 A33 E37 I38 F39 L84C32-R35 WeakPolarHBondContact O-CB 3.21Å; C32-R35 PolarHBondContact O-N 3.24Å; A33-R35 VanDerWaalsContact C-N 3.28Å; A33-R35 PolarHBondContact O-N 2.96Å; R35-E37 VanDerWaalsContact C-N 3.31Å; R35-E37 PolarHBondContact O-N 3.27Å; R35-I38 PolarHBondContact O-N 2.98Å; R35-F39 HydrophobicContact CG-CD2 4.1Å; R35-F39 HydrophobicContact CG-CE2 4.3Å; R35-F39 VanDerWaalsContact O-CD2 3.26Å; R35-F39 WeakPolarHBondContact O-CD2 3.16Å; R35-F39 PolarHBondContact O-N 2.94Å; R35-L84 HydrophobicContact CB-CD1 3.56Å; R35-L84 HydrophobicContact CG-CD1 3.69Å; R35-L84 HydrophobicContact CG-CG 4.27Å
36E92.3Very high91.8Very high114 Ų11452 Ų5253%0.53327%0.269SS..Hα-helixtrans-64.5-40.7-175.9-67.1-55.4138.200110.4C34 I38 F39 T40C34-E36 PolarHBondContact O-N 3.07Å; E36-I38 PolarHBondContact O-N 2.58Å; E36-F39 PolarHBondContact O-N 2.83Å; E36-T40 WeakPolarHBondContact O-CA 3.37Å; E36-T40 WeakPolarHBondContact O-CB 3.1Å; E36-T40 PolarHBondContact O-N 3.41Å; E36-T40 PolarHBondContact O-OG1 3.41Å
37E91.1Very high91.5Very high66 Ų6647.8 Ų47.831%0.30826%0.257SS..Hα-helixtrans-65.9-38.4177.2-59.694.1144.900112.6C34 R35 H41 Y49C34-E37 WeakPolarHBondContact CA-OE2 3.28Å; C34-E37 PolarHBondContact O-N 2.8Å; R35-E37 VanDerWaalsContact C-N 3.31Å; R35-E37 PolarHBondContact O-N 3.27Å; E37-H41 WeakPolarHBondContact O-CB 3.3Å; E37-H41 PolarHBondContact O-ND1 2.65Å; E37-Y49 HydrophobicContact CB-CE1 4.34Å
38I92Very high91.4Very high0 Ų047.8 Ų47.80%026%0.257CS..Hα-helixtrans-65.7-38.7176.3-73.5162.2000111I31 C34 R35 E36 H41 Y49 L53 L84 F88I31-I38 HydrophobicContact CG2-CD1 4.39Å; C34-I38 HydrophobicContact CB-CD1 4.15Å; C34-I38 HydrophobicContact CB-CG1 4.42Å; C34-I38 WeakPolarHBondContact O-CB 3.37Å; C34-I38 WeakPolarHBondContact O-CD1 3.48Å; C34-I38 WeakPolarHBondContact O-CG1 3.45Å; C34-I38 PolarHBondContact O-N 2.71Å; R35-I38 PolarHBondContact O-N 2.98Å; E36-I38 PolarHBondContact O-N 2.58Å; I38-H41 PolarHBondContact O-CE1 3.42Å; I38-H41 PolarHBondContact O-ND1 2.96Å; I38-Y49 HydrophobicContact CG1-CD1 3.84Å; I38-Y49 HydrophobicContact CG1-CE1 4.23Å; I38-L53 HydrophobicContact CD1-CD2 4.03Å; I38-L53 HydrophobicContact CG2-CD1 3.79Å; I38-L84 HydrophobicContact CD1-CD2 3.94Å; I38-L84 HydrophobicContact CG2-CD2 4.01Å; I38-F88 HydrophobicContact CG2-CB 4.35Å; I38-F88 HydrophobicContact CG2-CD2 3.49Å; I38-F88 VanDerWaalsContact CG2-CD2 3.49Å; I38-F88 HydrophobicContact CG2-CE2 3.98Å; I38-F88 HydrophobicContact CG2-CG 4Å; I38-F88 WeakPolarHBondContact O-CE2 3.39Å
39F91.4Very high91.2Very high42 Ų4247.9 Ų47.918%0.18426%0.257CS..Hα-helixtrans-87.6-35.8-177.6-81.4-99.3000113.1R35 E36 L84 R87 F88 D91R35-F39 HydrophobicContact CG-CD2 4.1Å; R35-F39 HydrophobicContact CG-CE2 4.3Å; R35-F39 VanDerWaalsContact O-CD2 3.26Å; R35-F39 WeakPolarHBondContact O-CD2 3.16Å; R35-F39 PolarHBondContact O-N 2.94Å; E36-F39 PolarHBondContact O-N 2.83Å; F39-L84 HydrophobicContact CE2-CD2 3.76Å; F39-L84 HydrophobicContact CE2-CG 3.9Å; F39-R87 HydrophobicContact CE1-CB 4.25Å; F39-R87 HydrophobicContact CZ-CB 3.71Å; F39-F88 HydrophobicContact CE1-CB 4.42Å; F39-F88 HydrophobicContact CE2-CB 4.16Å; F39-F88 HydrophobicContact CZ-CB 3.86Å; F39-F88 VanDerWaalsContact CZ-N 3.34Å; F39-D91 HydrophobicContact CE1-CB 4.31Å
40T89.4Confident91.1Very high99 Ų9943.8 Ų43.861%0.60724%0.238SC*.SBendtrans-117.578-173.866.80000110.2E36E36-T40 WeakPolarHBondContact O-CA 3.37Å; E36-T40 WeakPolarHBondContact O-CB 3.1Å; E36-T40 PolarHBondContact O-N 3.41Å; E36-T40 PolarHBondContact O-OG1 3.41Å
41H89.5Confident90.8Very high33 Ų3343.5 Ų43.515%0.15324%0.237CC..  trans-127.9160.5170.753.9-98.8000111E37 I38 F45 E46 Y49 R92E37-H41 WeakPolarHBondContact O-CB 3.3Å; E37-H41 PolarHBondContact O-ND1 2.65Å; I38-H41 PolarHBondContact O-CE1 3.42Å; I38-H41 PolarHBondContact O-ND1 2.96Å; H41-F45 HydrophobicContact CB-CB 4.49Å; H41-E46 IonicContact CD2-OE2 2.73Å; H41-E46 IonicContact CE1-OE2 3.02Å; H41-E46 WeakPolarHBondContact NE2-CA 3.44Å; H41-E46 IonicContact NE2-OE2 3.28Å; H41-E46 PolarHBondContact NE2-OE2 3.46Å; H41-Y49 HydrophobicContact CB-CD2 4.01Å; H41-Y49 HydrophobicContact CB-CE2 3.47Å; H41-Y49 VanDerWaalsContact CB-CE2 3.47Å; H41-Y49 AromaticContact CD2-CD2 3.71Å; H41-Y49 AromaticContact CE1-CD2 3.37Å; H41-Y49 WeakPolarHBondContact CE1-CD2 3.25Å; H41-Y49 AromaticContact CE1-CG 3.78Å; H41-Y49 AromaticContact CG-CD2 3.41Å; H41-Y49 VanDerWaalsContact CG-CD2 3.41Å; H41-Y49 AromaticContact CG-CE2 3.43Å; H41-Y49 VanDerWaalsContact CG-CE2 3.43Å; H41-Y49 AromaticContact ND1-CD2 3.22Å; H41-Y49 WeakPolarHBondContact ND1-CD2 3.36Å; H41-Y49 AromaticContact ND1-CE2 3.51Å; H41-Y49 AromaticContact ND1-CG 3.83Å; H41-Y49 AromaticContact NE2-CD2 3.69Å; H41-R92 PolarHBondContact CE1-NH2 3.19Å; H41-R92 PolarHBondContact NE2-NH2 3.4Å; H41-R92 VanDerWaalsContact NE2-NH2 3.15Å
42A88.3Confident90.7Very high36 Ų3643.5 Ų43.530%0.29824%0.237SC..  trans-68.2143.4175.700000110.8E44 F45A42-E44 HydrophobicContact CB-CG 4.28Å; A42-E44 VanDerWaalsContact CB-OE1 3.24Å; A42-E44 WeakPolarHBondContact CB-OE1 3.16Å; A42-E44 WeakPolarHBondContact CB-OE2 3.31Å; A42-E44 PolarHBondContact O-N 3.08Å; A42-F45 HydrophobicContact CB-CD2 3.86Å; A42-F45 HydrophobicContact CB-CE2 4Å; A42-F45 PolarHBondContact O-N 3.45Å
43P86.5Confident90.7Very high98 Ų9841.6 Ų41.664%0.63622%0.223SC*.G310 helixtrans-54.8-27.5-173.4-27.235000115.3F45 E46P43-F45 PolarHBondContact O-N 2.65Å; P43-E46 WeakPolarHBondContact O-CB 3.46Å; P43-E46 PolarHBondContact O-N 2.82Å
44E86.9Confident90.6Very high101 Ų10138.7 Ų38.747%0.47220%0.199SC..G310 helixtrans-64.3-22.3175.761.6-91.4-150.800113.5A42 L137A42-E44 HydrophobicContact CB-CG 4.28Å; A42-E44 VanDerWaalsContact CB-OE1 3.24Å; A42-E44 WeakPolarHBondContact CB-OE1 3.16Å; A42-E44 WeakPolarHBondContact CB-OE2 3.31Å; A42-E44 PolarHBondContact O-N 3.08Å; E44-L137 HydrophobicContact CB-CD1 4.27Å
45F90.3Very high90.6Very high34 Ų3438.7 Ų38.715%0.14920%0.199CC..G310 helixtrans-97.8-1.1178.9-54.1-54.5000113.6H41 A42 P43 T47 F48 Y49 L137 L138 P139H41-F45 HydrophobicContact CB-CB 4.49Å; A42-F45 HydrophobicContact CB-CD2 3.86Å; A42-F45 HydrophobicContact CB-CE2 4Å; A42-F45 PolarHBondContact O-N 3.45Å; P43-F45 PolarHBondContact O-N 2.65Å; F45-T47 VanDerWaalsContact C-N 3.29Å; F45-T47 PolarHBondContact O-N 3.14Å; F45-F48 WeakPolarHBondContact O-CB 3.43Å; F45-F48 PolarHBondContact O-N 3.49Å; F45-Y49 HydrophobicContact CB-CD2 4.27Å; F45-Y49 HydrophobicContact CB-CE2 3.99Å; F45-Y49 WeakPolarHBondContact O-CD2 3.34Å; F45-Y49 PolarHBondContact O-N 3.45Å; F45-L137 HydrophobicContact CD1-CB 4.19Å; F45-L137 HydrophobicContact CE1-CB 4.21Å; F45-L138 WeakPolarHBondContact CE1-O 3.17Å; F45-P139 HydrophobicContact CB-CG 4.01Å; F45-P139 HydrophobicContact CD1-CB 4.4Å; F45-P139 HydrophobicContact CD1-CG 4Å; F45-P139 HydrophobicContact CD2-CB 4.48Å; F45-P139 HydrophobicContact CD2-CG 4.41Å; F45-P139 HydrophobicContact CG-CB 4.34Å; F45-P139 HydrophobicContact CG-CG 3.88Å
46E88.2Confident90.6Very high24 Ų2433 Ų3311%0.11218%0.178CC..Hα-helixtrans-55.8-43.7-177.7-179.573.5-157.700112.2H41 P43 F48 Y49 V50 R92H41-E46 IonicContact CD2-OE2 2.73Å; H41-E46 IonicContact CE1-OE2 3.02Å; H41-E46 WeakPolarHBondContact NE2-CA 3.44Å; H41-E46 IonicContact NE2-OE2 3.28Å; H41-E46 PolarHBondContact NE2-OE2 3.46Å; P43-E46 WeakPolarHBondContact O-CB 3.46Å; P43-E46 PolarHBondContact O-N 2.82Å; E46-F48 VanDerWaalsContact C-N 3.25Å; E46-F48 PolarHBondContact O-N 3.33Å; E46-Y49 PolarHBondContact O-N 2.91Å; E46-V50 HydrophobicContact CG-CG2 4.15Å; E46-V50 WeakPolarHBondContact O-CB 3.23Å; E46-V50 VanDerWaalsContact O-CG2 3.27Å; E46-V50 WeakPolarHBondContact O-CG2 3.49Å; E46-V50 PolarHBondContact O-N 3.22Å; E46-V50 WeakPolarHBondContact OE1-CG2 3.32Å; E46-R92 WeakPolarHBondContact OE1-CD 3.39Å; E46-R92 IonicContact OE1-CZ 3.18Å; E46-R92 IonicContact OE1-NE 2.82Å; E46-R92 PolarHBondContact OE1-NE 3.45Å; E46-R92 IonicContact OE1-NH2 2.89Å; E46-R92 IonicContact OE2-CZ 2.65Å; E46-R92 VanDerWaalsContact OE2-CZ 3.26Å; E46-R92 IonicContact OE2-NE 3.5Å; E46-R92 PolarHBondContact OE2-NE 3.26Å; E46-R92 IonicContact OE2-NH2 3.68Å; E46-R92 PolarHBondContact OE2-NH2 2.8Å
47T87.8Confident90.7Very high32 Ų3227.6 Ų27.620%0.19615%0.153CC..Hα-helixtrans-62-34.6179.6-59.30000112.1F45 T51 R100F45-T47 VanDerWaalsContact C-N 3.29Å; F45-T47 PolarHBondContact O-N 3.14Å; T47-T51 WeakPolarHBondContact O-CB 3.48Å; T47-T51 PolarHBondContact O-N 3.4Å; T47-T51 VanDerWaalsContact O-N 3.1Å; T47-T51 PolarHBondContact O-OG1 3.16Å; T47-R100 PolarHBondContact OG1-NH1 2.87Å
48F90.9Very high90.7Very high0 Ų024.6 Ų24.60%014%0.138CC..Hα-helixtrans-62.8-54.6175.4168.7-99.7000111.1W3 V7 F45 E46 T51 F52 L133 T136 L138 P139 V142W3-F48 HydrophobicContact CE3-CE1 4.45Å; W3-F48 AromaticContact CE3-CZ 3.97Å; W3-F48 HydrophobicContact CE3-CZ 3.97Å; W3-F48 HydrophobicContact CH2-CE1 4.23Å; W3-F48 HydrophobicContact CZ3-CE1 4.06Å; W3-F48 AromaticContact CZ3-CZ 3.9Å; W3-F48 HydrophobicContact CZ3-CZ 3.9Å; V7-F48 HydrophobicContact CG2-CE2 4.17Å; V7-F48 HydrophobicContact CG2-CZ 4.16Å; F45-F48 WeakPolarHBondContact O-CB 3.43Å; F45-F48 PolarHBondContact O-N 3.49Å; E46-F48 VanDerWaalsContact C-N 3.25Å; E46-F48 PolarHBondContact O-N 3.33Å; F48-T51 PolarHBondContact O-N 3.35Å; F48-F52 VanDerWaalsContact O-CB 3.28Å; F48-F52 WeakPolarHBondContact O-CB 3.48Å; F48-F52 PolarHBondContact O-N 3.41Å; F48-L133 HydrophobicContact CD2-CD1 3.52Å; F48-L133 HydrophobicContact CE2-CD1 3.73Å; F48-T136 HydrophobicContact CB-CG2 3.7Å; F48-T136 HydrophobicContact CD2-CG2 3.91Å; F48-T136 HydrophobicContact CG-CG2 4.31Å; F48-T136 PolarHBondContact N-OG1 2.78Å; F48-L138 HydrophobicContact CD2-CD2 3.53Å; F48-L138 HydrophobicContact CE2-CD2 3.61Å; F48-L138 HydrophobicContact CG-CD2 4.46Å; F48-P139 HydrophobicContact CD1-CG 3.93Å; F48-P139 HydrophobicContact CE1-CG 4.24Å; F48-V142 HydrophobicContact CE1-CG1 4.45Å; F48-V142 HydrophobicContact CE1-CG2 3.89Å; F48-V142 HydrophobicContact CE2-CG1 4.01Å; F48-V142 HydrophobicContact CZ-CB 4.41Å; F48-V142 HydrophobicContact CZ-CG1 3.72Å; F48-V142 HydrophobicContact CZ-CG2 3.93Å
49Y91.6Very high90.8Very high3 Ų324.6 Ų24.61%0.01214%0.138CC..Hα-helixtrans-66.7-41.6-176.3-69.4-73.5000112.6W3 E37 I38 H41 F45 E46 T51 F52 L53 P139 H141W3-Y49 HydrophobicContact CH2-CE1 4.02Å; W3-Y49 HydrophobicContact CZ2-CE1 4.24Å; E37-Y49 HydrophobicContact CB-CE1 4.34Å; I38-Y49 HydrophobicContact CG1-CD1 3.84Å; I38-Y49 HydrophobicContact CG1-CE1 4.23Å; H41-Y49 HydrophobicContact CB-CD2 4.01Å; H41-Y49 HydrophobicContact CB-CE2 3.47Å; H41-Y49 VanDerWaalsContact CB-CE2 3.47Å; H41-Y49 AromaticContact CD2-CD2 3.71Å; H41-Y49 AromaticContact CE1-CD2 3.37Å; H41-Y49 WeakPolarHBondContact CE1-CD2 3.25Å; H41-Y49 AromaticContact CE1-CG 3.78Å; H41-Y49 AromaticContact CG-CD2 3.41Å; H41-Y49 VanDerWaalsContact CG-CD2 3.41Å; H41-Y49 AromaticContact CG-CE2 3.43Å; H41-Y49 VanDerWaalsContact CG-CE2 3.43Å; H41-Y49 AromaticContact ND1-CD2 3.22Å; H41-Y49 WeakPolarHBondContact ND1-CD2 3.36Å; H41-Y49 AromaticContact ND1-CE2 3.51Å; H41-Y49 AromaticContact ND1-CG 3.83Å; H41-Y49 AromaticContact NE2-CD2 3.69Å; F45-Y49 HydrophobicContact CB-CD2 4.27Å; F45-Y49 HydrophobicContact CB-CE2 3.99Å; F45-Y49 WeakPolarHBondContact O-CD2 3.34Å; F45-Y49 PolarHBondContact O-N 3.45Å; E46-Y49 PolarHBondContact O-N 2.91Å; Y49-T51 VanDerWaalsContact C-N 3.32Å; Y49-T51 PolarHBondContact O-N 2.97Å; Y49-F52 PolarHBondContact O-N 3.06Å; Y49-L53 WeakPolarHBondContact O-CB 3.4Å; Y49-L53 VanDerWaalsContact O-CG 3.27Å; Y49-L53 WeakPolarHBondContact O-CG 3.47Å; Y49-L53 PolarHBondContact O-N 3.35Å; Y49-P139 HydrophobicContact CE2-CG 3.85Å; Y49-H141 PolarHBondContact OH-CE1 3.3Å
50V90.6Very high90.9Very high3 Ų322.6 Ų22.62%0.01813%0.13CC..Hα-helixtrans-59.7-45.4176.3172.20000110.8E46 A54 F88 H103 Y106E46-V50 HydrophobicContact CG-CG2 4.15Å; E46-V50 WeakPolarHBondContact O-CB 3.23Å; E46-V50 VanDerWaalsContact O-CG2 3.27Å; E46-V50 WeakPolarHBondContact O-CG2 3.49Å; E46-V50 PolarHBondContact O-N 3.22Å; E46-V50 WeakPolarHBondContact OE1-CG2 3.32Å; V50-A54 VanDerWaalsContact O-CB 3.31Å; V50-A54 WeakPolarHBondContact O-CB 3.32Å; V50-A54 PolarHBondContact O-N 3.36Å; V50-F88 HydrophobicContact CG2-CE1 3.87Å; V50-F88 HydrophobicContact CG2-CZ 3.78Å; V50-H103 HydrophobicContact CG1-CB 4.34Å; V50-Y106 HydrophobicContact CG1-CD2 4.4Å
51T90.2Very high91.1Very high2 Ų217.9 Ų17.91%0.01210%0.101CC..Hα-helixtrans-69.4-43-178.7-56.80000111.5T47 F48 Y49 A54 L55 L129 H132 L133T47-T51 WeakPolarHBondContact O-CB 3.48Å; T47-T51 PolarHBondContact O-N 3.4Å; T47-T51 VanDerWaalsContact O-N 3.1Å; T47-T51 PolarHBondContact O-OG1 3.16Å; F48-T51 PolarHBondContact O-N 3.35Å; Y49-T51 VanDerWaalsContact C-N 3.32Å; Y49-T51 PolarHBondContact O-N 2.97Å; T51-A54 PolarHBondContact O-N 2.83Å; T51-L55 HydrophobicContact CG2-CD1 4.23Å; T51-L55 WeakPolarHBondContact O-CG 3.43Å; T51-L55 PolarHBondContact O-N 3.13Å; T51-L129 HydrophobicContact CG2-CB 4.04Å; T51-L129 HydrophobicContact CG2-CD2 3.72Å; T51-L129 WeakPolarHBondContact CG2-O 3.38Å; T51-H132 HydrophobicContact CG2-CB 4.27Å; T51-L133 HydrophobicContact CG2-CB 3.73Å; T51-L133 HydrophobicContact CG2-CD1 4.2Å; T51-L133 HydrophobicContact CG2-CG 4.42Å
52F93.1Very high91.1Very high0 Ų017.4 Ų17.40%010%0.103CC..Hα-helixtrans-58.8-48.4175.3171.9-103.5000111.3W3 D6 V7 L10 L27 T30 I31 F48 Y49 G56 L133W3-F52 HydrophobicContact CE3-CE2 4.43Å; W3-F52 HydrophobicContact CE3-CZ 4.47Å; W3-F52 HydrophobicContact CH2-CD1 4.4Å; W3-F52 HydrophobicContact CH2-CE1 4.17Å; W3-F52 AromaticContact CZ3-CD1 3.96Å; W3-F52 HydrophobicContact CZ3-CD1 3.96Å; W3-F52 HydrophobicContact CZ3-CD2 4.17Å; W3-F52 AromaticContact CZ3-CE1 3.72Å; W3-F52 HydrophobicContact CZ3-CE1 3.72Å; W3-F52 AromaticContact CZ3-CE2 3.95Å; W3-F52 HydrophobicContact CZ3-CE2 3.95Å; W3-F52 HydrophobicContact CZ3-CG 4.17Å; W3-F52 AromaticContact CZ3-CZ 3.72Å; W3-F52 HydrophobicContact CZ3-CZ 3.72Å; D6-F52 HydrophobicContact CB-CE2 4.41Å; V7-F52 HydrophobicContact CG2-CD2 4.19Å; V7-F52 HydrophobicContact CG2-CE2 4.36Å; L10-F52 HydrophobicContact CD1-CD2 3.79Å; L10-F52 HydrophobicContact CD1-CE2 3.83Å; L27-F52 HydrophobicContact CD1-CE2 4.14Å; L27-F52 HydrophobicContact CD1-CZ 3.86Å; T30-F52 HydrophobicContact CG2-CZ 4.04Å; I31-F52 HydrophobicContact CG1-CE1 4.04Å; I31-F52 HydrophobicContact CG1-CZ 4.47Å; F48-F52 VanDerWaalsContact O-CB 3.28Å; F48-F52 WeakPolarHBondContact O-CB 3.48Å; F48-F52 PolarHBondContact O-N 3.41Å; Y49-F52 PolarHBondContact O-N 3.06Å; F52-G56 WeakPolarHBondContact O-CA 3.01Å; F52-G56 PolarHBondContact O-N 3.28Å; F52-L133 HydrophobicContact CB-CD1 4.38Å
53L93.4Very high91.2Very high4 Ų416.5 Ų16.52%0.0219%0.092CC..Hα-helixtrans-66.4-39.1178.1-68.8-179.3000112.1I31 I38 Y49 G56 T57 V85 F88I31-L53 HydrophobicContact CD1-CD2 4.36Å; I31-L53 HydrophobicContact CG1-CD2 4.09Å; I31-L53 HydrophobicContact CG2-CD2 4.15Å; I38-L53 HydrophobicContact CD1-CD2 4.03Å; I38-L53 HydrophobicContact CG2-CD1 3.79Å; Y49-L53 WeakPolarHBondContact O-CB 3.4Å; Y49-L53 VanDerWaalsContact O-CG 3.27Å; Y49-L53 WeakPolarHBondContact O-CG 3.47Å; Y49-L53 PolarHBondContact O-N 3.35Å; L53-G56 PolarHBondContact O-N 3.42Å; L53-T57 VanDerWaalsContact O-CB 3.31Å; L53-T57 WeakPolarHBondContact O-CB 3.4Å; L53-T57 PolarHBondContact O-N 3.48Å; L53-T57 PolarHBondContact O-OG1 3.28Å; L53-V85 HydrophobicContact CD2-CG2 4.12Å; L53-F88 HydrophobicContact CD1-CB 4.29Å; L53-F88 HydrophobicContact CD1-CD1 3.45Å; L53-F88 VanDerWaalsContact CD1-CD1 3.45Å; L53-F88 HydrophobicContact CD1-CD2 4.34Å; L53-F88 HydrophobicContact CD1-CE1 3.79Å; L53-F88 HydrophobicContact CD1-CG 3.76Å; L53-F88 HydrophobicContact CD1-CZ 4.36Å
54A92.1Very high91.1Very high3 Ų311.9 Ų11.93%0.0256%0.062CC..Hα-helixtrans-61-49177.500000112V50 T51 H58 V110 L129V50-A54 VanDerWaalsContact O-CB 3.31Å; V50-A54 WeakPolarHBondContact O-CB 3.32Å; V50-A54 PolarHBondContact O-N 3.36Å; T51-A54 PolarHBondContact O-N 2.83Å; A54-H58 VanDerWaalsContact O-CB 3.31Å; A54-H58 WeakPolarHBondContact O-CB 3.31Å; A54-H58 PolarHBondContact O-N 3.31Å; A54-V110 HydrophobicContact CB-CG2 4.15Å; A54-L129 HydrophobicContact CB-CD1 4.09Å; A54-L129 HydrophobicContact CB-CD2 4.28Å
55L92.5Very high90.5Very high0 Ų08.4 Ų8.40%05%0.051CC..Hα-helixtrans-67.4-40.6176.9-69.9174.3000112L10 F16 T51 H58 Y59 L121 I126 L129 L133L10-L55 HydrophobicContact CB-CB 4.27Å; L10-L55 HydrophobicContact CB-CD1 4.19Å; L10-L55 HydrophobicContact CD1-CB 4.14Å; L10-L55 HydrophobicContact CD2-CB 4.33Å; L10-L55 HydrophobicContact CG-CB 4.47Å; F16-L55 HydrophobicContact CE1-CB 4.49Å; F16-L55 HydrophobicContact CE1-CD2 4.34Å; F16-L55 HydrophobicContact CZ-CB 4.23Å; F16-L55 HydrophobicContact CZ-CD2 3.81Å; F16-L55 HydrophobicContact CZ-CG 4.46Å; T51-L55 HydrophobicContact CG2-CD1 4.23Å; T51-L55 WeakPolarHBondContact O-CG 3.43Å; T51-L55 PolarHBondContact O-N 3.13Å; L55-H58 PolarHBondContact O-N 2.99Å; L55-Y59 PolarHBondContact O-N 2.92Å; L55-L121 HydrophobicContact CD2-CD1 4.48Å; L55-I126 HydrophobicContact CD2-CG2 4.13Å; L55-L129 HydrophobicContact CD1-CB 4.07Å; L55-L129 HydrophobicContact CD2-CB 3.64Å; L55-L129 HydrophobicContact CD2-CD1 4.12Å; L55-L129 HydrophobicContact CG-CB 3.84Å; L55-L129 HydrophobicContact CG-CD1 4.46Å; L55-L133 HydrophobicContact CD1-CD2 3.89Å
56G94.1Very high89.7Confident0 Ų07.2 Ų7.20%05%0.046CC..Hα-helixtrans-65.7-46.2-179.900000112.3F52 L53 H58 Y59 I60F52-G56 WeakPolarHBondContact O-CA 3.01Å; F52-G56 PolarHBondContact O-N 3.28Å; L53-G56 PolarHBondContact O-N 3.42Å; G56-H58 VanDerWaalsContact C-N 3.33Å; G56-H58 PolarHBondContact O-N 2.9Å; G56-Y59 PolarHBondContact O-N 3.37Å; G56-I60 VanDerWaalsContact O-CG1 3.31Å; G56-I60 WeakPolarHBondContact O-CG1 3.44Å; G56-I60 PolarHBondContact O-N 2.94Å
57T94Very high88.9Confident0 Ų06.1 Ų6.10%04%0.041CC..Hα-helixtrans-64.3-40.2174.7-59.90000111.6L53 Y59 I60 T61 M82 V85 V110 M114L53-T57 VanDerWaalsContact O-CB 3.31Å; L53-T57 WeakPolarHBondContact O-CB 3.4Å; L53-T57 PolarHBondContact O-N 3.48Å; L53-T57 PolarHBondContact O-OG1 3.28Å; T57-Y59 PolarHBondContact O-N 3.4Å; T57-I60 PolarHBondContact O-N 3.43Å; T57-T61 HydrophobicContact CG2-CG2 4.14Å; T57-T61 WeakPolarHBondContact O-CG2 3.34Å; T57-T61 PolarHBondContact O-N 2.92Å; T57-T61 PolarHBondContact O-OG1 3.29Å; T57-M82 HydrophobicContact CG2-CE 4.13Å; T57-M82 HydrophobicContact CG2-SD 3.59Å; T57-M82 VanDerWaalsContact CG2-SD 3.59Å; T57-V85 WeakPolarHBondContact OG1-CG2 3.47Å; T57-V110 HydrophobicContact CG2-CG1 3.65Å; T57-M114 HydrophobicContact CG2-CG 4.07Å; T57-M114 HydrophobicContact CG2-SD 4.47Å
58H93.1Very high88.1Confident2 Ų26.4 Ų6.41%0.0094%0.042CC..Hα-helixtrans-58-47.5173.9172.469000112.5F16 A54 L55 G56 I60 T61 A62 S120 L121 I126F16-H58 AromaticContact CD1-CD2 3.53Å; F16-H58 AromaticContact CE1-CD2 3.81Å; A54-H58 VanDerWaalsContact O-CB 3.31Å; A54-H58 WeakPolarHBondContact O-CB 3.31Å; A54-H58 PolarHBondContact O-N 3.31Å; L55-H58 PolarHBondContact O-N 2.99Å; G56-H58 VanDerWaalsContact C-N 3.33Å; G56-H58 PolarHBondContact O-N 2.9Å; H58-I60 VanDerWaalsContact C-N 3.31Å; H58-I60 PolarHBondContact O-N 3.31Å; H58-T61 PolarHBondContact O-N 2.89Å; H58-T61 PolarHBondContact O-OG1 3.13Å; H58-A62 WeakPolarHBondContact O-CB 3.3Å; H58-A62 PolarHBondContact O-N 3.24Å; H58-S120 VanDerWaalsContact CA-OG 3.29Å; H58-S120 WeakPolarHBondContact CA-OG 3.31Å; H58-S120 WeakPolarHBondContact CB-OG 3.21Å; H58-S120 PolarHBondContact ND1-N 2.97Å; H58-S120 PolarHBondContact ND1-OG 3.22Å; H58-L121 HydrophobicContact CB-CB 4.37Å; H58-L121 HydrophobicContact CB-CD1 3.54Å; H58-L121 HydrophobicContact CB-CG 3.97Å; H58-L121 PolarHBondContact CE1-O 3.38Å; H58-L121 PolarHBondContact ND1-N 2.82Å; H58-L121 VanDerWaalsContact ND1-N 3.19Å; H58-I126 WeakPolarHBondContact NE2-CD1 3.4Å
59Y93.6Very high87.5Confident0 Ų011.1 Ų11.10%08%0.075CC..Hα-helixtrans-59.6-43.3175.9-176.3-86000111.5F15 F16 T18 N20 Y23 L24 L27 L55 G56 T57 A62 H63F15-Y59 HydrophobicContact CD1-CD2 4.27Å; F15-Y59 AromaticContact CD1-CE2 3.88Å; F15-Y59 HydrophobicContact CD1-CE2 3.88Å; F15-Y59 HydrophobicContact CE1-CD2 4.05Å; F15-Y59 AromaticContact CE1-CE2 3.41Å; F15-Y59 HydrophobicContact CE1-CE2 3.41Å; F15-Y59 VanDerWaalsContact CE1-CE2 3.41Å; F15-Y59 AromaticContact CE1-CZ 3.9Å; F15-Y59 HydrophobicContact CZ-CE2 4.24Å; F16-Y59 HydrophobicContact CD1-CD2 4.1Å; T18-Y59 PolarHBondContact O-OH 3.25Å; N20-Y59 PolarHBondContact N-OH 2.78Å; N20-Y59 PolarHBondContact O-OH 3.26Å; Y23-Y59 HydrophobicContact CD1-CD1 4Å; Y23-Y59 AromaticContact CD1-CE1 3.45Å; Y23-Y59 HydrophobicContact CD1-CE1 3.45Å; Y23-Y59 VanDerWaalsContact CD1-CE1 3.45Å; Y23-Y59 HydrophobicContact CD1-CE2 4.14Å; Y23-Y59 AromaticContact CD1-CZ 3.53Å; Y23-Y59 AromaticContact CE1-CD1 3.98Å; Y23-Y59 HydrophobicContact CE1-CD1 3.98Å; Y23-Y59 HydrophobicContact CE1-CD2 4.41Å; Y23-Y59 AromaticContact CE1-CE1 3.91Å; Y23-Y59 HydrophobicContact CE1-CE1 3.91Å; Y23-Y59 HydrophobicContact CE1-CE2 4.32Å; Y23-Y59 HydrophobicContact CE1-CG 4.25Å; L24-Y59 HydrophobicContact CB-CE1 4.09Å; L24-Y59 HydrophobicContact CD1-CD1 4.22Å; L24-Y59 HydrophobicContact CD1-CE1 4.21Å; L27-Y59 HydrophobicContact CD2-CD1 3.93Å; L27-Y59 HydrophobicContact CD2-CG 4.38Å; L55-Y59 PolarHBondContact O-N 2.92Å; G56-Y59 PolarHBondContact O-N 3.37Å; T57-Y59 PolarHBondContact O-N 3.4Å; Y59-A62 PolarHBondContact O-N 3.18Å; Y59-H63 AromaticContact CD1-CD2 3.81Å; Y59-H63 AromaticContact CD2-CD2 3.49Å; Y59-H63 VanDerWaalsContact CD2-CD2 3.49Å; Y59-H63 WeakPolarHBondContact CD2-CD2 3.45Å; Y59-H63 AromaticContact CD2-NE2 3.54Å; Y59-H63 AromaticContact CE1-CD2 3.57Å; Y59-H63 AromaticContact CE2-CD2 3.27Å; Y59-H63 WeakPolarHBondContact CE2-CD2 3.48Å; Y59-H63 AromaticContact CE2-NE2 3.23Å; Y59-H63 WeakPolarHBondContact CE2-NE2 3.3Å; Y59-H63 AromaticContact CG-CD2 3.75Å; Y59-H63 AromaticContact CZ-CD2 3.31Å; Y59-H63 AromaticContact CZ-NE2 3.71Å; Y59-H63 PolarHBondContact O-CD2 3.18Å; Y59-H63 PolarHBondContact O-N 3.24Å; Y59-H63 VanDerWaalsContact O-N 3.12Å
60I93.6Very high87.1Confident0 Ų011.9 Ų11.90%08%0.079CC..Hα-helixtrans-60.3-48.7178.1-71.2166.7000111.4L24 L27 I31 G56 T57 H58 H63 L64 I78 M82 F216L24-I60 HydrophobicContact CD1-CB 4.1Å; L24-I60 HydrophobicContact CD1-CG1 3.68Å; L24-I60 HydrophobicContact CD1-CG2 4.35Å; L27-I60 HydrophobicContact CD2-CD1 4.24Å; L27-I60 HydrophobicContact CD2-CG1 4.04Å; L27-I60 HydrophobicContact CG-CD1 4.33Å; I31-I60 HydrophobicContact CD1-CD1 3.94Å; G56-I60 VanDerWaalsContact O-CG1 3.31Å; G56-I60 WeakPolarHBondContact O-CG1 3.44Å; G56-I60 PolarHBondContact O-N 2.94Å; T57-I60 PolarHBondContact O-N 3.43Å; H58-I60 VanDerWaalsContact C-N 3.31Å; H58-I60 PolarHBondContact O-N 3.31Å; I60-H63 PolarHBondContact O-N 3.24Å; I60-L64 PolarHBondContact O-N 3.33Å; I60-I78 HydrophobicContact CG2-CG2 3.71Å; I60-M82 HydrophobicContact CB-CE 4.35Å; I60-M82 HydrophobicContact CD1-CE 3.47Å; I60-M82 VanDerWaalsContact CD1-CE 3.47Å; I60-M82 HydrophobicContact CG1-CE 4.49Å; I60-M82 HydrophobicContact CG2-CE 4.12Å; I60-M82 HydrophobicContact CG2-SD 4.33Å; I60-F216 HydrophobicContact CG2-CE2 4.48Å
61T92.6Very high86.9Confident1 Ų118 Ų181%0.00611%0.107CC..Hα-helixtrans-73-34.6-17866.80000112.2T57 H58 H63 L64 N118 F216T57-T61 HydrophobicContact CG2-CG2 4.14Å; T57-T61 WeakPolarHBondContact O-CG2 3.34Å; T57-T61 PolarHBondContact O-N 2.92Å; T57-T61 PolarHBondContact O-OG1 3.29Å; H58-T61 PolarHBondContact O-N 2.89Å; H58-T61 PolarHBondContact O-OG1 3.13Å; T61-H63 VanDerWaalsContact C-N 3.29Å; T61-H63 PolarHBondContact O-N 3.37Å; T61-L64 WeakPolarHBondContact O-CB 3.05Å; T61-L64 PolarHBondContact O-N 3.11Å; T61-N118 WeakPolarHBondContact CB-O 3.29Å; T61-N118 PolarHBondContact OG1-O 2.98Å; T61-F216 HydrophobicContact CG2-CE1 4.25Å; T61-F216 HydrophobicContact CG2-CZ 4.03Å
62A90.3Very high86.8Confident23 Ų2321.7 Ų21.719%0.1912%0.124CC..Hα-helixtrans-60.2-37.8174.700000112.7H58 Y59 E119H58-A62 WeakPolarHBondContact O-CB 3.3Å; H58-A62 PolarHBondContact O-N 3.24Å; Y59-A62 PolarHBondContact O-N 3.18Å; A62-E119 HydrophobicContact CB-CG 3.57Å
63H89.5Confident86.6Confident16 Ų1625 Ų257%0.07415%0.148CC..THydrogen-bonded Turntrans-103.112.7-175.9-60.8-55.3000113.8F16 L24 Y59 I60 T61 A65 T66F16-H63 PolarHBondContact O-CE1 3.03Å; F16-H63 PolarHBondContact O-NE2 3.39Å; F16-H63 VanDerWaalsContact O-NE2 3.15Å; L24-H63 HydrophobicContact CD2-CB 4.45Å; Y59-H63 AromaticContact CD1-CD2 3.81Å; Y59-H63 AromaticContact CD2-CD2 3.49Å; Y59-H63 VanDerWaalsContact CD2-CD2 3.49Å; Y59-H63 WeakPolarHBondContact CD2-CD2 3.45Å; Y59-H63 AromaticContact CD2-NE2 3.54Å; Y59-H63 AromaticContact CE1-CD2 3.57Å; Y59-H63 AromaticContact CE2-CD2 3.27Å; Y59-H63 WeakPolarHBondContact CE2-CD2 3.48Å; Y59-H63 AromaticContact CE2-NE2 3.23Å; Y59-H63 WeakPolarHBondContact CE2-NE2 3.3Å; Y59-H63 AromaticContact CG-CD2 3.75Å; Y59-H63 AromaticContact CZ-CD2 3.31Å; Y59-H63 AromaticContact CZ-NE2 3.71Å; Y59-H63 PolarHBondContact O-CD2 3.18Å; Y59-H63 PolarHBondContact O-N 3.24Å; Y59-H63 VanDerWaalsContact O-N 3.12Å; I60-H63 PolarHBondContact O-N 3.24Å; T61-H63 VanDerWaalsContact C-N 3.29Å; T61-H63 PolarHBondContact O-N 3.37Å; H63-A65 PolarHBondContact O-N 3.22Å; H63-A65 VanDerWaalsContact O-N 3.12Å; H63-T66 HydrophobicContact CB-CG2 4.49Å; H63-T66 WeakPolarHBondContact O-CB 3.41Å; H63-T66 PolarHBondContact O-N 3.05Å; H63-T66 PolarHBondContact O-OG1 2.83Å
64L85.2Confident86.5Confident1 Ų125.3 Ų25.31%0.00515%0.149CC..G310 helixtrans-57-32.6-177.8-166.763.6000112.8I60 T61 T66 S67 F212 R213 F216I60-L64 PolarHBondContact O-N 3.33Å; T61-L64 WeakPolarHBondContact O-CB 3.05Å; T61-L64 PolarHBondContact O-N 3.11Å; L64-T66 PolarHBondContact O-N 3.42Å; L64-T66 VanDerWaalsContact O-N 3.13Å; L64-S67 VanDerWaalsContact O-CB 3.3Å; L64-S67 WeakPolarHBondContact O-CB 3.46Å; L64-S67 PolarHBondContact O-N 2.83Å; L64-S67 PolarHBondContact O-OG 3.1Å; L64-F212 HydrophobicContact CD1-CD1 3.82Å; L64-F212 HydrophobicContact CD1-CE1 3.53Å; L64-F212 HydrophobicContact CG-CD1 4.49Å; L64-R213 HydrophobicContact CD2-CB 4.15Å; L64-R213 HydrophobicContact CD2-CG 3.83Å; L64-R213 HydrophobicContact CG-CB 4.36Å; L64-R213 HydrophobicContact CG-CG 4.47Å; L64-F216 HydrophobicContact CD1-CB 4.24Å; L64-F216 HydrophobicContact CD1-CD1 4.4Å; L64-F216 HydrophobicContact CD1-CD2 3.73Å; L64-F216 HydrophobicContact CD1-CE2 4.12Å; L64-F216 HydrophobicContact CD1-CG 3.88Å; L64-F216 HydrophobicContact CD2-CB 3.94Å; L64-F216 HydrophobicContact CD2-CD1 3.39Å; L64-F216 HydrophobicContact CD2-CD2 4.23Å; L64-F216 HydrophobicContact CD2-CE1 3.89Å; L64-F216 HydrophobicContact CD2-CG 3.6Å; L64-F216 HydrophobicContact CD2-CZ 4.48Å; L64-F216 HydrophobicContact CG-CG 4.39Å
65A75.3Confident86.4Confident28 Ų2827.4 Ų27.423%0.23116%0.156CC..G310 helixtrans-60.9-22.117500000114.3R19 H63 S67 N68R19-A65 VanDerWaalsContact NH2-C 3.25Å; H63-A65 PolarHBondContact O-N 3.22Å; H63-A65 VanDerWaalsContact O-N 3.12Å; A65-S67 VanDerWaalsContact C-N 3.3Å; A65-N68 PolarHBondContact O-ND2 3.49Å
66T72.8Confident86.5Confident10 Ų1030.5 Ų30.56%0.06117%0.171CC..G310 helixtrans-72.7-24.3173.456.60000113.6R19 L24 H63 L64 N68 S69R19-T66 HydrophobicContact CG-CG2 3.08Å; R19-T66 VanDerWaalsContact NH2-N 3.14Å; L24-T66 WeakPolarHBondContact CD2-OG1 3.15Å; H63-T66 HydrophobicContact CB-CG2 4.49Å; H63-T66 WeakPolarHBondContact O-CB 3.41Å; H63-T66 PolarHBondContact O-N 3.05Å; H63-T66 PolarHBondContact O-OG1 2.83Å; L64-T66 PolarHBondContact O-N 3.42Å; L64-T66 VanDerWaalsContact O-N 3.13Å; T66-N68 PolarHBondContact O-N 3.1Å; T66-S69 PolarHBondContact O-N 3.26Å; T66-S69 PolarHBondContact O-OG 3.24Å
67S70.7Confident86.5Confident0 Ų031.5 Ų31.50%018%0.179CC..G310 helixtrans-68.1-11.8-163.862.30000113.5L64 A65 S69 L70 R75 F212L64-S67 VanDerWaalsContact O-CB 3.3Å; L64-S67 WeakPolarHBondContact O-CB 3.46Å; L64-S67 PolarHBondContact O-N 2.83Å; L64-S67 PolarHBondContact O-OG 3.1Å; A65-S67 VanDerWaalsContact C-N 3.3Å; S67-S69 PolarHBondContact O-N 3.32Å; S67-L70 VanDerWaalsContact O-CB 3.24Å; S67-L70 WeakPolarHBondContact O-CB 3.4Å; S67-L70 PolarHBondContact O-N 3.03Å; S67-R75 WeakPolarHBondContact O-CD 3.33Å; S67-F212 WeakPolarHBondContact OG-CD1 3.31Å; S67-F212 WeakPolarHBondContact OG-CE1 3.5Å
68N71.6Confident86.5Confident39 Ų3931.5 Ų31.521%0.20918%0.179CC..G310 helixtrans-68.5-23.2174.3-54-66.3000112.5A65 T66 L70 E208 T209 F212A65-N68 PolarHBondContact O-ND2 3.49Å; T66-N68 PolarHBondContact O-N 3.1Å; N68-L70 VanDerWaalsContact C-N 3.27Å; N68-E208 PolarHBondContact OD1-O 2.93Å; N68-T209 WeakPolarHBondContact ND2-CA 3.32Å; N68-T209 PolarHBondContact ND2-O 3.04Å; N68-T209 VanDerWaalsContact ND2-O 3.09Å; N68-F212 VanDerWaalsContact OD1-CB 3.3Å; N68-F212 WeakPolarHBondContact OD1-CB 3.37Å
69S77.3Confident86.6Confident99 Ų9931.7 Ų31.769%0.69218%0.18SC*.G310 helixtrans-84.50.317073.30000113.2T66 S67T66-S69 PolarHBondContact O-N 3.26Å; T66-S69 PolarHBondContact O-OG 3.24Å; S67-S69 PolarHBondContact O-N 3.32Å
70L83.8Confident86.7Confident19 Ų1933.2 Ų33.210%0.09919%0.192CC..SBendtrans-91.3148.7178.4-61.9174000110.8P21 L24 S67 N68 D74 R75 I78P21-L70 HydrophobicContact CB-CD2 3.97Å; L24-L70 HydrophobicContact CD2-CD1 4.02Å; S67-L70 VanDerWaalsContact O-CB 3.24Å; S67-L70 WeakPolarHBondContact O-CB 3.4Å; S67-L70 PolarHBondContact O-N 3.03Å; N68-L70 VanDerWaalsContact C-N 3.27Å; L70-D74 HydrophobicContact CB-CB 4.03Å; L70-D74 HydrophobicContact CD1-CB 4.4Å; L70-R75 HydrophobicContact CB-CG 4.3Å; L70-R75 PolarHBondContact O-NE 2.8Å; L70-I78 HydrophobicContact CD1-CD1 3.82Å
71E87Confident86.8Confident131 Ų13133.2 Ų33.261%0.61219%0.192SC*.  trans-58.4152.7171.1-63.4-176.4166.700111S73 D74 R75E71-S73 PolarHBondContact O-N 2.67Å; E71-D74 PolarHBondContact O-N 3.37Å; E71-R75 PolarHBondContact O-N 3.19Å; E71-R75 VanDerWaalsContact O-N 3.12Å
72E87.7Confident86.9Confident80 Ų8033.3 Ų33.337%0.37419%0.193SC..Hα-helixtrans-55.4-36.7177.8-172.664-148.700112D74 R75 E76 R215E72-D74 VanDerWaalsContact C-N 3.3Å; E72-D74 PolarHBondContact O-N 2.93Å; E72-R75 WeakPolarHBondContact O-CB 3.48Å; E72-R75 PolarHBondContact O-N 2.81Å; E72-R75 IonicContact OE2-CZ 2.78Å; E72-R75 IonicContact OE2-NE 2.63Å; E72-R75 IonicContact OE2-NH1 3.01Å; E72-R75 PolarHBondContact OE2-NH1 3.38Å; E72-R75 IonicContact OE2-NH2 3.93Å; E72-R75 PolarHBondContact OE2-NH2 3.37Å; E72-E76 WeakPolarHBondContact O-CG 3.32Å; E72-E76 PolarHBondContact O-N 3.49Å; E72-R215 IonicContact OE1-CZ 3.73Å; E72-R215 IonicContact OE1-NH1 3.87Å; E72-R215 PolarHBondContact OE1-NH1 3.27Å; E72-R215 IonicContact OE1-NH2 2.91Å
73S88.5Confident87.2Confident70 Ų7036.1 Ų36.149%0.4920%0.198SC..Hα-helixtrans-58.7-39.2176.555.80000113E71 A77E71-S73 PolarHBondContact O-N 2.67Å; S73-A77 PolarHBondContact O-N 3.42Å
74D91Very high87.5Confident10 Ų1035.9 Ų35.95%0.05320%0.198CC..Hα-helixtrans-76.8-37.1-179.9-68.5-28.7000111.4K25 L70 E71 E72 E76 A77 I78K25-D74 VanDerWaalsContact CD-OD1 3.24Å; K25-D74 WeakPolarHBondContact CD-OD1 3.42Å; K25-D74 WeakPolarHBondContact CD-OD2 3.45Å; K25-D74 WeakPolarHBondContact CE-OD1 3.31Å; K25-D74 WeakPolarHBondContact CE-OD2 3.29Å; K25-D74 HydrophobicContact CG-CB 4.46Å; K25-D74 WeakPolarHBondContact CG-OD1 3.47Å; K25-D74 IonicContact NZ-OD1 2.8Å; K25-D74 PolarHBondContact NZ-OD1 3.15Å; K25-D74 IonicContact NZ-OD2 3.86Å; K25-D74 PolarHBondContact NZ-OD2 3.4Å; L70-D74 HydrophobicContact CB-CB 4.03Å; L70-D74 HydrophobicContact CD1-CB 4.4Å; E71-D74 PolarHBondContact O-N 3.37Å; E72-D74 VanDerWaalsContact C-N 3.3Å; E72-D74 PolarHBondContact O-N 2.93Å; D74-E76 VanDerWaalsContact C-N 3.34Å; D74-A77 WeakPolarHBondContact O-CB 3.29Å; D74-A77 PolarHBondContact O-N 3.48Å; D74-I78 WeakPolarHBondContact O-CG1 3.04Å; D74-I78 PolarHBondContact O-N 3.31Å
75R91.3Very high87.9Confident46 Ų4636 Ų3617%0.17420%0.199CC..Hα-helixtrans-60.5-43.3171.5-79.6-170.9-78145.19.8111.5S67 L70 E71 E72 I78 L79 F212S67-R75 WeakPolarHBondContact O-CD 3.33Å; L70-R75 HydrophobicContact CB-CG 4.3Å; L70-R75 PolarHBondContact O-NE 2.8Å; E71-R75 PolarHBondContact O-N 3.19Å; E71-R75 VanDerWaalsContact O-N 3.12Å; E72-R75 WeakPolarHBondContact O-CB 3.48Å; E72-R75 PolarHBondContact O-N 2.81Å; E72-R75 IonicContact OE2-CZ 2.78Å; E72-R75 IonicContact OE2-NE 2.63Å; E72-R75 IonicContact OE2-NH1 3.01Å; E72-R75 PolarHBondContact OE2-NH1 3.38Å; E72-R75 IonicContact OE2-NH2 3.93Å; E72-R75 PolarHBondContact OE2-NH2 3.37Å; R75-I78 WeakPolarHBondContact O-CB 3.48Å; R75-I78 PolarHBondContact O-N 3.26Å; R75-L79 PolarHBondContact O-N 3.02Å; R75-L79 VanDerWaalsContact O-N 3.13Å; R75-F212 HydrophobicContact CB-CD2 3.92Å; R75-F212 HydrophobicContact CB-CE1 4.48Å; R75-F212 HydrophobicContact CB-CE2 3.41Å; R75-F212 VanDerWaalsContact CB-CE2 3.41Å; R75-F212 HydrophobicContact CB-CZ 3.69Å; R75-F212 HydrophobicContact CG-CD1 4.31Å; R75-F212 HydrophobicContact CG-CD2 3.81Å; R75-F212 HydrophobicContact CG-CE1 4.15Å; R75-F212 HydrophobicContact CG-CE2 3.72Å; R75-F212 HydrophobicContact CG-CG 4.07Å; R75-F212 HydrophobicContact CG-CZ 3.84Å; R75-F212 WeakPolarHBondContact O-CZ 3.37Å
76E93.1Very high88.8Confident66 Ų6634.7 Ų34.731%0.30819%0.188SC..Hα-helixtrans-64.7-37.4173.5-74-59.2150.600113E72 D74 I78 L79 A80 R215E72-E76 WeakPolarHBondContact O-CG 3.32Å; E72-E76 PolarHBondContact O-N 3.49Å; D74-E76 VanDerWaalsContact C-N 3.34Å; E76-I78 VanDerWaalsContact C-N 3.34Å; E76-I78 PolarHBondContact O-N 3.19Å; E76-L79 PolarHBondContact O-N 2.81Å; E76-A80 WeakPolarHBondContact O-CB 3.34Å; E76-A80 PolarHBondContact O-N 2.98Å; E76-R215 IonicContact OE1-CZ 3.26Å; E76-R215 IonicContact OE1-NH1 2.83Å; E76-R215 IonicContact OE1-NH2 2.86Å; E76-R215 PolarHBondContact OE1-NH2 2.89Å
77A93.9Very high89.8Confident20 Ų2039.4 Ų39.417%0.16520%0.204CC..Hα-helixtrans-62.5-40.1174.100000112A28 Q29 S73 D74 A80 A81A28-A77 HydrophobicContact CB-CB 4.49Å; Q29-A77 HydrophobicContact CG-CB 4.48Å; S73-A77 PolarHBondContact O-N 3.42Å; D74-A77 WeakPolarHBondContact O-CB 3.29Å; D74-A77 PolarHBondContact O-N 3.48Å; A77-A80 PolarHBondContact O-N 3.28Å; A77-A81 WeakPolarHBondContact O-CB 3.24Å; A77-A81 PolarHBondContact O-N 3.37Å
78I95Very high90.8Very high0 Ų039.4 Ų39.40%020%0.204CC..Hα-helixtrans-60.9-47.7174.3-69.5166.1000110.8L24 A28 I60 L70 D74 R75 E76 A80 A81 M82 F212 F216L24-I78 HydrophobicContact CD1-CD1 4.5Å; L24-I78 HydrophobicContact CD2-CD1 4.14Å; L24-I78 HydrophobicContact CG-CD1 4.09Å; A28-I78 HydrophobicContact CB-CG1 3.9Å; I60-I78 HydrophobicContact CG2-CG2 3.71Å; L70-I78 HydrophobicContact CD1-CD1 3.82Å; D74-I78 WeakPolarHBondContact O-CG1 3.04Å; D74-I78 PolarHBondContact O-N 3.31Å; R75-I78 WeakPolarHBondContact O-CB 3.48Å; R75-I78 PolarHBondContact O-N 3.26Å; E76-I78 VanDerWaalsContact C-N 3.34Å; E76-I78 PolarHBondContact O-N 3.19Å; I78-A80 VanDerWaalsContact C-N 3.31Å; I78-A80 PolarHBondContact O-N 2.79Å; I78-A81 PolarHBondContact O-N 3.4Å; I78-M82 WeakPolarHBondContact O-CG 3.37Å; I78-M82 PolarHBondContact O-N 3.48Å; I78-F212 HydrophobicContact CG2-CE1 4.5Å; I78-F212 HydrophobicContact CG2-CZ 4.49Å; I78-F216 HydrophobicContact CG2-CD2 4.12Å; I78-F216 HydrophobicContact CG2-CE2 3.87Å
79L94.8Very high91.8Very high7 Ų737.6 Ų37.64%0.03720%0.195CC..Hα-helixtrans-62.9-37.4177.3-65.8177.2000112.1R75 E76 R83 F212 F216 E219R75-L79 PolarHBondContact O-N 3.02Å; R75-L79 VanDerWaalsContact O-N 3.13Å; E76-L79 PolarHBondContact O-N 2.81Å; L79-R83 WeakPolarHBondContact O-CG 3.5Å; L79-R83 PolarHBondContact O-N 3.49Å; L79-R83 PolarHBondContact O-NE 3Å; L79-F212 HydrophobicContact CD1-CE2 4.15Å; L79-F212 HydrophobicContact CD2-CZ 4.29Å; L79-F212 HydrophobicContact CG-CE2 4.2Å; L79-F212 HydrophobicContact CG-CZ 4.11Å; L79-F216 HydrophobicContact CD2-CB 4.21Å; L79-F216 HydrophobicContact CD2-CD2 3.75Å; L79-F216 HydrophobicContact CD2-CG 4.31Å; L79-E219 HydrophobicContact CD2-CB 4.41Å; L79-E219 HydrophobicContact CD2-CG 4.34Å
80A96Very high92.4Very high31 Ų3133.8 Ų33.826%0.25617%0.167SC..Hα-helixtrans-65.9-42.5175.200000112.4E76 A77 I78 M82 R83 L84E76-A80 WeakPolarHBondContact O-CB 3.34Å; E76-A80 PolarHBondContact O-N 2.98Å; A77-A80 PolarHBondContact O-N 3.28Å; I78-A80 VanDerWaalsContact C-N 3.31Å; I78-A80 PolarHBondContact O-N 2.79Å; A80-M82 VanDerWaalsContact C-N 3.34Å; A80-M82 PolarHBondContact O-N 2.86Å; A80-R83 WeakPolarHBondContact O-CB 3.42Å; A80-R83 PolarHBondContact O-N 2.75Å; A80-L84 PolarHBondContact O-N 3.08Å; A80-L84 VanDerWaalsContact O-N 3.08Å
81A96Very high92.7Very high0 Ų035.2 Ų35.20%018%0.175CC..Hα-helixtrans-61.9-43.4175.800000111.1A28 I31 C32 A77 I78 R83 L84 V85A28-A81 HydrophobicContact CB-CB 4.09Å; I31-A81 HydrophobicContact CB-CB 4.01Å; I31-A81 HydrophobicContact CD1-CB 4.44Å; I31-A81 HydrophobicContact CG2-CB 3.89Å; C32-A81 PolarHBondContact SG-N 3.3Å; C32-A81 VanDerWaalsContact SG-N 3.37Å; A77-A81 WeakPolarHBondContact O-CB 3.24Å; A77-A81 PolarHBondContact O-N 3.37Å; I78-A81 PolarHBondContact O-N 3.4Å; A81-R83 PolarHBondContact O-N 3.41Å; A81-L84 WeakPolarHBondContact O-CB 3.3Å; A81-L84 PolarHBondContact O-N 3.37Å; A81-L84 VanDerWaalsContact O-N 3.14Å; A81-V85 WeakPolarHBondContact O-CG2 3.19Å; A81-V85 PolarHBondContact O-N 3.42Å
82M94.9Very high92.8Very high3 Ų329.6 Ų29.62%0.01515%0.148CC..Hα-helixtrans-64.9-39.4176.5-73.5-48.592.800113T57 I60 I78 A80 L84 V85 V86 M114 F216T57-M82 HydrophobicContact CG2-CE 4.13Å; T57-M82 HydrophobicContact CG2-SD 3.59Å; T57-M82 VanDerWaalsContact CG2-SD 3.59Å; I60-M82 HydrophobicContact CB-CE 4.35Å; I60-M82 HydrophobicContact CD1-CE 3.47Å; I60-M82 VanDerWaalsContact CD1-CE 3.47Å; I60-M82 HydrophobicContact CG1-CE 4.49Å; I60-M82 HydrophobicContact CG2-CE 4.12Å; I60-M82 HydrophobicContact CG2-SD 4.33Å; I78-M82 WeakPolarHBondContact O-CG 3.37Å; I78-M82 PolarHBondContact O-N 3.48Å; A80-M82 VanDerWaalsContact C-N 3.34Å; A80-M82 PolarHBondContact O-N 2.86Å; M82-L84 PolarHBondContact O-N 3.45Å; M82-V85 HydrophobicContact CE-CG2 4.07Å; M82-V85 PolarHBondContact O-N 2.95Å; M82-V86 WeakPolarHBondContact O-CG2 3.4Å; M82-V86 PolarHBondContact O-N 3.49Å; M82-M114 HydrophobicContact CB-CE 3.67Å; M82-M114 HydrophobicContact CG-CE 4.17Å; M82-M114 HydrophobicContact SD-CE 4.22Å; M82-M114 HydrophobicContact SD-CG 4.12Å; M82-M114 HydrophobicContact SD-SD 4.15Å; M82-F216 HydrophobicContact CB-CE2 4.41Å; M82-F216 HydrophobicContact CG-CE2 3.42Å; M82-F216 VanDerWaalsContact CG-CE2 3.42Å; M82-F216 HydrophobicContact CG-CZ 3.64Å; M82-F216 HydrophobicContact SD-CE2 4.4Å; M82-F216 HydrophobicContact SD-CZ 4.14Å
83R95.5Very high92.8Very high82 Ų8226.1 Ų26.131%0.30913%0.132SC..Hα-helixtrans-57.1-40.3171.7-82.2178.5-74.5154.7-8.5112L79 A80 A81 R87 L223L79-R83 WeakPolarHBondContact O-CG 3.5Å; L79-R83 PolarHBondContact O-N 3.49Å; L79-R83 PolarHBondContact O-NE 3Å; A80-R83 WeakPolarHBondContact O-CB 3.42Å; A80-R83 PolarHBondContact O-N 2.75Å; A81-R83 PolarHBondContact O-N 3.41Å; R83-R87 VanDerWaalsContact O-CG 3.29Å; R83-R87 WeakPolarHBondContact O-CG 3.35Å; R83-R87 PolarHBondContact O-N 3.34Å; R83-R87 VanDerWaalsContact O-N 3.1Å; R83-L223 HydrophobicContact CB-CD2 4.12Å; R83-L223 HydrophobicContact CG-CD1 4.35Å; R83-L223 HydrophobicContact CG-CD2 3.62Å
84L95.8Very high92.7Very high11 Ų1125.7 Ų25.76%0.05813%0.129CC..Hα-helixtrans-66.6-45.4177.3-169.4159.1000111.6I31 R35 I38 F39 A80 A81 M82 V86 R87 F88I31-L84 HydrophobicContact CG2-CB 4.46Å; I31-L84 HydrophobicContact CG2-CD1 4.36Å; I31-L84 HydrophobicContact CG2-CD2 3.99Å; I31-L84 VanDerWaalsContact O-CD1 3.24Å; I31-L84 WeakPolarHBondContact O-CD1 3.42Å; R35-L84 HydrophobicContact CB-CD1 3.56Å; R35-L84 HydrophobicContact CG-CD1 3.69Å; R35-L84 HydrophobicContact CG-CG 4.27Å; I38-L84 HydrophobicContact CD1-CD2 3.94Å; I38-L84 HydrophobicContact CG2-CD2 4.01Å; F39-L84 HydrophobicContact CE2-CD2 3.76Å; F39-L84 HydrophobicContact CE2-CG 3.9Å; A80-L84 PolarHBondContact O-N 3.08Å; A80-L84 VanDerWaalsContact O-N 3.08Å; A81-L84 WeakPolarHBondContact O-CB 3.3Å; A81-L84 PolarHBondContact O-N 3.37Å; A81-L84 VanDerWaalsContact O-N 3.14Å; M82-L84 PolarHBondContact O-N 3.45Å; L84-V86 VanDerWaalsContact C-N 3.33Å; L84-V86 PolarHBondContact O-N 2.99Å; L84-R87 PolarHBondContact O-N 3.5Å; L84-F88 WeakPolarHBondContact O-CB 3.37Å; L84-F88 PolarHBondContact O-N 3.22Å
85V94.7Very high92.3Very high5 Ų530.9 Ų30.93%0.0315%0.148CC..Hα-helixtrans-58.4-43.8176.51720000111.5I31 L53 T57 A81 M82 F88 A89 V110 M114I31-V85 HydrophobicContact CG2-CG2 4.39Å; L53-V85 HydrophobicContact CD2-CG2 4.12Å; T57-V85 WeakPolarHBondContact OG1-CG2 3.47Å; A81-V85 WeakPolarHBondContact O-CG2 3.19Å; A81-V85 PolarHBondContact O-N 3.42Å; M82-V85 HydrophobicContact CE-CG2 4.07Å; M82-V85 PolarHBondContact O-N 2.95Å; V85-F88 WeakPolarHBondContact O-CB 3.34Å; V85-F88 PolarHBondContact O-N 2.95Å; V85-A89 WeakPolarHBondContact O-CB 3.47Å; V85-A89 PolarHBondContact O-N 3.28Å; V85-V110 HydrophobicContact CG1-CG1 3.77Å; V85-M114 HydrophobicContact CG1-SD 4.46Å
86V93.4Very high90.8Very high0 Ų035 Ų350%018%0.179CC..Hα-helixtrans-63.2-46.4176.9168.30000111.4M82 L84 F88 A89 V90 L111 M114 L223 L224 Q227 V229M82-V86 WeakPolarHBondContact O-CG2 3.4Å; M82-V86 PolarHBondContact O-N 3.49Å; L84-V86 VanDerWaalsContact C-N 3.33Å; L84-V86 PolarHBondContact O-N 2.99Å; V86-F88 VanDerWaalsContact C-N 3.26Å; V86-F88 PolarHBondContact O-N 3.5Å; V86-A89 PolarHBondContact O-N 3.37Å; V86-V90 HydrophobicContact CG1-CG2 4.32Å; V86-V90 WeakPolarHBondContact O-CB 3.41Å; V86-V90 VanDerWaalsContact O-CG2 3.24Å; V86-V90 WeakPolarHBondContact O-CG2 3.46Å; V86-V90 PolarHBondContact O-N 3.08Å; V86-L111 HydrophobicContact CG2-CD2 4.42Å; V86-M114 HydrophobicContact CG2-CE 3.31Å; V86-M114 HydrophobicContact CG2-SD 3.71Å; V86-L223 HydrophobicContact CB-CD2 3.66Å; V86-L223 HydrophobicContact CB-CG 4.46Å; V86-L223 HydrophobicContact CG1-CD2 3.77Å; V86-L223 HydrophobicContact CG1-CG 4.02Å; V86-L223 HydrophobicContact CG2-CD2 3.88Å; V86-L224 HydrophobicContact CB-CD2 4.28Å; V86-L224 HydrophobicContact CG1-CD2 3.69Å; V86-L224 HydrophobicContact CG2-CD2 3.58Å; V86-L224 HydrophobicContact CG2-CG 4.36Å; V86-Q227 HydrophobicContact CG1-CG 4.31Å; V86-V229 HydrophobicContact CG1-CG2 4.18Å
87R93.9Very high88.9Confident108 Ų10839.8 Ų39.841%0.40820%0.201SC..Hα-helixtrans-60.9-38.8177-73.1172.6-178.9-179.30.2111.7F39 R83 L84 V90 D91F39-R87 HydrophobicContact CE1-CB 4.25Å; F39-R87 HydrophobicContact CZ-CB 3.71Å; R83-R87 VanDerWaalsContact O-CG 3.29Å; R83-R87 WeakPolarHBondContact O-CG 3.35Å; R83-R87 PolarHBondContact O-N 3.34Å; R83-R87 VanDerWaalsContact O-N 3.1Å; L84-R87 PolarHBondContact O-N 3.5Å; R87-V90 PolarHBondContact O-N 3.05Å; R87-D91 WeakPolarHBondContact O-CB 3.46Å; R87-D91 PolarHBondContact O-N 3.31Å
88F92.6Very high87.1Confident1 Ų147.4 Ų47.40%0.00423%0.226CC..Hα-helixtrans-64-48.4176174.4-97.9000110.8I38 F39 V50 L53 L84 V85 V86 V90 D91 R92 F107I38-F88 HydrophobicContact CG2-CB 4.35Å; I38-F88 HydrophobicContact CG2-CD2 3.49Å; I38-F88 VanDerWaalsContact CG2-CD2 3.49Å; I38-F88 HydrophobicContact CG2-CE2 3.98Å; I38-F88 HydrophobicContact CG2-CG 4Å; I38-F88 WeakPolarHBondContact O-CE2 3.39Å; F39-F88 HydrophobicContact CE1-CB 4.42Å; F39-F88 HydrophobicContact CE2-CB 4.16Å; F39-F88 HydrophobicContact CZ-CB 3.86Å; F39-F88 VanDerWaalsContact CZ-N 3.34Å; V50-F88 HydrophobicContact CG2-CE1 3.87Å; V50-F88 HydrophobicContact CG2-CZ 3.78Å; L53-F88 HydrophobicContact CD1-CB 4.29Å; L53-F88 HydrophobicContact CD1-CD1 3.45Å; L53-F88 VanDerWaalsContact CD1-CD1 3.45Å; L53-F88 HydrophobicContact CD1-CD2 4.34Å; L53-F88 HydrophobicContact CD1-CE1 3.79Å; L53-F88 HydrophobicContact CD1-CG 3.76Å; L53-F88 HydrophobicContact CD1-CZ 4.36Å; L84-F88 WeakPolarHBondContact O-CB 3.37Å; L84-F88 PolarHBondContact O-N 3.22Å; V85-F88 WeakPolarHBondContact O-CB 3.34Å; V85-F88 PolarHBondContact O-N 2.95Å; V86-F88 VanDerWaalsContact C-N 3.26Å; V86-F88 PolarHBondContact O-N 3.5Å; F88-V90 VanDerWaalsContact C-N 3.32Å; F88-V90 PolarHBondContact O-N 3.36Å; F88-D91 PolarHBondContact O-N 2.96Å; F88-R92 HydrophobicContact CD1-CG 4.49Å; F88-R92 HydrophobicContact CD2-CG 4.37Å; F88-R92 HydrophobicContact CE1-CG 4.06Å; F88-R92 HydrophobicContact CE2-CG 3.94Å; F88-R92 HydrophobicContact CZ-CG 3.76Å; F88-R92 WeakPolarHBondContact O-CG 3.3Å; F88-R92 PolarHBondContact O-N 3.14Å; F88-F107 HydrophobicContact CD1-CE1 4.08Å; F88-F107 HydrophobicContact CD1-CZ 4.44Å; F88-F107 AromaticContact CE1-CE1 3.99Å; F88-F107 HydrophobicContact CE1-CE1 3.99Å; F88-F107 HydrophobicContact CE1-CZ 4.03Å
89A90.8Very high85.1Confident0 Ų049 Ų490%024%0.235CC..Hα-helixtrans-59.2-43.1176.400000111.9V85 V86 R92 L93 F107V85-A89 WeakPolarHBondContact O-CB 3.47Å; V85-A89 PolarHBondContact O-N 3.28Å; V86-A89 PolarHBondContact O-N 3.37Å; A89-R92 PolarHBondContact O-N 2.86Å; A89-L93 VanDerWaalsContact O-CB 3.26Å; A89-L93 WeakPolarHBondContact O-CB 3.27Å; A89-L93 WeakPolarHBondContact O-CG 3.48Å; A89-L93 PolarHBondContact O-N 2.68Å; A89-F107 HydrophobicContact CB-CD1 3.54Å; A89-F107 HydrophobicContact CB-CE1 3.74Å; A89-F107 HydrophobicContact CB-CG 4.25Å
90V91.2Very high83.5Confident20 Ų2054.8 Ų54.812%0.12126%0.257CS..Hα-helixtrans-60.9-48.8176.3167.90000111.5V86 R87 F88 R92 L93 S94 Q227 V229 L232V86-V90 HydrophobicContact CG1-CG2 4.32Å; V86-V90 WeakPolarHBondContact O-CB 3.41Å; V86-V90 VanDerWaalsContact O-CG2 3.24Å; V86-V90 WeakPolarHBondContact O-CG2 3.46Å; V86-V90 PolarHBondContact O-N 3.08Å; R87-V90 PolarHBondContact O-N 3.05Å; F88-V90 VanDerWaalsContact C-N 3.32Å; F88-V90 PolarHBondContact O-N 3.36Å; V90-R92 VanDerWaalsContact C-N 3.31Å; V90-R92 PolarHBondContact O-N 3.03Å; V90-L93 PolarHBondContact O-N 2.82Å; V90-S94 WeakPolarHBondContact O-CB 3.44Å; V90-S94 PolarHBondContact O-N 3.3Å; V90-S94 PolarHBondContact O-OG 2.9Å; V90-Q227 HydrophobicContact CG2-CB 3.91Å; V90-V229 HydrophobicContact CG2-CG2 3.58Å; V90-L232 HydrophobicContact CB-CD1 4.38Å; V90-L232 HydrophobicContact CG1-CD1 3.88Å; V90-L232 HydrophobicContact CG2-CD1 4.3Å
91D90.3Very high81.7Confident49 Ų4955.8 Ų55.826%0.26226%0.258SS..Hα-helixtrans-57.9-46.7178.3175.683.3000110.5F39 R87 F88 S94 R95F39-D91 HydrophobicContact CE1-CB 4.31Å; R87-D91 WeakPolarHBondContact O-CB 3.46Å; R87-D91 PolarHBondContact O-N 3.31Å; F88-D91 PolarHBondContact O-N 2.96Å; D91-S94 PolarHBondContact O-N 3.45Å; D91-R95 WeakPolarHBondContact O-CG 3.48Å; D91-R95 PolarHBondContact O-N 3.43Å; D91-R95 IonicContact OD1-NE 2.82Å; D91-R95 IonicContact OD1-NH2 3.81Å; D91-R95 PolarHBondContact OD1-NH2 2.61Å; D91-R95 IonicContact OD2-CZ 3.03Å; D91-R95 IonicContact OD2-NE 2.68Å; D91-R95 PolarHBondContact OD2-NE 2.7Å; D91-R95 IonicContact OD2-NH2 3.69Å; D91-R95 PolarHBondContact OD2-NH2 3.09Å
92R88.1Confident80Confident13 Ų1359.7 Ų59.75%0.04928%0.278CS..Hα-helixtrans-70.4-37.5179.9-64-46.7-166.4-106.65.2114.1H41 E46 F88 A89 V90 S94 F107H41-R92 PolarHBondContact CE1-NH2 3.19Å; H41-R92 PolarHBondContact NE2-NH2 3.4Å; H41-R92 VanDerWaalsContact NE2-NH2 3.15Å; E46-R92 WeakPolarHBondContact OE1-CD 3.39Å; E46-R92 IonicContact OE1-CZ 3.18Å; E46-R92 IonicContact OE1-NE 2.82Å; E46-R92 PolarHBondContact OE1-NE 3.45Å; E46-R92 IonicContact OE1-NH2 2.89Å; E46-R92 IonicContact OE2-CZ 2.65Å; E46-R92 VanDerWaalsContact OE2-CZ 3.26Å; E46-R92 IonicContact OE2-NE 3.5Å; E46-R92 PolarHBondContact OE2-NE 3.26Å; E46-R92 IonicContact OE2-NH2 3.68Å; E46-R92 PolarHBondContact OE2-NH2 2.8Å; F88-R92 HydrophobicContact CD1-CG 4.49Å; F88-R92 HydrophobicContact CD2-CG 4.37Å; F88-R92 HydrophobicContact CE1-CG 4.06Å; F88-R92 HydrophobicContact CE2-CG 3.94Å; F88-R92 HydrophobicContact CZ-CG 3.76Å; F88-R92 WeakPolarHBondContact O-CG 3.3Å; F88-R92 PolarHBondContact O-N 3.14Å; A89-R92 PolarHBondContact O-N 2.86Å; V90-R92 VanDerWaalsContact C-N 3.31Å; V90-R92 PolarHBondContact O-N 3.03Å; R92-S94 VanDerWaalsContact C-N 3.3Å; R92-F107 HydrophobicContact CB-CE2 4.02Å; R92-F107 HydrophobicContact CB-CZ 3.81Å; R92-F107 HydrophobicContact CG-CZ 4.26Å
93L87.7Confident79Confident6 Ų660 Ų603%0.03128%0.279CS..Hα-helixtrans-71.4-27175.4-70.9169.5000112.4A89 V90 L104 F107 V229 L232 L233 V236A89-L93 VanDerWaalsContact O-CB 3.26Å; A89-L93 WeakPolarHBondContact O-CB 3.27Å; A89-L93 WeakPolarHBondContact O-CG 3.48Å; A89-L93 PolarHBondContact O-N 2.68Å; V90-L93 PolarHBondContact O-N 2.82Å; L93-L104 HydrophobicContact CD2-CD1 3.97Å; L93-F107 HydrophobicContact CD2-CD2 4Å; L93-F107 HydrophobicContact CG-CD2 4.16Å; L93-V229 HydrophobicContact CD1-CG1 4.49Å; L93-L232 HydrophobicContact CB-CB 4.37Å; L93-L233 HydrophobicContact CD1-CD2 3.75Å; L93-L233 HydrophobicContact CD1-CG 4.27Å; L93-L233 HydrophobicContact CD2-CD2 4.2Å; L93-V236 HydrophobicContact CB-CG2 4.46Å; L93-V236 HydrophobicContact CD2-CG1 4.46Å; L93-V236 HydrophobicContact CD2-CG2 4.16Å; L93-V236 WeakPolarHBondContact O-CG2 3.35Å
94S87.2Confident78.5Confident62 Ų6256.2 Ų56.243%0.43427%0.265SS..Hα-helixtrans-79.8-27.7179.7-61.50000113V90 D91 R92 T96V90-S94 WeakPolarHBondContact O-CB 3.44Å; V90-S94 PolarHBondContact O-N 3.3Å; V90-S94 PolarHBondContact O-OG 2.9Å; D91-S94 PolarHBondContact O-N 3.45Å; R92-S94 VanDerWaalsContact C-N 3.3Å; S94-T96 PolarHBondContact O-N 2.94Å
95R82.2Confident77.9Confident118 Ų11857.4 Ų57.445%0.44527%0.272SS..SBendtrans-62.5120.6174-71.9172.5-167.7-143.30.6109.2D91 E97D91-R95 WeakPolarHBondContact O-CG 3.48Å; D91-R95 PolarHBondContact O-N 3.43Å; D91-R95 IonicContact OD1-NE 2.82Å; D91-R95 IonicContact OD1-NH2 3.81Å; D91-R95 PolarHBondContact OD1-NH2 2.61Å; D91-R95 IonicContact OD2-CZ 3.03Å; D91-R95 IonicContact OD2-NE 2.68Å; D91-R95 PolarHBondContact OD2-NE 2.7Å; D91-R95 IonicContact OD2-NH2 3.69Å; D91-R95 PolarHBondContact OD2-NH2 3.09Å; R95-E97 PolarHBondContact O-N 3.05Å
96T58.8Low77.5Confident134 Ų13458.2 Ų58.282%0.82227%0.274SS*.SBendtrans-66-18-18043.60000112.9S94 R98S94-T96 PolarHBondContact O-N 2.94Å; T96-R98 VanDerWaalsContact C-N 3.28Å; T96-R98 PolarHBondContact O-N 2.9Å
97E54.7Low77.3Confident166 Ų16658.8 Ų58.878%0.77628%0.277SS*.SBendtrans-6590.8168.8-71.6-174.7172.900109.3R95R95-E97 PolarHBondContact O-N 3.05Å
98R54.8Low77.1Confident180 Ų18053.9 Ų53.968%0.67926%0.258SS*.  trans3.890.3165.7-59.9-179.5-165.2152.612.1111.7T96 R100T96-R98 VanDerWaalsContact C-N 3.28Å; T96-R98 PolarHBondContact O-N 2.9Å; R98-R100 PolarHBondContact O-N 2.92Å
99P53.7Low76.9Confident32 Ų3254.7 Ų54.721%0.20827%0.265CS..  trans-50.5122.7167.618.4-29.7000106.4L101 V236P99-L101 PolarHBondContact O-N 2.97Å; P99-V236 HydrophobicContact CG-CG1 3.72Å; P99-V236 HydrophobicContact CG-CG2 4.47Å
100R61.9Low76.8Confident129 Ų12954.9 Ų54.949%0.48727%0.267SS..  trans-52.4132.7179.7-61-177-163.7170.38.9105.8T47 R98 I102 H103T47-R100 PolarHBondContact OG1-NH1 2.87Å; R98-R100 PolarHBondContact O-N 2.92Å; R100-I102 PolarHBondContact O-N 3.26Å; R100-H103 WeakPolarHBondContact O-CA 3.45Å; R100-H103 VanDerWaalsContact O-CB 3.29Å; R100-H103 WeakPolarHBondContact O-CB 3.05Å; R100-H103 PolarHBondContact O-N 2.93Å
101L57.1Low76.8Confident52 Ų5254 Ų5427%0.27226%0.261SS..Hα-helixtrans-45-42.6-174.6160.351.2000112.3P99 H103 L104P99-L101 PolarHBondContact O-N 2.97Å; L101-H103 PolarHBondContact O-N 3.28Å; L101-L104 WeakPolarHBondContact O-CB 3.2Å; L101-L104 PolarHBondContact O-N 3.35Å
102I60.7Low76.8Confident82 Ų8254.7 Ų54.742%0.42127%0.265SS..Hα-helixtrans-47.6-42.6174.5-66.5173.8000112R100 L104 Y106R100-I102 PolarHBondContact O-N 3.26Å; I102-L104 PolarHBondContact O-N 3.3Å; I102-Y106 HydrophobicContact CB-CE2 4.42Å; I102-Y106 HydrophobicContact CG2-CD2 3.92Å; I102-Y106 HydrophobicContact CG2-CE2 3.12Å; I102-Y106 WeakPolarHBondContact O-CD2 3.48Å; I102-Y106 WeakPolarHBondContact O-CE2 3.33Å; I102-Y106 VanDerWaalsContact O-CG 3.28Å
103H74.9Confident76.9Confident10 Ų1054.1 Ų54.15%0.04626%0.263CS..Hα-helixtrans-70.8-32.5-178-57.3-163.9000111.6V50 R100 L101 Y106 F107V50-H103 HydrophobicContact CG1-CB 4.34Å; R100-H103 WeakPolarHBondContact O-CA 3.45Å; R100-H103 VanDerWaalsContact O-CB 3.29Å; R100-H103 WeakPolarHBondContact O-CB 3.05Å; R100-H103 PolarHBondContact O-N 2.93Å; L101-H103 PolarHBondContact O-N 3.28Å; H103-Y106 PolarHBondContact O-N 3.37Å; H103-F107 HydrophobicContact CB-CD2 4.17Å; H103-F107 HydrophobicContact CB-CE2 3.78Å; H103-F107 WeakPolarHBondContact O-CB 3.47Å; H103-F107 WeakPolarHBondContact O-CD2 3.31Å; H103-F107 VanDerWaalsContact O-CG 3.26Å; H103-F107 WeakPolarHBondContact O-CG 3.31Å; H103-F107 PolarHBondContact O-N 3.5Å
104L84.3Confident77.1Confident2 Ų253.8 Ų53.81%0.0126%0.261CS..Hα-helixtrans-65.6-45.6-179.3-177.665000111.4L93 L101 I102 Y106 F107 I108 L233 V236 R281L93-L104 HydrophobicContact CD2-CD1 3.97Å; L101-L104 WeakPolarHBondContact O-CB 3.2Å; L101-L104 PolarHBondContact O-N 3.35Å; I102-L104 PolarHBondContact O-N 3.3Å; L104-Y106 PolarHBondContact O-N 3.08Å; L104-F107 PolarHBondContact O-N 3.01Å; L104-I108 HydrophobicContact CD1-CD1 4.13Å; L104-I108 HydrophobicContact CD1-CG1 4.25Å; L104-I108 HydrophobicContact CD2-CD1 4.36Å; L104-I108 HydrophobicContact CG-CD1 3.79Å; L104-I108 HydrophobicContact CG-CG1 4.35Å; L104-I108 VanDerWaalsContact O-CG1 3.25Å; L104-I108 WeakPolarHBondContact O-CG1 3.14Å; L104-I108 PolarHBondContact O-N 3.39Å; L104-L233 HydrophobicContact CD1-CD2 3.72Å; L104-V236 HydrophobicContact CD1-CG1 4.14Å; L104-V236 HydrophobicContact CD2-CG1 4.37Å; L104-R281 VanDerWaalsContact CD2-NH1 3.34Å
105N83.4Confident77.3Confident37 Ų3751 Ų5120%0.19824%0.241CC..Hα-helixtrans-59.3-42.1178.5-642.4000110.8I108 A109 E280 N284N105-I108 PolarHBondContact O-N 3.23Å; N105-A109 WeakPolarHBondContact O-CB 3.24Å; N105-A109 PolarHBondContact O-N 3.48Å; N105-E280 PolarHBondContact ND2-OE1 3.2Å; N105-N284 PolarHBondContact OD1-ND2 2.95Å; N105-N284 PolarHBondContact OD1-OD1 2.9Å
106Y85.3Confident77.5Confident22 Ų2246.8 Ų46.89%0.08623%0.23CC..Hα-helixtrans-68.9-41.9179.6-56.5-28.8000111.7V50 I102 H103 L104 A109 V110 L129V50-Y106 HydrophobicContact CG1-CD2 4.4Å; I102-Y106 HydrophobicContact CB-CE2 4.42Å; I102-Y106 HydrophobicContact CG2-CD2 3.92Å; I102-Y106 HydrophobicContact CG2-CE2 3.12Å; I102-Y106 WeakPolarHBondContact O-CD2 3.48Å; I102-Y106 WeakPolarHBondContact O-CE2 3.33Å; I102-Y106 VanDerWaalsContact O-CG 3.28Å; H103-Y106 PolarHBondContact O-N 3.37Å; L104-Y106 PolarHBondContact O-N 3.08Å; Y106-A109 PolarHBondContact O-N 2.82Å; Y106-V110 VanDerWaalsContact O-CB 3.24Å; Y106-V110 WeakPolarHBondContact O-CB 3.4Å; Y106-V110 WeakPolarHBondContact O-CG2 3.24Å; Y106-V110 PolarHBondContact O-N 3.36Å; Y106-L129 HydrophobicContact CD1-CD1 4.05Å; Y106-L129 HydrophobicContact CD1-CD2 4.11Å; Y106-L129 HydrophobicContact CD1-CG 4.34Å; Y106-L129 HydrophobicContact CD2-CD2 3.63Å; Y106-L129 HydrophobicContact CE1-CD1 3.98Å; Y106-L129 HydrophobicContact CE1-CD2 3.8Å; Y106-L129 HydrophobicContact CE1-CG 3.86Å; Y106-L129 HydrophobicContact CE2-CD2 3.23Å; Y106-L129 HydrophobicContact CE2-CG 4.16Å; Y106-L129 HydrophobicContact CG-CD2 4.05Å
107F89.3Confident78.8Confident12 Ų1240.5 Ų40.55%0.05319%0.192CC..Hα-helixtrans-60.6-47.9173.3-69.3-46.6000111.1F88 A89 R92 L93 H103 L104 A109 V110 L111F88-F107 HydrophobicContact CD1-CE1 4.08Å; F88-F107 HydrophobicContact CD1-CZ 4.44Å; F88-F107 AromaticContact CE1-CE1 3.99Å; F88-F107 HydrophobicContact CE1-CE1 3.99Å; F88-F107 HydrophobicContact CE1-CZ 4.03Å; A89-F107 HydrophobicContact CB-CD1 3.54Å; A89-F107 HydrophobicContact CB-CE1 3.74Å; A89-F107 HydrophobicContact CB-CG 4.25Å; R92-F107 HydrophobicContact CB-CE2 4.02Å; R92-F107 HydrophobicContact CB-CZ 3.81Å; R92-F107 HydrophobicContact CG-CZ 4.26Å; L93-F107 HydrophobicContact CD2-CD2 4Å; L93-F107 HydrophobicContact CG-CD2 4.16Å; H103-F107 HydrophobicContact CB-CD2 4.17Å; H103-F107 HydrophobicContact CB-CE2 3.78Å; H103-F107 WeakPolarHBondContact O-CB 3.47Å; H103-F107 WeakPolarHBondContact O-CD2 3.31Å; H103-F107 VanDerWaalsContact O-CG 3.26Å; H103-F107 WeakPolarHBondContact O-CG 3.31Å; H103-F107 PolarHBondContact O-N 3.5Å; L104-F107 PolarHBondContact O-N 3.01Å; F107-A109 VanDerWaalsContact C-N 3.33Å; F107-A109 PolarHBondContact O-N 2.98Å; F107-V110 PolarHBondContact O-N 2.8Å; F107-L111 HydrophobicContact CB-CD1 4.49Å; F107-L111 VanDerWaalsContact O-CB 3.27Å; F107-L111 WeakPolarHBondContact O-CB 3.38Å; F107-L111 VanDerWaalsContact O-CD1 3.32Å; F107-L111 WeakPolarHBondContact O-CD1 3.18Å; F107-L111 WeakPolarHBondContact O-CG 3.36Å; F107-L111 PolarHBondContact O-N 2.88Å
108I89.7Confident80.2Confident4 Ų436.1 Ų36.12%0.02117%0.174CC..Hα-helixtrans-57-48.6177.9-66.8165.9000110.8L104 N105 L111 N112 L233 N284 S287 I288L104-I108 HydrophobicContact CD1-CD1 4.13Å; L104-I108 HydrophobicContact CD1-CG1 4.25Å; L104-I108 HydrophobicContact CD2-CD1 4.36Å; L104-I108 HydrophobicContact CG-CD1 3.79Å; L104-I108 HydrophobicContact CG-CG1 4.35Å; L104-I108 VanDerWaalsContact O-CG1 3.25Å; L104-I108 WeakPolarHBondContact O-CG1 3.14Å; L104-I108 PolarHBondContact O-N 3.39Å; N105-I108 PolarHBondContact O-N 3.23Å; I108-L111 PolarHBondContact O-N 3.11Å; I108-N112 WeakPolarHBondContact O-CB 2.96Å; I108-N112 PolarHBondContact O-N 3.33Å; I108-L233 HydrophobicContact CG1-CD2 4.09Å; I108-N284 HydrophobicContact CD1-CB 3.74Å; I108-S287 VanDerWaalsContact CG2-CB 3.49Å; I108-I288 HydrophobicContact CD1-CD1 3.78Å; I108-I288 HydrophobicContact CD1-CG1 3.77Å; I108-I288 HydrophobicContact CG1-CD1 4.29Å; I108-I288 HydrophobicContact CG1-CG1 3.9Å
109A88.4Confident81.6Confident18 Ų1834.2 Ų34.215%0.14917%0.172CC..Hα-helixtrans-62-49.9-179.700000112.3N105 Y106 F107 L111 N112 G113 S120 L121N105-A109 WeakPolarHBondContact O-CB 3.24Å; N105-A109 PolarHBondContact O-N 3.48Å; Y106-A109 PolarHBondContact O-N 2.82Å; F107-A109 VanDerWaalsContact C-N 3.33Å; F107-A109 PolarHBondContact O-N 2.98Å; A109-L111 VanDerWaalsContact C-N 3.33Å; A109-L111 PolarHBondContact O-N 3.04Å; A109-N112 WeakPolarHBondContact O-CB 3.46Å; A109-N112 PolarHBondContact O-N 2.87Å; A109-N112 VanDerWaalsContact O-N 3.16Å; A109-G113 PolarHBondContact O-N 3.44Å; A109-S120 WeakPolarHBondContact CB-O 3.47Å; A109-S120 WeakPolarHBondContact O-CB 3.29Å; A109-L121 HydrophobicContact CB-CD2 3.56Å
110V89.3Confident83.1Confident5 Ų533.3 Ų33.33%0.0317%0.167CC..Hα-helixtrans-55.3-49.4177162.70000110.9A54 T57 V85 Y106 F107 N112 G113 M114A54-V110 HydrophobicContact CB-CG2 4.15Å; T57-V110 HydrophobicContact CG2-CG1 3.65Å; V85-V110 HydrophobicContact CG1-CG1 3.77Å; Y106-V110 VanDerWaalsContact O-CB 3.24Å; Y106-V110 WeakPolarHBondContact O-CB 3.4Å; Y106-V110 WeakPolarHBondContact O-CG2 3.24Å; Y106-V110 PolarHBondContact O-N 3.36Å; F107-V110 PolarHBondContact O-N 2.8Å; V110-N112 VanDerWaalsContact C-N 3.3Å; V110-N112 PolarHBondContact O-N 3.44Å; V110-G113 PolarHBondContact O-N 3.02Å; V110-M114 HydrophobicContact CG1-SD 4.3Å; V110-M114 WeakPolarHBondContact O-CG 3.36Å; V110-M114 PolarHBondContact O-N 3.35Å
111L91.5Very high84.2Confident1 Ų127.6 Ų27.61%0.00515%0.146CC..Hα-helixtrans-63.9-36.9179.9-64.9169.8000111.8V86 F107 I108 A109 M114 C115 L224 V229 L233V86-L111 HydrophobicContact CG2-CD2 4.42Å; F107-L111 HydrophobicContact CB-CD1 4.49Å; F107-L111 VanDerWaalsContact O-CB 3.27Å; F107-L111 WeakPolarHBondContact O-CB 3.38Å; F107-L111 VanDerWaalsContact O-CD1 3.32Å; F107-L111 WeakPolarHBondContact O-CD1 3.18Å; F107-L111 WeakPolarHBondContact O-CG 3.36Å; F107-L111 PolarHBondContact O-N 2.88Å; I108-L111 PolarHBondContact O-N 3.11Å; A109-L111 VanDerWaalsContact C-N 3.33Å; A109-L111 PolarHBondContact O-N 3.04Å; L111-M114 PolarHBondContact O-N 2.92Å; L111-C115 PolarHBondContact O-N 3.35Å; L111-C115 PolarHBondContact O-SG 2.82Å; L111-C115 VanDerWaalsContact O-SG 3.39Å; L111-L224 HydrophobicContact CD2-CD1 4.33Å; L111-L224 HydrophobicContact CD2-CD2 3.38Å; L111-L224 HydrophobicContact CD2-CG 4.49Å; L111-V229 HydrophobicContact CD1-CG1 3.56Å; L111-V229 HydrophobicContact CD2-CG1 4.15Å; L111-L233 HydrophobicContact CD1-CD1 3.83Å; L111-L233 HydrophobicContact CD1-CD2 4.38Å; L111-L233 HydrophobicContact CD1-CG 4.46Å
112N89.8Confident85.5Confident64 Ų6429.2 Ų29.234%0.34216%0.16SC..Hα-helixtrans-65.5-42.6174.9-166.622.1000112.1I108 A109 V110 M114 C115 S116 L291I108-N112 WeakPolarHBondContact O-CB 2.96Å; I108-N112 PolarHBondContact O-N 3.33Å; A109-N112 WeakPolarHBondContact O-CB 3.46Å; A109-N112 PolarHBondContact O-N 2.87Å; A109-N112 VanDerWaalsContact O-N 3.16Å; V110-N112 VanDerWaalsContact C-N 3.3Å; V110-N112 PolarHBondContact O-N 3.44Å; N112-M114 VanDerWaalsContact C-N 3.29Å; N112-M114 PolarHBondContact O-N 2.9Å; N112-C115 PolarHBondContact O-N 3.39Å; N112-S116 WeakPolarHBondContact O-CB 3Å; N112-S116 PolarHBondContact O-N 3.11Å; N112-S116 PolarHBondContact O-OG 3.07Å; N112-L291 HydrophobicContact CB-CD2 3.94Å
113G90.6Very high86.7Confident0 Ų034.3 Ų34.30%017%0.174CC..Hα-helixtrans-62.1-37.4173.800000112.8A109 V110 S116 G117 N118A109-G113 PolarHBondContact O-N 3.44Å; V110-G113 PolarHBondContact O-N 3.02Å; G113-S116 PolarHBondContact O-N 3.04Å; G113-S116 PolarHBondContact O-OG 2.86Å; G113-G117 WeakPolarHBondContact O-CA 3.48Å; G113-G117 PolarHBondContact O-N 3.38Å; G113-N118 WeakPolarHBondContact CA-O 3.49Å
114M91.8Very high87.1Confident0 Ų037.1 Ų37.10%020%0.199CC..Hα-helixtrans-65.4-41.7175.5-68.8-176.663.200112.5T57 M82 V85 V86 V110 L111 N112 S220T57-M114 HydrophobicContact CG2-CG 4.07Å; T57-M114 HydrophobicContact CG2-SD 4.47Å; M82-M114 HydrophobicContact CB-CE 3.67Å; M82-M114 HydrophobicContact CG-CE 4.17Å; M82-M114 HydrophobicContact SD-CE 4.22Å; M82-M114 HydrophobicContact SD-CG 4.12Å; M82-M114 HydrophobicContact SD-SD 4.15Å; V85-M114 HydrophobicContact CG1-SD 4.46Å; V86-M114 HydrophobicContact CG2-CE 3.31Å; V86-M114 HydrophobicContact CG2-SD 3.71Å; V110-M114 HydrophobicContact CG1-SD 4.3Å; V110-M114 WeakPolarHBondContact O-CG 3.36Å; V110-M114 PolarHBondContact O-N 3.35Å; L111-M114 PolarHBondContact O-N 2.92Å; N112-M114 VanDerWaalsContact C-N 3.29Å; N112-M114 PolarHBondContact O-N 2.9Å; M114-S220 WeakPolarHBondContact O-CB 3.27Å
115C91.1Very high87.2Confident3 Ų338 Ų382%0.0221%0.206CC..Hα-helixtrans-69.6-34.6178-75.70000113.6L111 N112 Q221 L224 P292L111-C115 PolarHBondContact O-N 3.35Å; L111-C115 PolarHBondContact O-SG 2.82Å; L111-C115 VanDerWaalsContact O-SG 3.39Å; N112-C115 PolarHBondContact O-N 3.39Å; C115-Q221 HydrophobicContact CB-CG 4.39Å; C115-Q221 PolarHBondContact O-NE2 3.42Å; C115-L224 WeakPolarHBondContact SG-CD1 3.27Å; C115-P292 HydrophobicContact CB-CG 3.73Å
116S87Confident87.4Confident29 Ų2936.9 Ų36.920%0.20320%0.2CC..Hα-helixtrans-94.4-18.7-175.3600000113.9N112 G113 N118 M217N112-S116 WeakPolarHBondContact O-CB 3Å; N112-S116 PolarHBondContact O-N 3.11Å; N112-S116 PolarHBondContact O-OG 3.07Å; G113-S116 PolarHBondContact O-N 3.04Å; G113-S116 PolarHBondContact O-OG 2.86Å; S116-N118 PolarHBondContact O-N 3.38Å; S116-M217 VanDerWaalsContact O-SD 3.39Å
117G85.3Confident87.5Confident2 Ų240 Ų402%0.02122%0.217CC..THydrogen-bonded Turntrans6720.1-174.300000113.7G113G113-G117 WeakPolarHBondContact O-CA 3.48Å; G113-G117 PolarHBondContact O-N 3.38Å
118N85.3Confident87.4Confident74 Ų7442.3 Ų42.340%0.39623%0.233SC..SBendtrans-124.6176.7-176.3-66.7-31.2000111.2T61 G113 S116 S120T61-N118 WeakPolarHBondContact CB-O 3.29Å; T61-N118 PolarHBondContact OG1-O 2.98Å; G113-N118 WeakPolarHBondContact CA-O 3.49Å; S116-N118 PolarHBondContact O-N 3.38Å; N118-S120 PolarHBondContact O-N 2.94Å
119E83.9Confident87.3Confident140 Ų14042.1 Ų42.165%0.65423%0.232SC*.  trans-50.5120.3173-69.8179.2-158.900111.9A62A62-E119 HydrophobicContact CB-CG 3.57Å
120S83.6Confident87.3Confident14 Ų1441.5 Ų41.510%0.09823%0.226CC..  trans-84.2-28-179.241.40000115.1H58 A109 N118H58-S120 VanDerWaalsContact CA-OG 3.29Å; H58-S120 WeakPolarHBondContact CA-OG 3.31Å; H58-S120 WeakPolarHBondContact CB-OG 3.21Å; H58-S120 PolarHBondContact ND1-N 2.97Å; H58-S120 PolarHBondContact ND1-OG 3.22Å; A109-S120 WeakPolarHBondContact CB-O 3.47Å; A109-S120 WeakPolarHBondContact O-CB 3.29Å; N118-S120 PolarHBondContact O-N 2.94Å
121L86.4Confident87.2Confident8 Ų843.4 Ų43.44%0.04224%0.242CC..SBendtrans-119.3131.7-166.2-66.5173.3000110.3L55 H58 A109 A125 I126 L129L55-L121 HydrophobicContact CD2-CD1 4.48Å; H58-L121 HydrophobicContact CB-CB 4.37Å; H58-L121 HydrophobicContact CB-CD1 3.54Å; H58-L121 HydrophobicContact CB-CG 3.97Å; H58-L121 PolarHBondContact CE1-O 3.38Å; H58-L121 PolarHBondContact ND1-N 2.82Å; H58-L121 VanDerWaalsContact ND1-N 3.19Å; A109-L121 HydrophobicContact CB-CD2 3.56Å; L121-A125 HydrophobicContact CB-CB 4.38Å; L121-A125 HydrophobicContact CD2-CB 4.17Å; L121-I126 HydrophobicContact CB-CG1 3.95Å; L121-L129 HydrophobicContact CD1-CD1 3.53Å; L121-L129 HydrophobicContact CD2-CD1 4.19Å
122P84.4Confident86.8Confident87 Ų8746 Ų4657%0.56526%0.255SS*.  trans-68.5155.4169.529.7-34.3000110.4A124 A125 I126P122-A124 PolarHBondContact O-N 3.45Å; P122-A124 VanDerWaalsContact O-N 3.1Å; P122-A125 HydrophobicContact CG-CB 3.83Å; P122-A125 WeakPolarHBondContact O-CA 2.95Å; P122-A125 WeakPolarHBondContact O-CB 2.77Å; P122-A125 PolarHBondContact O-N 3.39Å; P122-I126 PolarHBondContact O-N 3Å; P122-I126 VanDerWaalsContact O-N 3.11Å
123R85Confident86.7Confident188 Ų18843.2 Ų43.271%0.70924%0.239SC*.Hα-helixtrans-50.9-39.6-179.4-171.9173.4-176.6157.71113.9A125 I126 I127R123-A125 PolarHBondContact O-N 3.41Å; R123-I126 PolarHBondContact O-N 3.4Å; R123-I127 HydrophobicContact CG-CD1 4.18Å; R123-I127 WeakPolarHBondContact O-CG1 3.37Å; R123-I127 PolarHBondContact O-N 2.57Å
124A84.5Confident86.5Confident70 Ų7049 Ų4958%0.57927%0.265SS*.Hα-helixtrans-61.2-42.6176.400000112.2P122 I127 T128P122-A124 PolarHBondContact O-N 3.45Å; P122-A124 VanDerWaalsContact O-N 3.1Å; A124-I127 PolarHBondContact O-N 3.4Å; A124-T128 PolarHBondContact O-N 3.16Å; A124-T128 PolarHBondContact O-OG1 2.92Å; A124-T128 VanDerWaalsContact O-OG1 3.11Å
125A85.4Confident86.2Confident20 Ų2053.9 Ų53.917%0.16529%0.294CS..Hα-helixtrans-67.1-38.4177.500000111.7L121 P122 R123 T128 L129L121-A125 HydrophobicContact CB-CB 4.38Å; L121-A125 HydrophobicContact CD2-CB 4.17Å; P122-A125 HydrophobicContact CG-CB 3.83Å; P122-A125 WeakPolarHBondContact O-CA 2.95Å; P122-A125 WeakPolarHBondContact O-CB 2.77Å; P122-A125 PolarHBondContact O-N 3.39Å; R123-A125 PolarHBondContact O-N 3.41Å; A125-T128 PolarHBondContact O-N 3.43Å; A125-L129 VanDerWaalsContact O-CB 3.27Å; A125-L129 WeakPolarHBondContact O-CB 3.13Å; A125-L129 WeakPolarHBondContact O-CD1 3.13Å; A125-L129 VanDerWaalsContact O-CG 3.3Å; A125-L129 WeakPolarHBondContact O-CG 3.37Å; A125-L129 PolarHBondContact O-N 2.98Å
126I88Confident85.9Confident14 Ų1454.7 Ų54.77%0.07230%0.299CS..Hα-helixtrans-58.5-49.5174.2-58.6170.4000109.9F16 L55 H58 L121 P122 R123 T128 L129 S130F16-I126 HydrophobicContact CD2-CG2 3.61Å; F16-I126 HydrophobicContact CE1-CG2 4.45Å; F16-I126 HydrophobicContact CE2-CG2 3.48Å; F16-I126 VanDerWaalsContact CE2-CG2 3.48Å; F16-I126 HydrophobicContact CG-CG2 4.16Å; F16-I126 HydrophobicContact CZ-CG2 3.94Å; L55-I126 HydrophobicContact CD2-CG2 4.13Å; H58-I126 WeakPolarHBondContact NE2-CD1 3.4Å; L121-I126 HydrophobicContact CB-CG1 3.95Å; P122-I126 PolarHBondContact O-N 3Å; P122-I126 VanDerWaalsContact O-N 3.11Å; R123-I126 PolarHBondContact O-N 3.4Å; I126-T128 PolarHBondContact O-N 2.9Å; I126-L129 PolarHBondContact O-N 3.41Å; I126-S130 WeakPolarHBondContact O-CB 3.32Å; I126-S130 PolarHBondContact O-N 2.89Å; I126-S130 PolarHBondContact O-OG 3.33Å
127I87.6Confident85.9Confident86 Ų8657.8 Ų57.844%0.44131%0.313SS..Hα-helixtrans-58.4-49179.4-67.8165.6000110.8R123 A124 S130 A131R123-I127 HydrophobicContact CG-CD1 4.18Å; R123-I127 WeakPolarHBondContact O-CG1 3.37Å; R123-I127 PolarHBondContact O-N 2.57Å; A124-I127 PolarHBondContact O-N 3.4Å; I127-S130 PolarHBondContact O-N 3.41Å; I127-A131 WeakPolarHBondContact O-CB 3.45Å; I127-A131 PolarHBondContact O-N 2.86Å
128T86.7Confident86Confident62 Ų6258.9 Ų58.938%0.3832%0.318SS..Hα-helixtrans-62.1-44.6179.6-59.60000112A124 A125 I126 A131 H132A124-T128 PolarHBondContact O-N 3.16Å; A124-T128 PolarHBondContact O-OG1 2.92Å; A124-T128 VanDerWaalsContact O-OG1 3.11Å; A125-T128 PolarHBondContact O-N 3.43Å; I126-T128 PolarHBondContact O-N 2.9Å; T128-A131 WeakPolarHBondContact O-CB 3.38Å; T128-A131 PolarHBondContact O-N 3.23Å; T128-H132 PolarHBondContact O-N 3.33Å
129L87.9Confident86.1Confident0 Ų055.5 Ų55.50%030%0.3CS..Hα-helixtrans-65.6-43.8177.4-78.6165.1000111.8T51 A54 L55 Y106 L121 A125 I126 A131 H132 L133T51-L129 HydrophobicContact CG2-CB 4.04Å; T51-L129 HydrophobicContact CG2-CD2 3.72Å; T51-L129 WeakPolarHBondContact CG2-O 3.38Å; A54-L129 HydrophobicContact CB-CD1 4.09Å; A54-L129 HydrophobicContact CB-CD2 4.28Å; L55-L129 HydrophobicContact CD1-CB 4.07Å; L55-L129 HydrophobicContact CD2-CB 3.64Å; L55-L129 HydrophobicContact CD2-CD1 4.12Å; L55-L129 HydrophobicContact CG-CB 3.84Å; L55-L129 HydrophobicContact CG-CD1 4.46Å; Y106-L129 HydrophobicContact CD1-CD1 4.05Å; Y106-L129 HydrophobicContact CD1-CD2 4.11Å; Y106-L129 HydrophobicContact CD1-CG 4.34Å; Y106-L129 HydrophobicContact CD2-CD2 3.63Å; Y106-L129 HydrophobicContact CE1-CD1 3.98Å; Y106-L129 HydrophobicContact CE1-CD2 3.8Å; Y106-L129 HydrophobicContact CE1-CG 3.86Å; Y106-L129 HydrophobicContact CE2-CD2 3.23Å; Y106-L129 HydrophobicContact CE2-CG 4.16Å; Y106-L129 HydrophobicContact CG-CD2 4.05Å; L121-L129 HydrophobicContact CD1-CD1 3.53Å; L121-L129 HydrophobicContact CD2-CD1 4.19Å; A125-L129 VanDerWaalsContact O-CB 3.27Å; A125-L129 WeakPolarHBondContact O-CB 3.13Å; A125-L129 WeakPolarHBondContact O-CD1 3.13Å; A125-L129 VanDerWaalsContact O-CG 3.3Å; A125-L129 WeakPolarHBondContact O-CG 3.37Å; A125-L129 PolarHBondContact O-N 2.98Å; I126-L129 PolarHBondContact O-N 3.41Å; L129-A131 PolarHBondContact O-N 3.1Å; L129-H132 PolarHBondContact O-N 3.38Å; L129-L133 WeakPolarHBondContact O-CB 3.43Å; L129-L133 PolarHBondContact O-N 3.46Å
130S88Confident86.1Confident4 Ų453.3 Ų53.33%0.02830%0.298CS..Hα-helixtrans-61.6-35.6175.1-63.10000111.3L10 I126 I127 L133 K134L10-S130 PolarHBondContact O-OG 3.24Å; I126-S130 WeakPolarHBondContact O-CB 3.32Å; I126-S130 PolarHBondContact O-N 2.89Å; I126-S130 PolarHBondContact O-OG 3.33Å; I127-S130 PolarHBondContact O-N 3.41Å; S130-L133 PolarHBondContact O-N 3.29Å; S130-K134 WeakPolarHBondContact O-CG 3.44Å; S130-K134 PolarHBondContact O-N 3.15Å
131A86.6Confident86.1Confident45 Ų4556.5 Ų56.537%0.37231%0.312SS..Hα-helixtrans-66.3-46.9172.900000111.5I127 T128 L129 L133 K134 T135I127-A131 WeakPolarHBondContact O-CB 3.45Å; I127-A131 PolarHBondContact O-N 2.86Å; T128-A131 WeakPolarHBondContact O-CB 3.38Å; T128-A131 PolarHBondContact O-N 3.23Å; L129-A131 PolarHBondContact O-N 3.1Å; A131-L133 VanDerWaalsContact C-N 3.27Å; A131-L133 PolarHBondContact O-N 3.42Å; A131-K134 WeakPolarHBondContact O-CB 3.27Å; A131-K134 PolarHBondContact O-N 3.34Å; A131-K134 VanDerWaalsContact O-N 3.08Å; A131-T135 PolarHBondContact O-N 3.34Å; A131-T135 VanDerWaalsContact O-N 3.17Å; A131-T135 PolarHBondContact O-OG1 2.84Å
132H84.9Confident85.9Confident57 Ų5756.1 Ų56.126%0.26431%0.31SS..Hα-helixtrans-59.2-38.2174.6-71.4175.5000112.5T51 T128 L129 K134 T135 T136T51-H132 HydrophobicContact CG2-CB 4.27Å; T128-H132 PolarHBondContact O-N 3.33Å; L129-H132 PolarHBondContact O-N 3.38Å; H132-K134 PolarHBondContact O-N 2.92Å; H132-T135 PolarHBondContact O-N 3.23Å; H132-T135 PolarHBondContact O-OG1 3.37Å; H132-T136 VanDerWaalsContact O-CB 3.27Å; H132-T136 WeakPolarHBondContact O-CB 3.32Å; H132-T136 PolarHBondContact O-N 3.03Å
133L87.2Confident85.7Confident4 Ų455.1 Ų55.12%0.02130%0.297CS..Hα-helixtrans-66.8-28.4178.3-16556.5000112.1V7 L10 L11 F48 T51 F52 L55 L129 S130 A131 T136V7-L133 HydrophobicContact CG1-CD2 3.99Å; V7-L133 HydrophobicContact CG1-CG 4.19Å; L10-L133 HydrophobicContact CB-CD2 4.4Å; L11-L133 HydrophobicContact CD2-CB 3.8Å; L11-L133 HydrophobicContact CD2-CD2 3.79Å; L11-L133 HydrophobicContact CD2-CG 3.81Å; F48-L133 HydrophobicContact CD2-CD1 3.52Å; F48-L133 HydrophobicContact CE2-CD1 3.73Å; T51-L133 HydrophobicContact CG2-CB 3.73Å; T51-L133 HydrophobicContact CG2-CD1 4.2Å; T51-L133 HydrophobicContact CG2-CG 4.42Å; F52-L133 HydrophobicContact CB-CD1 4.38Å; L55-L133 HydrophobicContact CD1-CD2 3.89Å; L129-L133 WeakPolarHBondContact O-CB 3.43Å; L129-L133 PolarHBondContact O-N 3.46Å; S130-L133 PolarHBondContact O-N 3.29Å; A131-L133 VanDerWaalsContact C-N 3.27Å; A131-L133 PolarHBondContact O-N 3.42Å; L133-T136 HydrophobicContact CD1-CG2 4.39Å
134K86.6Confident85.2Confident123 Ų12348.8 Ų48.854%0.53528%0.284SS..Hα-helixtrans-74.5-35.6174.3-70.3170.3-173.1174.80112.6L11 S130 A131 H132L11-K134 HydrophobicContact CD1-CG 4.09Å; L11-K134 HydrophobicContact CD2-CG 3.89Å; L11-K134 HydrophobicContact CG-CG 4.44Å; L11-K134 WeakPolarHBondContact O-CE 3.34Å; L11-K134 PolarHBondContact O-NZ 3.46Å; S130-K134 WeakPolarHBondContact O-CG 3.44Å; S130-K134 PolarHBondContact O-N 3.15Å; A131-K134 WeakPolarHBondContact O-CB 3.27Å; A131-K134 PolarHBondContact O-N 3.34Å; A131-K134 VanDerWaalsContact O-N 3.08Å; H132-K134 PolarHBondContact O-N 2.92Å
135T85Confident84.9Confident101 Ų10146.4 Ų46.462%0.6226%0.263SS*.Hα-helixtrans-97.9-15-171.860.90000113.9A131 H132A131-T135 PolarHBondContact O-N 3.34Å; A131-T135 VanDerWaalsContact O-N 3.17Å; A131-T135 PolarHBondContact O-OG1 2.84Å; H132-T135 PolarHBondContact O-N 3.23Å; H132-T135 PolarHBondContact O-OG1 3.37Å
136T85.6Confident84.5Confident20 Ų2045.8 Ų45.812%0.12326%0.257CS..SBendtrans-66.5152.3179.9-169.50000112F48 H132 L133 L138F48-T136 HydrophobicContact CB-CG2 3.7Å; F48-T136 HydrophobicContact CD2-CG2 3.91Å; F48-T136 HydrophobicContact CG-CG2 4.31Å; F48-T136 PolarHBondContact N-OG1 2.78Å; H132-T136 VanDerWaalsContact O-CB 3.27Å; H132-T136 WeakPolarHBondContact O-CB 3.32Å; H132-T136 PolarHBondContact O-N 3.03Å; L133-T136 HydrophobicContact CD1-CG2 4.39Å; T136-L138 HydrophobicContact CG2-CD2 4.46Å; T136-L138 PolarHBondContact O-N 3.08Å
137L86.6Confident83.2Confident95 Ų9550 Ų5050%0.49727%0.272SS..PPolyproline II helixtrans-61.5126.4168.6-74.1160.8000109.4E44 F45E44-L137 HydrophobicContact CB-CD1 4.27Å; F45-L137 HydrophobicContact CD1-CB 4.19Å; F45-L137 HydrophobicContact CE1-CB 4.21Å
138L87.6Confident81.4Confident24 Ų2455.2 Ų55.213%0.12629%0.286CS..PPolyproline II helixtrans-91.1133.6176.9-63.4175.4000109.9F45 F48 T136 V142 K143 V146F45-L138 WeakPolarHBondContact CE1-O 3.17Å; F48-L138 HydrophobicContact CD2-CD2 3.53Å; F48-L138 HydrophobicContact CE2-CD2 3.61Å; F48-L138 HydrophobicContact CG-CD2 4.46Å; T136-L138 HydrophobicContact CG2-CD2 4.46Å; T136-L138 PolarHBondContact O-N 3.08Å; L138-V142 HydrophobicContact CB-CG1 4.41Å; L138-V142 HydrophobicContact CD2-CG1 4Å; L138-K143 HydrophobicContact CB-CB 3.94Å; L138-K143 HydrophobicContact CB-CG 4.46Å; L138-V146 HydrophobicContact CD1-CB 4.22Å; L138-V146 HydrophobicContact CD1-CG1 4.05Å
139P87Confident79.7Confident3 Ų358.7 Ų58.72%0.01930%0.298CS..PPolyproline II helixtrans-53.3146.2168.7-2330.1000111.1F45 F48 Y49 H141 V142 K143F45-P139 HydrophobicContact CB-CG 4.01Å; F45-P139 HydrophobicContact CD1-CB 4.4Å; F45-P139 HydrophobicContact CD1-CG 4Å; F45-P139 HydrophobicContact CD2-CB 4.48Å; F45-P139 HydrophobicContact CD2-CG 4.41Å; F45-P139 HydrophobicContact CG-CB 4.34Å; F45-P139 HydrophobicContact CG-CG 3.88Å; F48-P139 HydrophobicContact CD1-CG 3.93Å; F48-P139 HydrophobicContact CE1-CG 4.24Å; Y49-P139 HydrophobicContact CE2-CG 3.85Å; P139-H141 VanDerWaalsContact C-N 3.26Å; P139-H141 VanDerWaalsContact CB-CE1 3.45Å; P139-H141 WeakPolarHBondContact CB-CE1 3.28Å; P139-H141 PolarHBondContact O-N 2.92Å; P139-H141 VanDerWaalsContact O-N 3.12Å; P139-V142 HydrophobicContact CB-CB 4.36Å; P139-V142 HydrophobicContact CB-CG2 3.93Å; P139-V142 HydrophobicContact CG-CB 4.45Å; P139-V142 HydrophobicContact CG-CG2 3.86Å; P139-V142 WeakPolarHBondContact O-CB 3.35Å; P139-V142 PolarHBondContact O-N 2.98Å; P139-K143 WeakPolarHBondContact O-CB 3.45Å; P139-K143 PolarHBondContact O-N 3.46Å
140P83.9Confident77.7Confident94 Ų9461 Ų6161%0.6131%0.31SS*.Hα-helixtrans-53-39.5-174.9-28.834.8000114.4K143 A144P140-K143 PolarHBondContact O-N 3.43Å; P140-A144 WeakPolarHBondContact O-CB 2.88Å; P140-A144 PolarHBondContact O-N 2.87Å
141H82.5Confident75.4Confident81 Ų8166.9 Ų66.938%0.37535%0.348SS..Hα-helixtrans-71.6-32.8179.163.5-93.7000113.1W3 Y49 P139W3-H141 AromaticContact CD1-CD2 3.91Å; W3-H141 AromaticContact NE1-CD2 3.44Å; W3-H141 PolarHBondContact NE1-CD2 3.31Å; W3-H141 AromaticContact NE1-NE2 3.67Å; Y49-H141 PolarHBondContact OH-CE1 3.3Å; P139-H141 VanDerWaalsContact C-N 3.26Å; P139-H141 VanDerWaalsContact CB-CE1 3.45Å; P139-H141 WeakPolarHBondContact CB-CE1 3.28Å; P139-H141 PolarHBondContact O-N 2.92Å; P139-H141 VanDerWaalsContact O-N 3.12Å
142V83.5Confident73.3Confident0 Ų069 Ų690%036%0.36CS..Hα-helixtrans-70.8-48.1172178.80000109.5W3 F48 L138 P139 A144 T145 V146W3-V142 HydrophobicContact CB-CB 4.4Å; W3-V142 HydrophobicContact CB-CG1 3.92Å; W3-V142 HydrophobicContact CB-CG2 4.42Å; W3-V142 HydrophobicContact CD2-CG1 4.47Å; W3-V142 HydrophobicContact CD2-CG2 3.77Å; W3-V142 HydrophobicContact CE3-CG2 4.42Å; W3-V142 HydrophobicContact CG-CB 4.23Å; W3-V142 HydrophobicContact CG-CG1 4.14Å; W3-V142 HydrophobicContact CG-CG2 3.77Å; W3-V142 HydrophobicContact CZ2-CG2 4.35Å; F48-V142 HydrophobicContact CE1-CG1 4.45Å; F48-V142 HydrophobicContact CE1-CG2 3.89Å; F48-V142 HydrophobicContact CE2-CG1 4.01Å; F48-V142 HydrophobicContact CZ-CB 4.41Å; F48-V142 HydrophobicContact CZ-CG1 3.72Å; F48-V142 HydrophobicContact CZ-CG2 3.93Å; L138-V142 HydrophobicContact CB-CG1 4.41Å; L138-V142 HydrophobicContact CD2-CG1 4Å; P139-V142 HydrophobicContact CB-CB 4.36Å; P139-V142 HydrophobicContact CB-CG2 3.93Å; P139-V142 HydrophobicContact CG-CB 4.45Å; P139-V142 HydrophobicContact CG-CG2 3.86Å; P139-V142 WeakPolarHBondContact O-CB 3.35Å; P139-V142 PolarHBondContact O-N 2.98Å; V142-A144 VanDerWaalsContact C-N 3.25Å; V142-A144 PolarHBondContact O-N 2.91Å; V142-T145 PolarHBondContact O-N 2.91Å; V142-T145 PolarHBondContact O-OG1 2.91Å; V142-V146 HydrophobicContact CG1-CG2 3.83Å; V142-V146 WeakPolarHBondContact O-CG2 3.25Å; V142-V146 PolarHBondContact O-N 2.69Å
143K79.7Confident71.2Confident67 Ų6768.3 Ų68.329%0.29136%0.364SS..Hα-helixtrans-56.2-40.2179.5-169.6172.2179.2173.20111.8L138 P139 P140 T145 R147L138-K143 HydrophobicContact CB-CB 3.94Å; L138-K143 HydrophobicContact CB-CG 4.46Å; P139-K143 WeakPolarHBondContact O-CB 3.45Å; P139-K143 PolarHBondContact O-N 3.46Å; P140-K143 PolarHBondContact O-N 3.43Å; K143-T145 PolarHBondContact O-N 3.37Å; K143-R147 HydrophobicContact CG-CG 3.93Å; K143-R147 WeakPolarHBondContact O-CB 3.29Å; K143-R147 WeakPolarHBondContact O-CG 3.4Å; K143-R147 PolarHBondContact O-N 3.39Å
144A74.9Confident68.8Low55 Ų5574.6 Ų74.646%0.45540%0.397SS..Hα-helixtrans-63.2-25.5177.600000114.2P140 V142 R148P140-A144 WeakPolarHBondContact O-CB 2.88Å; P140-A144 PolarHBondContact O-N 2.87Å; V142-A144 VanDerWaalsContact C-N 3.25Å; V142-A144 PolarHBondContact O-N 2.91Å; A144-R148 PolarHBondContact O-NH1 3.17Å
145T78.7Confident66.5Low20 Ų2074.3 Ų74.312%0.12341%0.406CS..Hα-helixtrans-96.9-36.4178.955.30000112W3 S4 V142 K143W3-T145 WeakPolarHBondContact CB-OG1 3.32Å; S4-T145 WeakPolarHBondContact CB-O 2.95Å; S4-T145 PolarHBondContact OG-O 2.89Å; V142-T145 PolarHBondContact O-N 2.91Å; V142-T145 PolarHBondContact O-OG1 2.91Å; K143-T145 PolarHBondContact O-N 3.37Å
146V76.6Confident64Low7 Ų773.2 Ų73.24%0.04241%0.407CS..Hα-helixtrans-77.9-38.5-179.1176.80000112.5W3 L138 V142 R148 E149 I150W3-V146 HydrophobicContact CB-CG2 4.49Å; L138-V146 HydrophobicContact CD1-CB 4.22Å; L138-V146 HydrophobicContact CD1-CG1 4.05Å; V142-V146 HydrophobicContact CG1-CG2 3.83Å; V142-V146 WeakPolarHBondContact O-CG2 3.25Å; V142-V146 PolarHBondContact O-N 2.69Å; V146-R148 PolarHBondContact O-N 3.04Å; V146-E149 PolarHBondContact O-N 3.33Å; V146-I150 HydrophobicContact CG1-CB 4.5Å; V146-I150 HydrophobicContact CG1-CD1 3.47Å; V146-I150 VanDerWaalsContact CG1-CD1 3.47Å; V146-I150 HydrophobicContact CG1-CG1 4.03Å; V146-I150 PolarHBondContact O-N 2.89Å
147R59.9Low61.4Low102 Ų10277.5 Ų77.539%0.38544%0.435SS..THydrogen-bonded Turntrans-65.5-20.9-179.8-84-168167.5-179.7-6.7114.5K143 E149 A153 D154K143-R147 HydrophobicContact CG-CG 3.93Å; K143-R147 WeakPolarHBondContact O-CB 3.29Å; K143-R147 WeakPolarHBondContact O-CG 3.4Å; K143-R147 PolarHBondContact O-N 3.39Å; R147-E149 PolarHBondContact O-N 2.82Å; R147-A153 PolarHBondContact NH2-O 3.34Å; R147-D154 IonicContact CZ-OD1 2.94Å; R147-D154 IonicContact NH2-OD1 3.34Å; R147-D154 PolarHBondContact NH2-OD1 3.26Å; R147-D154 IonicContact NH2-OD2 3.43Å
148R50Low58.8Low196 Ų19679.6 Ų79.674%0.7445%0.446SS*.THydrogen-bonded Turntrans-58.2-17176.2-72.6-165.5-17199.71.5112.4A144 V146A144-R148 PolarHBondContact O-NH1 3.17Å; V146-R148 PolarHBondContact O-N 3.04Å
149E50.7Low55.9Low134 Ų13483.5 Ų83.563%0.62648%0.475SS*.THydrogen-bonded Turntrans-138.2-8.2-176-70.7174.2-11200116.2K8 V146 R147 P151K8-E149 IonicContact NZ-OE1 3.84Å; K8-E149 PolarHBondContact NZ-OE1 2.89Å; K8-E149 IonicContact NZ-OE2 2.83Å; K8-E149 PolarHBondContact NZ-OE2 3.19Å; V146-E149 PolarHBondContact O-N 3.33Å; R147-E149 PolarHBondContact O-N 2.82Å; E149-P151 WeakPolarHBondContact O-CD 3.06Å
150I46.3Very low53.2Low50 Ų5089.4 Ų89.426%0.25651%0.511SS..  trans-112.5101.7179.5-49.7-174.2000110.9K8 L11 V146 S152K8-I150 HydrophobicContact CG-CD1 4.4Å; L11-I150 HydrophobicContact CD1-CD1 4.08Å; V146-I150 HydrophobicContact CG1-CB 4.5Å; V146-I150 HydrophobicContact CG1-CD1 3.47Å; V146-I150 VanDerWaalsContact CG1-CD1 3.47Å; V146-I150 HydrophobicContact CG1-CG1 4.03Å; V146-I150 PolarHBondContact O-N 2.89Å; I150-S152 VanDerWaalsContact C-N 3.33Å; I150-S152 PolarHBondContact O-N 3.31Å
151P39.3Very low50.3Low127 Ų12792.8 Ų92.883%0.82552%0.517SS*.SBendtrans-83.373.5177.733-32.4000111E149E149-P151 WeakPolarHBondContact O-CD 3.06Å
152S42.4Very low47.7Very low90 Ų9096.1 Ų96.163%0.62953%0.532SS*.  trans176.580.1162.9450000110.2I150I150-S152 VanDerWaalsContact C-N 3.33Å; I150-S152 PolarHBondContact O-N 3.31Å
153A41.6Very low44.9Very low42 Ų42102.5 Ų102.535%0.34757%0.566SS.*  trans-137.135172.400000111.6R147R147-A153 PolarHBondContact NH2-O 3.34Å
154D35.8Very low42.5Very low135 Ų135105 Ų10572%0.72259%0.593SS**  trans-124.168.6166.4-68.4-36.4000107.5R147R147-D154 IonicContact CZ-OD1 2.94Å; R147-D154 IonicContact NH2-OD1 3.34Å; R147-D154 PolarHBondContact NH2-OD1 3.26Å; R147-D154 IonicContact NH2-OD2 3.43Å
155V38.1Very low40.2Very low117 Ų117111.2 Ų111.271%0.70961%0.612SS**  trans-121.8118.5161.4-173.50000106.4
156A32.6Very low37.6Very low79 Ų79118.7 Ų118.765%0.65364%0.643SS**  trans-49.8151.5177.400000111.3L158A156-L158 PolarHBondContact O-N 3.12Å
157P32.7Very low35.5Very low109 Ų109123.2 Ų123.271%0.70867%0.673SS**  trans-59.8115-17424.8-32.2000108.9S159P157-S159 VanDerWaalsContact C-N 3.3Å; P157-S159 PolarHBondContact O-N 3.42Å
158L30.2Very low33.9Very low139 Ų139125.2 Ų125.273%0.72869%0.692SS**  trans-58.5101.5166.6-68.7172.3000106.3A156 V160A156-L158 PolarHBondContact O-N 3.12Å; L158-V160 PolarHBondContact O-N 3.23Å
159S27.5Very low33.3Very low106 Ų106118.9 Ų118.974%0.74168%0.678SS**  trans-60.2101159.448.50000105.1P157 K161P157-S159 VanDerWaalsContact C-N 3.3Å; P157-S159 PolarHBondContact O-N 3.42Å; S159-K161 PolarHBondContact O-N 2.92Å
160V29.4Very low32.3Very low128 Ų128122.1 Ų122.178%0.77669%0.693SS**  trans-63.885.8169.8-175.90000105.7L158 E162L158-V160 PolarHBondContact O-N 3.23Å; V160-E162 PolarHBondContact O-N 3.17Å
161K25Very low31.9Very low165 Ų165125.4 Ų125.472%0.71771%0.707SS**  trans-63.8118.9152.7-94.6-179.3171.7179.30104.2S159 D163S159-K161 PolarHBondContact O-N 2.92Å; K161-D163 PolarHBondContact O-N 2.84Å
162E26.5Very low31.9Very low151 Ų151123.3 Ų123.371%0.70670%0.695SS**  trans-61.481.4167.6-66.1-175.3116.600107.1V160 S164 K277V160-E162 PolarHBondContact O-N 3.17Å; E162-S164 PolarHBondContact O-N 2.65Å; E162-K277 IonicContact OE1-NZ 3.7Å; E162-K277 PolarHBondContact OE1-NZ 2.82Å
163D24.9Very low32Very low134 Ų134123 Ų12372%0.71768%0.684SS**  trans-69.2117.9173.1-75.7-24.1000106.7K161 E165K161-D163 PolarHBondContact O-N 2.84Å; D163-E165 PolarHBondContact O-N 3.39Å
164S28.5Very low32Very low120 Ų120121.3 Ų121.384%0.83967%0.671SS**  trans-63.674.7176.8173.80000109E162 K166E162-S164 PolarHBondContact O-N 2.65Å; S164-K166 PolarHBondContact O-N 2.85Å; S164-K166 VanDerWaalsContact O-N 3.1Å
165E27.7Very low32.5Very low184 Ų184120.3 Ų120.386%0.8666%0.657SS**  trans-66.2109.9167.8-91.6-175.5151.200108.7D163 C167D163-E165 PolarHBondContact O-N 3.39Å; E165-C167 PolarHBondContact O-N 3.33Å
166K24.5Very low32.6Very low177 Ų177116.3 Ų116.377%0.7763%0.632SS**  trans-54.8118.4173.7-162.9178.9-179-168.60108.1S164 D168S164-K166 PolarHBondContact O-N 2.85Å; S164-K166 VanDerWaalsContact O-N 3.1Å; K166-D168 VanDerWaalsContact C-N 3.29Å; K166-D168 PolarHBondContact O-N 3.04Å
167C31.1Very low33.3Very low102 Ų102113.4 Ų113.469%0.68961%0.606SS**  trans-75.273.4-169.8-168.30000111.5E165 S169E165-C167 PolarHBondContact O-N 3.33Å; C167-S169 PolarHBondContact O-N 3.3Å
168D27.3Very low34.1Very low144 Ų144112.7 Ų112.777%0.7759%0.593SS**  trans-94.572.5163.9-67.4-25.2000107.5K166K166-D168 VanDerWaalsContact C-N 3.29Å; K166-D168 PolarHBondContact O-N 3.04Å
169S36.6Very low34.9Very low64 Ų64109.4 Ų109.445%0.44857%0.573SS.*  trans-130.3108.4169.165.30000109.5C167 H171C167-S169 PolarHBondContact O-N 3.3Å; S169-H171 VanDerWaalsContact C-N 3.31Å; S169-H171 PolarHBondContact O-N 3.1Å; S169-H171 PolarHBondContact O-ND1 3.49Å; S169-H171 PolarHBondContact OG-CE1 3.13Å; S169-H171 PolarHBondContact OG-ND1 2.98Å
170E30.5Very low35.7Very low202 Ų202105.6 Ų105.694%0.94455%0.545SS*.  trans-54.984.1177.7-59.4170.3149.700110.6
171H38Very low36.7Very low119 Ų119101.5 Ų101.555%0.55152%0.519SS*.  trans-101.5109.2172.6-7262.6000107.5S169 E173S169-H171 VanDerWaalsContact C-N 3.31Å; S169-H171 PolarHBondContact O-N 3.1Å; S169-H171 PolarHBondContact O-ND1 3.49Å; S169-H171 PolarHBondContact OG-CE1 3.13Å; S169-H171 PolarHBondContact OG-ND1 2.98Å; H171-E173 PolarHBondContact O-N 3.42Å; H171-E173 VanDerWaalsContact O-N 3.13Å
172S39.4Very low38Very low83 Ų8395.9 Ų95.958%0.5850%0.5SS*.  trans-33.6113.9179.5-172.60000112.4G174 Y175S172-G174 PolarHBondContact O-N 2.94Å; S172-Y175 VanDerWaalsContact O-CB 3.29Å; S172-Y175 WeakPolarHBondContact O-CB 3.46Å; S172-Y175 PolarHBondContact O-N 3.03Å
173E44.3Very low38.6Very low84 Ų8490.1 Ų90.139%0.39348%0.476SS..THydrogen-bonded Turntrans-52-30.9-164.4-76.8174.7-176.500114.3H171 Y324 A353 S356H171-E173 PolarHBondContact O-N 3.42Å; H171-E173 VanDerWaalsContact O-N 3.13Å; E173-Y324 VanDerWaalsContact C-OH 3.24Å; E173-Y324 VanDerWaalsContact CA-OH 3.25Å; E173-Y324 WeakPolarHBondContact CA-OH 3.38Å; E173-Y324 HydrophobicContact CB-CE1 4.42Å; E173-Y324 WeakPolarHBondContact CB-OH 3.36Å; E173-Y324 PolarHBondContact O-OH 3.09Å; E173-A353 CarbonylContact C-O 3.6Å; E173-A353 VanDerWaalsContact C-O 3.28Å; E173-A353 VanDerWaalsContact CB-O 3.32Å; E173-A353 WeakPolarHBondContact CB-O 3.27Å; E173-S356 WeakPolarHBondContact OE2-CB 3.29Å; E173-S356 PolarHBondContact OE2-OG 3.09Å
174G41.9Very low39.2Very low6 Ų684.7 Ų84.76%0.06245%0.446CS..THydrogen-bonded Turntrans-85.5-16.8178.400000116.3S172 L176 E178 A353S172-G174 PolarHBondContact O-N 2.94Å; G174-L176 VanDerWaalsContact C-N 3.27Å; G174-L176 PolarHBondContact O-N 2.96Å; G174-E178 PolarHBondContact O-N 3.29Å; G174-A353 WeakPolarHBondContact CA-O 3.49Å; G174-A353 PolarHBondContact N-O 3.38Å
175Y45.2Very low39.9Very low114 Ų11481.8 Ų81.845%0.44743%0.426SS..Hα-helixtrans-66.2-29.1-172.7-179.9-106.3000112.6S172 K179S172-Y175 VanDerWaalsContact O-CB 3.29Å; S172-Y175 WeakPolarHBondContact O-CB 3.46Å; S172-Y175 PolarHBondContact O-N 3.03Å; Y175-K179 HydrophobicContact CD1-CD 4.49Å; Y175-K179 HydrophobicContact CE1-CD 3.67Å; Y175-K179 WeakPolarHBondContact O-CB 3.43Å; Y175-K179 PolarHBondContact O-N 3.47Å; Y175-K179 PolarHBondContact OH-NZ 3.31Å
176L40.4Very low40.3Very low33 Ų3379 Ų7917%0.17342%0.417CS..Hα-helixtrans-67.7-49.7-177.9-61.4-175.7000112.3G174 K179 V180 Q279 I323G174-L176 VanDerWaalsContact C-N 3.27Å; G174-L176 PolarHBondContact O-N 2.96Å; L176-K179 PolarHBondContact O-N 2.88Å; L176-V180 VanDerWaalsContact O-CG2 3.32Å; L176-V180 WeakPolarHBondContact O-CG2 3.27Å; L176-V180 PolarHBondContact O-N 2.61Å; L176-Q279 HydrophobicContact CD2-CG 4.13Å; L176-I323 HydrophobicContact CD1-CD1 4.18Å
177V46.9Very low40.7Very low17 Ų1775.4 Ų75.410%0.10340%0.399CS..Hα-helixtrans-65.8-49.5179.6178.30000109.2K179 V180 I181 M320 I350V177-K179 VanDerWaalsContact C-N 3.29Å; V177-K179 PolarHBondContact O-N 2.98Å; V177-V180 PolarHBondContact O-N 2.74Å; V177-I181 HydrophobicContact CG1-CD1 3.33Å; V177-I181 HydrophobicContact CG1-CG1 4.04Å; V177-I181 VanDerWaalsContact O-CB 3.24Å; V177-I181 WeakPolarHBondContact O-CB 3.38Å; V177-I181 VanDerWaalsContact O-CG1 3.28Å; V177-I181 WeakPolarHBondContact O-CG1 3.37Å; V177-I181 PolarHBondContact O-N 3.31Å; V177-M320 HydrophobicContact CG2-CE 3.27Å; V177-M320 HydrophobicContact CG2-CG 4.16Å; V177-M320 HydrophobicContact CG2-SD 3.43Å; V177-M320 WeakPolarHBondContact CG2-SD 3.45Å; V177-I350 HydrophobicContact CG1-CD1 4.17Å; V177-I350 HydrophobicContact CG1-CG1 4.14Å; V177-I350 HydrophobicContact CG1-CG2 4.03Å
178E50.1Low40.7Very low94 Ų9475.6 Ų75.644%0.43940%0.397SS..Hα-helixtrans-62.1-37.6179.6-166179.9-176.900111.2G174 S182G174-E178 PolarHBondContact O-N 3.29Å; E178-S182 WeakPolarHBondContact O-CA 3.22Å; E178-S182 WeakPolarHBondContact O-CB 3.13Å; E178-S182 PolarHBondContact O-N 3.3Å; E178-S182 PolarHBondContact O-OG 3.23Å
179K47.4Very low40.7Very low70 Ų7072.8 Ų72.830%0.30439%0.389SS..Hα-helixtrans-68.9-42.1176.4-172.7171.7-168.3161.50112.9Y175 L176 V177 S182 S183Y175-K179 HydrophobicContact CD1-CD 4.49Å; Y175-K179 HydrophobicContact CE1-CD 3.67Å; Y175-K179 WeakPolarHBondContact O-CB 3.43Å; Y175-K179 PolarHBondContact O-N 3.47Å; Y175-K179 PolarHBondContact OH-NZ 3.31Å; L176-K179 PolarHBondContact O-N 2.88Å; V177-K179 VanDerWaalsContact C-N 3.29Å; V177-K179 PolarHBondContact O-N 2.98Å; K179-S182 PolarHBondContact O-OG 3.26Å; K179-S183 WeakPolarHBondContact O-CB 3.47Å; K179-S183 PolarHBondContact O-N 3.44Å; K179-S183 PolarHBondContact O-OG 3.25Å
180V43.5Very low40.2Very low26 Ų2678.4 Ų78.416%0.15841%0.405CS..Hα-helixtrans-68.4-48.5178.2173.70000109.9L176 V177 S183 F184 T282 A316L176-V180 VanDerWaalsContact O-CG2 3.32Å; L176-V180 WeakPolarHBondContact O-CG2 3.27Å; L176-V180 PolarHBondContact O-N 2.61Å; V177-V180 PolarHBondContact O-N 2.74Å; V180-S183 WeakPolarHBondContact O-CB 3.29Å; V180-S183 PolarHBondContact O-N 2.86Å; V180-F184 HydrophobicContact CG1-CD2 3.67Å; V180-F184 HydrophobicContact CG1-CE2 3.56Å; V180-F184 WeakPolarHBondContact O-CD2 3.38Å; V180-F184 PolarHBondContact O-N 3.36Å; V180-T282 HydrophobicContact CG2-CG2 4.09Å; V180-A316 HydrophobicContact CG1-CB 4.17Å; V180-A316 HydrophobicContact CG2-CB 4.42Å
181I50.6Low40Very low43 Ų4375.2 Ų75.222%0.22140%0.395CS..Hα-helixtrans-68.1-44.6179.6-65.2-178.4000111.2V177 S183 F184 S185 L370V177-I181 HydrophobicContact CG1-CD1 3.33Å; V177-I181 HydrophobicContact CG1-CG1 4.04Å; V177-I181 VanDerWaalsContact O-CB 3.24Å; V177-I181 WeakPolarHBondContact O-CB 3.38Å; V177-I181 VanDerWaalsContact O-CG1 3.28Å; V177-I181 WeakPolarHBondContact O-CG1 3.37Å; V177-I181 PolarHBondContact O-N 3.31Å; I181-S183 VanDerWaalsContact C-N 3.3Å; I181-S183 PolarHBondContact O-N 2.89Å; I181-F184 CarbonylContact O-C 3.59Å; I181-F184 PolarHBondContact O-N 3.42Å; I181-F184 VanDerWaalsContact O-N 3.08Å; I181-S185 VanDerWaalsContact O-CB 3.31Å; I181-S185 WeakPolarHBondContact O-CB 3.25Å; I181-S185 PolarHBondContact O-N 3.26Å; I181-L370 HydrophobicContact CD1-CD1 3.44Å; I181-L370 VanDerWaalsContact CD1-CD1 3.44Å; I181-L370 HydrophobicContact CD1-CD2 3.7Å; I181-L370 HydrophobicContact CD1-CG 4.19Å; I181-L370 HydrophobicContact CG1-CD2 4.47Å; I181-L370 HydrophobicContact CG2-CD2 3.84Å
182S51.9Low39.4Very low46 Ų4676.3 Ų76.332%0.32241%0.409SS..Hα-helixtrans-67.8-33.3177.166.50000111.7E178 K179 F184 S185 N186E178-S182 WeakPolarHBondContact O-CA 3.22Å; E178-S182 WeakPolarHBondContact O-CB 3.13Å; E178-S182 PolarHBondContact O-N 3.3Å; E178-S182 PolarHBondContact O-OG 3.23Å; K179-S182 PolarHBondContact O-OG 3.26Å; S182-F184 VanDerWaalsContact C-N 3.35Å; S182-S185 WeakPolarHBondContact CA-OG 2.98Å; S182-S185 PolarHBondContact O-OG 3.35Å; S182-N186 PolarHBondContact O-N 2.88Å; S182-N186 PolarHBondContact O-ND2 2.85Å
183S40.6Very low38.8Very low30 Ų3077.6 Ų77.621%0.2141%0.414CS..Hα-helixtrans-59.5-49.1168.1-64.50000109.3K179 V180 I181 Y187K179-S183 WeakPolarHBondContact O-CB 3.47Å; K179-S183 PolarHBondContact O-N 3.44Å; K179-S183 PolarHBondContact O-OG 3.25Å; V180-S183 WeakPolarHBondContact O-CB 3.29Å; V180-S183 PolarHBondContact O-N 2.86Å; I181-S183 VanDerWaalsContact C-N 3.3Å; I181-S183 PolarHBondContact O-N 2.89Å; S183-Y187 WeakPolarHBondContact O-CD2 3.4Å; S183-Y187 WeakPolarHBondContact O-CE2 3.07Å
184F36.6Very low38.3Very low20 Ų2079.1 Ų79.19%0.08843%0.431CS..Hα-helixtrans-73.1-33.5179.9-74.6-61.4000115.1V180 I181 S182 N186 Y187 V188 L289 T309 C312 L313V180-F184 HydrophobicContact CG1-CD2 3.67Å; V180-F184 HydrophobicContact CG1-CE2 3.56Å; V180-F184 WeakPolarHBondContact O-CD2 3.38Å; V180-F184 PolarHBondContact O-N 3.36Å; I181-F184 CarbonylContact O-C 3.59Å; I181-F184 PolarHBondContact O-N 3.42Å; I181-F184 VanDerWaalsContact O-N 3.08Å; S182-F184 VanDerWaalsContact C-N 3.35Å; F184-N186 VanDerWaalsContact C-N 3.27Å; F184-N186 PolarHBondContact O-N 3.37Å; F184-Y187 CarbonylContact O-C 3.52Å; F184-Y187 WeakPolarHBondContact O-CA 3.26Å; F184-Y187 WeakPolarHBondContact O-CB 3.48Å; F184-Y187 PolarHBondContact O-N 3.43Å; F184-V188 WeakPolarHBondContact O-CG2 3.36Å; F184-V188 PolarHBondContact O-N 2.87Å; F184-L289 HydrophobicContact CE1-CD1 3.94Å; F184-T309 HydrophobicContact CD1-CG2 4.3Å; F184-T309 HydrophobicContact CE1-CG2 3.74Å; F184-T309 HydrophobicContact CZ-CG2 4.31Å; F184-C312 HydrophobicContact CE2-CB 4.45Å; F184-C312 HydrophobicContact CZ-CB 3.91Å; F184-L313 HydrophobicContact CD2-CD2 3.82Å; F184-L313 HydrophobicContact CE2-CD2 3.69Å; F184-L313 HydrophobicContact CE2-CG 4.17Å; F184-L313 HydrophobicContact CZ-CD2 4.44Å; F184-L313 HydrophobicContact CZ-CG 4.47Å
185S42.7Very low37.8Very low59 Ų5982.4 Ų82.441%0.41345%0.453SS..Hα-helixtrans-67.3-33.1-176.674.20000110.8I181 S182 Y187I181-S185 VanDerWaalsContact O-CB 3.31Å; I181-S185 WeakPolarHBondContact O-CB 3.25Å; I181-S185 PolarHBondContact O-N 3.26Å; S182-S185 WeakPolarHBondContact CA-OG 2.98Å; S182-S185 PolarHBondContact O-OG 3.35Å; S185-Y187 PolarHBondContact O-N 2.87Å
186N36.7Very low37.1Very low126 Ų12688.2 Ų88.267%0.67447%0.474SS*.Hα-helixtrans-63.8-17.3169.6-71.5-32.2000113S182 F184S182-N186 PolarHBondContact O-N 2.88Å; S182-N186 PolarHBondContact O-ND2 2.85Å; F184-N186 VanDerWaalsContact C-N 3.27Å; F184-N186 PolarHBondContact O-N 3.37Å
187Y33.4Very low36.8Very low101 Ų10195.1 Ų95.140%0.39650%0.503SS..Hα-helixtrans-107.5-21.8-179.1-59.6-62.4000114.4S183 F184 S185 G290S183-Y187 WeakPolarHBondContact O-CD2 3.4Å; S183-Y187 WeakPolarHBondContact O-CE2 3.07Å; F184-Y187 CarbonylContact O-C 3.52Å; F184-Y187 WeakPolarHBondContact O-CA 3.26Å; F184-Y187 WeakPolarHBondContact O-CB 3.48Å; F184-Y187 PolarHBondContact O-N 3.43Å; S185-Y187 PolarHBondContact O-N 2.87Å; Y187-G290 WeakPolarHBondContact OH-CA 3.26Å
188V30.3Very low36.2Very low106 Ų10698.7 Ų98.764%0.64253%0.534SS*.Hα-helixtrans-81.7-23179.3-179.40000112.2F184 F190F184-V188 WeakPolarHBondContact O-CG2 3.36Å; F184-V188 PolarHBondContact O-N 2.87Å; V188-F190 VanDerWaalsContact C-N 3.29Å; V188-F190 PolarHBondContact O-N 3.29Å
189S27.6Very low35.3Very low85 Ų85102.7 Ų102.759%0.59455%0.55SS**  trans-72.285.6167.2-71.30000110.2D191S189-D191 PolarHBondContact O-N 3.03Å
190F26Very low34.5Very low182 Ų182107 Ų10780%0.79858%0.576SS**  trans-68.129.6167.8-84.2-83.7000113.3V188 V192V188-F190 VanDerWaalsContact C-N 3.29Å; V188-F190 PolarHBondContact O-N 3.29Å; F190-V192 PolarHBondContact O-N 2.63Å; F190-V192 VanDerWaalsContact O-N 3.09Å
191D25.7Very low34Very low135 Ų135109.7 Ų109.772%0.72260%0.596SS**  trans-77.799.4163.1-76.5-30.4000106.7S189 V193S189-D191 PolarHBondContact O-N 3.03Å; D191-V193 HydrophobicContact CB-CG2 4.43Å; D191-V193 PolarHBondContact O-N 2.75Å
192V27.2Very low33.2Very low142 Ų142112.1 Ų112.186%0.86162%0.623SS**  trans-60.178.5169.1-179.70000108F190F190-V192 PolarHBondContact O-N 2.63Å; F190-V192 VanDerWaalsContact O-N 3.09Å
193V26Very low32.4Very low110 Ų110118.9 Ų118.967%0.66765%0.65SS**  trans-111.8117.9164.5-178.10000105.1D191 S195D191-V193 HydrophobicContact CB-CG2 4.43Å; D191-V193 PolarHBondContact O-N 2.75Å; V193-S195 PolarHBondContact O-N 2.79Å
194P33.2Very low32Very low116 Ų116121.3 Ų121.375%0.75368%0.68SS**  trans-54.3133.6-174.619.9-29.9000109.6
195S31.4Very low32.2Very low75 Ų75123.8 Ų123.852%0.52469%0.694SS.*  trans-34.2133.8-165.365.60000114.5V193 F197V193-S195 PolarHBondContact O-N 2.79Å; S195-F197 VanDerWaalsContact CB-CD2 3.43Å; S195-F197 PolarHBondContact O-N 2.99Å; S195-F197 WeakPolarHBondContact OG-CD2 3.49Å
196R31.2Very low32.2Very low237 Ų237124.3 Ų124.389%0.89470%0.697SS**G310 helixtrans-62.518.3170-65.5-175.4-179.5-178.61.7114.6A198R196-A198 PolarHBondContact O-N 3.27Å; R196-A198 VanDerWaalsContact O-N 3.13Å
197F34.9Very low32.9Very low177 Ų177124.9 Ų124.978%0.77671%0.705SS**G310 helixtrans-66-4.7169-72.7-62.8000113.6S195S195-F197 VanDerWaalsContact CB-CD2 3.43Å; S195-F197 PolarHBondContact O-N 2.99Å; S195-F197 WeakPolarHBondContact OG-CD2 3.49Å
198A33.7Very low33.5Very low92 Ų92127.3 Ų127.376%0.7672%0.72SS**G310 helixtrans-87.93.9176.700000115.6R196R196-A198 PolarHBondContact O-N 3.27Å; R196-A198 VanDerWaalsContact O-N 3.13Å
199K31.7Very low34.5Very low179 Ų179123.2 Ų123.278%0.77870%0.695SS**SBendtrans-115.80.2-173.3-98.8-177177.5-179.50119.3
200N29.6Very low36.2Very low159 Ų159122.3 Ų122.385%0.8569%0.686SS**SBendtrans-117.830176-717.1000114.5
201S33.1Very low38.9Very low83 Ų83118.7 Ų118.758%0.5868%0.675SS**  trans-138.355.3164.7-58.60000109.7E203S201-E203 VanDerWaalsContact C-N 3.31Å; S201-E203 PolarHBondContact O-N 3.35Å
202A33.8Very low41.9Very low95 Ų95112.3 Ų112.379%0.78564%0.641SS**  trans-94.765.9166.800000108.7
203E34.3Very low44.9Very low187 Ų187107.8 Ų107.887%0.87461%0.608SS**SBendtrans-15587.6162.6-114.6167.1-166.600108.4S201 D205S201-E203 VanDerWaalsContact C-N 3.31Å; S201-E203 PolarHBondContact O-N 3.35Å; E203-D205 PolarHBondContact O-N 2.7Å
204G34Very low47.9Very low82 Ų82106.3 Ų106.385%0.84560%0.596SS**  trans7415.3154.700000119.6S206G204-S206 PolarHBondContact O-N 3.44Å
205D40.8Very low50.7Low72 Ų72105.3 Ų105.339%0.38558%0.577SS.*  trans-72.5100.1174.9-104.1-23.4000110.3E203 T209 R213E203-D205 PolarHBondContact O-N 2.7Å; D205-T209 PolarHBondContact OD1-OG1 2.89Å; D205-T209 VanDerWaalsContact OD1-OG1 3.08Å; D205-R213 IonicContact OD2-NH2 2.69Å
206S41Very low53.6Low69 Ų69101.7 Ų101.748%0.48355%0.552SS.*  trans-45.6139.3173.650.30000111.5G204 E208 T209G204-S206 PolarHBondContact O-N 3.44Å; S206-E208 PolarHBondContact O-N 2.62Å; S206-T209 PolarHBondContact O-N 3.35Å; S206-T209 PolarHBondContact O-OG1 2.97Å; S206-T209 WeakPolarHBondContact OG-CG2 3.43Å
207V51.5Low56.6Low138 Ų13892.5 Ų92.584%0.83652%0.52SS*.THydrogen-bonded Turntrans-45.9-29.8-177.31770000114
208E47.2Very low59.3Low153 Ų15389.4 Ų89.472%0.71551%0.508SS*.THydrogen-bonded Turntrans-72.1-29.7176.6-68.3179.7171.700114.2N68 S206 V210 D211N68-E208 PolarHBondContact OD1-O 2.93Å; S206-E208 PolarHBondContact O-N 2.62Å; E208-V210 PolarHBondContact O-N 3.31Å; E208-D211 PolarHBondContact O-N 3.36Å
209T51.8Low62.1Low20 Ų2087.3 Ų87.312%0.12348%0.482CS..Hα-helixtrans-68.2-26-175.656.10000113.6N68 D205 S206 D211N68-T209 WeakPolarHBondContact ND2-CA 3.32Å; N68-T209 PolarHBondContact ND2-O 3.04Å; N68-T209 VanDerWaalsContact ND2-O 3.09Å; D205-T209 PolarHBondContact OD1-OG1 2.89Å; D205-T209 VanDerWaalsContact OD1-OG1 3.08Å; S206-T209 PolarHBondContact O-N 3.35Å; S206-T209 PolarHBondContact O-OG1 2.97Å; S206-T209 WeakPolarHBondContact OG-CG2 3.43Å; T209-D211 VanDerWaalsContact C-N 3.34Å
210V62.1Low65.1Low65 Ų6579 Ų7939%0.39445%0.447SS..Hα-helixtrans-73.9-26.6-179-178.10000111.4E208 L214E208-V210 PolarHBondContact O-N 3.31Å; V210-L214 WeakPolarHBondContact O-CB 3.26Å; V210-L214 PolarHBondContact O-N 3.23Å
211D83.4Confident68.1Low106 Ų10673.8 Ų73.857%0.56742%0.417SS*.Hα-helixtrans-69.5-54.2-168.3-167.219.1000112.4E208 T209 L214 R215E208-D211 PolarHBondContact O-N 3.36Å; T209-D211 VanDerWaalsContact C-N 3.34Å; D211-L214 PolarHBondContact O-N 2.89Å; D211-R215 WeakPolarHBondContact O-CB 3.39Å; D211-R215 PolarHBondContact O-N 3.44Å
212F87.9Confident71Confident1 Ų174.7 Ų74.70%0.00441%0.408CS..Hα-helixtrans-70.4-38.1179.8-175.3-103000112.9L64 S67 N68 R75 I78 L79 L214 R215 F216L64-F212 HydrophobicContact CD1-CD1 3.82Å; L64-F212 HydrophobicContact CD1-CE1 3.53Å; L64-F212 HydrophobicContact CG-CD1 4.49Å; S67-F212 WeakPolarHBondContact OG-CD1 3.31Å; S67-F212 WeakPolarHBondContact OG-CE1 3.5Å; N68-F212 VanDerWaalsContact OD1-CB 3.3Å; N68-F212 WeakPolarHBondContact OD1-CB 3.37Å; R75-F212 HydrophobicContact CB-CD2 3.92Å; R75-F212 HydrophobicContact CB-CE1 4.48Å; R75-F212 HydrophobicContact CB-CE2 3.41Å; R75-F212 VanDerWaalsContact CB-CE2 3.41Å; R75-F212 HydrophobicContact CB-CZ 3.69Å; R75-F212 HydrophobicContact CG-CD1 4.31Å; R75-F212 HydrophobicContact CG-CD2 3.81Å; R75-F212 HydrophobicContact CG-CE1 4.15Å; R75-F212 HydrophobicContact CG-CE2 3.72Å; R75-F212 HydrophobicContact CG-CG 4.07Å; R75-F212 HydrophobicContact CG-CZ 3.84Å; R75-F212 WeakPolarHBondContact O-CZ 3.37Å; I78-F212 HydrophobicContact CG2-CE1 4.5Å; I78-F212 HydrophobicContact CG2-CZ 4.49Å; L79-F212 HydrophobicContact CD1-CE2 4.15Å; L79-F212 HydrophobicContact CD2-CZ 4.29Å; L79-F212 HydrophobicContact CG-CE2 4.2Å; L79-F212 HydrophobicContact CG-CZ 4.11Å; F212-L214 VanDerWaalsContact C-N 3.29Å; F212-L214 PolarHBondContact O-N 3.39Å; F212-R215 PolarHBondContact O-N 3.01Å; F212-F216 HydrophobicContact CE1-CB 4.33Å; F212-F216 HydrophobicContact CE1-CD2 4.38Å; F212-F216 VanDerWaalsContact O-CB 3.27Å; F212-F216 WeakPolarHBondContact O-CB 3.39Å; F212-F216 PolarHBondContact O-N 3.47Å
213R89.7Confident73.8Confident48 Ų4870.6 Ų70.618%0.18137%0.373CS..Hα-helixtrans-59.5-44.5176.9176.7170.766.5179.7-6.9110.6L64 D205 F216 M217L64-R213 HydrophobicContact CD2-CB 4.15Å; L64-R213 HydrophobicContact CD2-CG 3.83Å; L64-R213 HydrophobicContact CG-CB 4.36Å; L64-R213 HydrophobicContact CG-CG 4.47Å; D205-R213 IonicContact OD2-NH2 2.69Å; R213-F216 WeakPolarHBondContact O-CB 3.35Å; R213-F216 PolarHBondContact O-N 2.87Å; R213-M217 HydrophobicContact CG-SD 3.92Å; R213-M217 VanDerWaalsContact O-CG 3.25Å; R213-M217 WeakPolarHBondContact O-CG 3.24Å; R213-M217 PolarHBondContact O-N 3.38Å
214L90.6Very high76.7Confident78 Ų7861.7 Ų61.741%0.40833%0.331SS..Hα-helixtrans-62.3-47.5176.8-179.961.6000111.3V210 D211 F212 F216 M217 Q218V210-L214 WeakPolarHBondContact O-CB 3.26Å; V210-L214 PolarHBondContact O-N 3.23Å; D211-L214 PolarHBondContact O-N 2.89Å; F212-L214 VanDerWaalsContact C-N 3.29Å; F212-L214 PolarHBondContact O-N 3.39Å; L214-F216 VanDerWaalsContact C-N 3.31Å; L214-F216 PolarHBondContact O-N 3.25Å; L214-M217 PolarHBondContact O-N 2.94Å; L214-Q218 HydrophobicContact CD1-CG 4.27Å; L214-Q218 HydrophobicContact CG-CG 4.5Å; L214-Q218 WeakPolarHBondContact O-CB 3.32Å; L214-Q218 VanDerWaalsContact O-CG 3.32Å; L214-Q218 WeakPolarHBondContact O-CG 3.09Å; L214-Q218 PolarHBondContact O-N 2.64Å
215R91.2Very high79.4Confident95 Ų9561.1 Ų61.136%0.35831%0.306SS..Hα-helixtrans-57.8-44.1176.3-175.8175.7177-155.7-8.1111.9E72 E76 D211 F212 Q218 E219E72-R215 IonicContact OE1-CZ 3.73Å; E72-R215 IonicContact OE1-NH1 3.87Å; E72-R215 PolarHBondContact OE1-NH1 3.27Å; E72-R215 IonicContact OE1-NH2 2.91Å; E76-R215 IonicContact OE1-CZ 3.26Å; E76-R215 IonicContact OE1-NH1 2.83Å; E76-R215 IonicContact OE1-NH2 2.86Å; E76-R215 PolarHBondContact OE1-NH2 2.89Å; D211-R215 WeakPolarHBondContact O-CB 3.39Å; D211-R215 PolarHBondContact O-N 3.44Å; F212-R215 PolarHBondContact O-N 3.01Å; R215-Q218 PolarHBondContact O-N 3.08Å; R215-E219 VanDerWaalsContact O-CB 3.32Å; R215-E219 WeakPolarHBondContact O-CB 3.35Å; R215-E219 PolarHBondContact O-N 2.91Å
216F93.2Very high81.9Confident0 Ų062.8 Ų62.80%031%0.311CS..Hα-helixtrans-60.3-45.8176.7174.7-81.7000112.2I60 T61 L64 I78 L79 M82 F212 R213 L214 S220I60-F216 HydrophobicContact CG2-CE2 4.48Å; T61-F216 HydrophobicContact CG2-CE1 4.25Å; T61-F216 HydrophobicContact CG2-CZ 4.03Å; L64-F216 HydrophobicContact CD1-CB 4.24Å; L64-F216 HydrophobicContact CD1-CD1 4.4Å; L64-F216 HydrophobicContact CD1-CD2 3.73Å; L64-F216 HydrophobicContact CD1-CE2 4.12Å; L64-F216 HydrophobicContact CD1-CG 3.88Å; L64-F216 HydrophobicContact CD2-CB 3.94Å; L64-F216 HydrophobicContact CD2-CD1 3.39Å; L64-F216 HydrophobicContact CD2-CD2 4.23Å; L64-F216 HydrophobicContact CD2-CE1 3.89Å; L64-F216 HydrophobicContact CD2-CG 3.6Å; L64-F216 HydrophobicContact CD2-CZ 4.48Å; L64-F216 HydrophobicContact CG-CG 4.39Å; I78-F216 HydrophobicContact CG2-CD2 4.12Å; I78-F216 HydrophobicContact CG2-CE2 3.87Å; L79-F216 HydrophobicContact CD2-CB 4.21Å; L79-F216 HydrophobicContact CD2-CD2 3.75Å; L79-F216 HydrophobicContact CD2-CG 4.31Å; M82-F216 HydrophobicContact CB-CE2 4.41Å; M82-F216 HydrophobicContact CG-CE2 3.42Å; M82-F216 VanDerWaalsContact CG-CE2 3.42Å; M82-F216 HydrophobicContact CG-CZ 3.64Å; M82-F216 HydrophobicContact SD-CE2 4.4Å; M82-F216 HydrophobicContact SD-CZ 4.14Å; F212-F216 HydrophobicContact CE1-CB 4.33Å; F212-F216 HydrophobicContact CE1-CD2 4.38Å; F212-F216 VanDerWaalsContact O-CB 3.27Å; F212-F216 WeakPolarHBondContact O-CB 3.39Å; F212-F216 PolarHBondContact O-N 3.47Å; R213-F216 WeakPolarHBondContact O-CB 3.35Å; R213-F216 PolarHBondContact O-N 2.87Å; L214-F216 VanDerWaalsContact C-N 3.31Å; L214-F216 PolarHBondContact O-N 3.25Å; F216-S220 VanDerWaalsContact O-CB 3.23Å; F216-S220 WeakPolarHBondContact O-CB 3.28Å; F216-S220 PolarHBondContact O-N 2.98Å; F216-S220 PolarHBondContact O-OG 3.28Å
217M92.7Very high84.3Confident44 Ų4463.2 Ų63.222%0.21731%0.305CS..Hα-helixtrans-64.8-46.1178.6-70.5166.364.300111.1S116 R213 L214 S220 Q221S116-M217 VanDerWaalsContact O-SD 3.39Å; R213-M217 HydrophobicContact CG-SD 3.92Å; R213-M217 VanDerWaalsContact O-CG 3.25Å; R213-M217 WeakPolarHBondContact O-CG 3.24Å; R213-M217 PolarHBondContact O-N 3.38Å; L214-M217 PolarHBondContact O-N 2.94Å; M217-S220 PolarHBondContact O-N 3.34Å; M217-Q221 WeakPolarHBondContact O-CB 3.46Å; M217-Q221 VanDerWaalsContact O-CG 3.24Å; M217-Q221 WeakPolarHBondContact O-CG 3.32Å; M217-Q221 PolarHBondContact O-N 3.13Å
218Q92.7Very high86.2Confident112 Ų11262.3 Ų62.352%0.52329%0.287SS..Hα-helixtrans-60.5-47.4178.9-73.6175.5-14.100111.5L214 R215 Q221 R222L214-Q218 HydrophobicContact CD1-CG 4.27Å; L214-Q218 HydrophobicContact CG-CG 4.5Å; L214-Q218 WeakPolarHBondContact O-CB 3.32Å; L214-Q218 VanDerWaalsContact O-CG 3.32Å; L214-Q218 WeakPolarHBondContact O-CG 3.09Å; L214-Q218 PolarHBondContact O-N 2.64Å; R215-Q218 PolarHBondContact O-N 3.08Å; Q218-Q221 PolarHBondContact O-N 3.16Å; Q218-R222 VanDerWaalsContact O-CB 3.3Å; Q218-R222 WeakPolarHBondContact O-CB 3.43Å; Q218-R222 PolarHBondContact O-N 3.3Å
219E93Very high88.3Confident47 Ų4755 Ų5522%0.2225%0.253CS..Hα-helixtrans-65.3-41.5178.8179.660.1-171.700111.7L79 R215 R222 L223L79-E219 HydrophobicContact CD2-CB 4.41Å; L79-E219 HydrophobicContact CD2-CG 4.34Å; R215-E219 VanDerWaalsContact O-CB 3.32Å; R215-E219 WeakPolarHBondContact O-CB 3.35Å; R215-E219 PolarHBondContact O-N 2.91Å; E219-R222 PolarHBondContact O-N 2.95Å; E219-R222 IonicContact OE1-CZ 3.82Å; E219-R222 IonicContact OE1-NE 2.71Å; E219-R222 IonicContact OE1-NH2 3.94Å; E219-R222 PolarHBondContact OE1-NH2 3.19Å; E219-R222 IonicContact OE2-CZ 3.25Å; E219-R222 IonicContact OE2-NE 3.75Å; E219-R222 PolarHBondContact OE2-NE 3.06Å; E219-R222 IonicContact OE2-NH2 3.66Å; E219-R222 PolarHBondContact OE2-NH2 2.98Å; E219-L223 WeakPolarHBondContact O-CB 3.48Å; E219-L223 PolarHBondContact O-N 2.97Å
220S93.4Very high90.1Very high4 Ų454.2 Ų54.23%0.02825%0.249CC..Hα-helixtrans-61.7-49.2175.7-65.50000111.3M114 F216 M217 R222 L223 L224M114-S220 WeakPolarHBondContact O-CB 3.27Å; F216-S220 VanDerWaalsContact O-CB 3.23Å; F216-S220 WeakPolarHBondContact O-CB 3.28Å; F216-S220 PolarHBondContact O-N 2.98Å; F216-S220 PolarHBondContact O-OG 3.28Å; M217-S220 PolarHBondContact O-N 3.34Å; S220-R222 PolarHBondContact O-N 3.43Å; S220-L223 PolarHBondContact O-N 3.42Å; S220-L224 WeakPolarHBondContact O-CB 3.36Å; S220-L224 WeakPolarHBondContact O-CG 3.31Å; S220-L224 PolarHBondContact O-N 2.87Å
221Q93.6Very high91.5Very high50 Ų5053.6 Ų53.623%0.23424%0.241CC..Hα-helixtrans-62.6-42.8178.7-70.6176.51800111.8C115 M217 Q218 L224 K225 P292C115-Q221 HydrophobicContact CB-CG 4.39Å; C115-Q221 PolarHBondContact O-NE2 3.42Å; M217-Q221 WeakPolarHBondContact O-CB 3.46Å; M217-Q221 VanDerWaalsContact O-CG 3.24Å; M217-Q221 WeakPolarHBondContact O-CG 3.32Å; M217-Q221 PolarHBondContact O-N 3.13Å; Q218-Q221 PolarHBondContact O-N 3.16Å; Q221-L224 PolarHBondContact O-N 3.42Å; Q221-K225 WeakPolarHBondContact O-CB 3.32Å; Q221-K225 WeakPolarHBondContact O-CG 3.45Å; Q221-K225 PolarHBondContact O-N 3.09Å; Q221-P292 HydrophobicContact CG-CG 4.02Å
222R93.3Very high91.8Very high102 Ų10249.8 Ų49.839%0.38522%0.221SC..Hα-helixtrans-56.8-52.2175.3-174.7-172.670.978.62.3110.9Q218 E219 S220 L224 K225 E226Q218-R222 VanDerWaalsContact O-CB 3.3Å; Q218-R222 WeakPolarHBondContact O-CB 3.43Å; Q218-R222 PolarHBondContact O-N 3.3Å; E219-R222 PolarHBondContact O-N 2.95Å; E219-R222 IonicContact OE1-CZ 3.82Å; E219-R222 IonicContact OE1-NE 2.71Å; E219-R222 IonicContact OE1-NH2 3.94Å; E219-R222 PolarHBondContact OE1-NH2 3.19Å; E219-R222 IonicContact OE2-CZ 3.25Å; E219-R222 IonicContact OE2-NE 3.75Å; E219-R222 PolarHBondContact OE2-NE 3.06Å; E219-R222 IonicContact OE2-NH2 3.66Å; E219-R222 PolarHBondContact OE2-NH2 2.98Å; S220-R222 PolarHBondContact O-N 3.43Å; R222-L224 PolarHBondContact O-N 3.36Å; R222-K225 PolarHBondContact O-N 3.02Å; R222-E226 IonicContact CZ-OE1 3.47Å; R222-E226 IonicContact CZ-OE2 2.65Å; R222-E226 IonicContact NH1-OE1 2.58Å; R222-E226 PolarHBondContact NH1-OE1 3.05Å; R222-E226 IonicContact NH1-OE2 3.97Å; R222-E226 PolarHBondContact NH1-OE2 3.27Å; R222-E226 WeakPolarHBondContact O-CG 3.24Å; R222-E226 PolarHBondContact O-N 3.43Å
223L93.8Very high91.9Very high10 Ų1049.8 Ų49.85%0.05222%0.221CC..Hα-helixtrans-61.1-43.8179.8-17873.2000112.2R83 V86 E219 S220 K225 E226 Q227R83-L223 HydrophobicContact CB-CD2 4.12Å; R83-L223 HydrophobicContact CG-CD1 4.35Å; R83-L223 HydrophobicContact CG-CD2 3.62Å; V86-L223 HydrophobicContact CB-CD2 3.66Å; V86-L223 HydrophobicContact CB-CG 4.46Å; V86-L223 HydrophobicContact CG1-CD2 3.77Å; V86-L223 HydrophobicContact CG1-CG 4.02Å; V86-L223 HydrophobicContact CG2-CD2 3.88Å; E219-L223 WeakPolarHBondContact O-CB 3.48Å; E219-L223 PolarHBondContact O-N 2.97Å; S220-L223 PolarHBondContact O-N 3.42Å; L223-K225 VanDerWaalsContact C-N 3.32Å; L223-K225 PolarHBondContact O-N 3.32Å; L223-E226 PolarHBondContact O-N 3.05Å; L223-Q227 HydrophobicContact CD1-CG 4.24Å; L223-Q227 HydrophobicContact CG-CG 4.4Å; L223-Q227 WeakPolarHBondContact O-CB 3.48Å; L223-Q227 VanDerWaalsContact O-CG 3.32Å; L223-Q227 WeakPolarHBondContact O-CG 3.04Å; L223-Q227 PolarHBondContact O-N 3.18Å
224L93.9Very high91.9Very high0 Ų047.6 Ų47.60%021%0.213CC..Hα-helixtrans-64.5-37.6-179.8-70.3175.2000112.4V86 L111 C115 S220 Q221 R222 R228 V229 L293V86-L224 HydrophobicContact CB-CD2 4.28Å; V86-L224 HydrophobicContact CG1-CD2 3.69Å; V86-L224 HydrophobicContact CG2-CD2 3.58Å; V86-L224 HydrophobicContact CG2-CG 4.36Å; L111-L224 HydrophobicContact CD2-CD1 4.33Å; L111-L224 HydrophobicContact CD2-CD2 3.38Å; L111-L224 HydrophobicContact CD2-CG 4.49Å; C115-L224 WeakPolarHBondContact SG-CD1 3.27Å; S220-L224 WeakPolarHBondContact O-CB 3.36Å; S220-L224 WeakPolarHBondContact O-CG 3.31Å; S220-L224 PolarHBondContact O-N 2.87Å; Q221-L224 PolarHBondContact O-N 3.42Å; R222-L224 PolarHBondContact O-N 3.36Å; L224-R228 PolarHBondContact O-N 3.28Å; L224-V229 HydrophobicContact CB-CG2 4.42Å; L224-V229 HydrophobicContact CD2-CB 4.02Å; L224-V229 HydrophobicContact CD2-CG1 4.24Å; L224-V229 HydrophobicContact CD2-CG2 3.6Å; L224-V229 PolarHBondContact O-N 3.32Å; L224-L293 HydrophobicContact CB-CD1 4.34Å; L224-L293 HydrophobicContact CB-CD2 3.54Å; L224-L293 HydrophobicContact CD1-CD2 4.3Å
225K91.9Very high91.9Very high70 Ų7049.3 Ų49.330%0.30422%0.217SC..Hα-helixtrans-66.2-47.9172.3-74-179.2173.3-1640111.4Q221 R222 L223 Q227 R228 L293 D296Q221-K225 WeakPolarHBondContact O-CB 3.32Å; Q221-K225 WeakPolarHBondContact O-CG 3.45Å; Q221-K225 PolarHBondContact O-N 3.09Å; R222-K225 PolarHBondContact O-N 3.02Å; L223-K225 VanDerWaalsContact C-N 3.32Å; L223-K225 PolarHBondContact O-N 3.32Å; K225-Q227 VanDerWaalsContact C-N 3.3Å; K225-Q227 PolarHBondContact O-N 2.98Å; K225-R228 PolarHBondContact O-N 3.31Å; K225-L293 HydrophobicContact CG-CD2 4.05Å; K225-D296 IonicContact NZ-OD2 2.88Å; K225-D296 PolarHBondContact NZ-OD2 3.47Å
226E92.1Very high91.8Very high107 Ų10746.1 Ų46.150%0.521%0.208SC..Hα-helixtrans-58.9-41178.5-77.5175-176.800112.6R222 L223 R228R222-E226 IonicContact CZ-OE1 3.47Å; R222-E226 IonicContact CZ-OE2 2.65Å; R222-E226 IonicContact NH1-OE1 2.58Å; R222-E226 PolarHBondContact NH1-OE1 3.05Å; R222-E226 IonicContact NH1-OE2 3.97Å; R222-E226 PolarHBondContact NH1-OE2 3.27Å; R222-E226 WeakPolarHBondContact O-CG 3.24Å; R222-E226 PolarHBondContact O-N 3.43Å; L223-E226 PolarHBondContact O-N 3.05Å; E226-R228 PolarHBondContact O-N 2.9Å
227Q91.6Very high91.6Very high77 Ų7746.1 Ų46.136%0.3621%0.208SC..THydrogen-bonded Turntrans-82.10.7177.3-61.8-60.4-6100113.5V86 V90 L223 K225 V229V86-Q227 HydrophobicContact CG1-CG 4.31Å; V90-Q227 HydrophobicContact CG2-CB 3.91Å; L223-Q227 HydrophobicContact CD1-CG 4.24Å; L223-Q227 HydrophobicContact CG-CG 4.4Å; L223-Q227 WeakPolarHBondContact O-CB 3.48Å; L223-Q227 VanDerWaalsContact O-CG 3.32Å; L223-Q227 WeakPolarHBondContact O-CG 3.04Å; L223-Q227 PolarHBondContact O-N 3.18Å; K225-Q227 VanDerWaalsContact C-N 3.3Å; K225-Q227 PolarHBondContact O-N 2.98Å; Q227-V229 HydrophobicContact CB-CG2 3.87Å; Q227-V229 PolarHBondContact O-N 3.04Å
228R91Very high91.5Very high119 Ų11944.9 Ų44.945%0.44920%0.202SC..THydrogen-bonded Turntrans52.238.5179.2-57.4173.467.5-164.61.9112.9L224 K225 E226 G230 E231 L232L224-R228 PolarHBondContact O-N 3.28Å; K225-R228 PolarHBondContact O-N 3.31Å; E226-R228 PolarHBondContact O-N 2.9Å; R228-G230 VanDerWaalsContact C-N 3.27Å; R228-G230 PolarHBondContact O-N 2.75Å; R228-E231 HydrophobicContact CB-CB 4.5Å; R228-E231 IonicContact CZ-OE1 2.67Å; R228-E231 VanDerWaalsContact CZ-OE1 3.28Å; R228-E231 IonicContact CZ-OE2 3.68Å; R228-E231 IonicContact NE-OE1 2.77Å; R228-E231 PolarHBondContact NE-OE1 2.67Å; R228-E231 IonicContact NE-OE2 2.73Å; R228-E231 IonicContact NH2-OE1 3.13Å; R228-E231 PolarHBondContact NH2-OE1 2.72Å; R228-E231 IonicContact NH2-OE2 3.54Å; R228-E231 PolarHBondContact NH2-OE2 3.17Å; R228-E231 PolarHBondContact O-N 2.97Å; R228-E231 VanDerWaalsContact O-N 3.13Å; R228-L232 PolarHBondContact O-N 3.49Å
229V91.1Very high91.3Very high0 Ų046.3 Ų46.30%021%0.207CC..Hα-helixtrans-60.8-38.5-175.5-176.70000111.5V86 V90 L93 L111 L224 Q227 E231 L232 L233V86-V229 HydrophobicContact CG1-CG2 4.18Å; V90-V229 HydrophobicContact CG2-CG2 3.58Å; L93-V229 HydrophobicContact CD1-CG1 4.49Å; L111-V229 HydrophobicContact CD1-CG1 3.56Å; L111-V229 HydrophobicContact CD2-CG1 4.15Å; L224-V229 HydrophobicContact CB-CG2 4.42Å; L224-V229 HydrophobicContact CD2-CB 4.02Å; L224-V229 HydrophobicContact CD2-CG1 4.24Å; L224-V229 HydrophobicContact CD2-CG2 3.6Å; L224-V229 PolarHBondContact O-N 3.32Å; Q227-V229 HydrophobicContact CB-CG2 3.87Å; Q227-V229 PolarHBondContact O-N 3.04Å; V229-E231 VanDerWaalsContact C-N 3.33Å; V229-E231 PolarHBondContact O-N 2.7Å; V229-L232 WeakPolarHBondContact O-CB 3.12Å; V229-L232 PolarHBondContact O-N 2.99Å; V229-L233 HydrophobicContact CG1-CD1 4.25Å; V229-L233 HydrophobicContact CG1-CG 4.36Å; V229-L233 WeakPolarHBondContact O-CG 3.32Å; V229-L233 PolarHBondContact O-N 2.91Å
230G90.5Very high91Very high4 Ų444.8 Ų44.84%0.04120%0.201CC..Hα-helixtrans-56.2-46175.900000112.4R228 L232 L233 L234 W294R228-G230 VanDerWaalsContact C-N 3.27Å; R228-G230 PolarHBondContact O-N 2.75Å; G230-L232 VanDerWaalsContact C-N 3.34Å; G230-L232 PolarHBondContact O-N 3.41Å; G230-L233 WeakPolarHBondContact O-CB 3.45Å; G230-L233 PolarHBondContact O-N 2.83Å; G230-L234 WeakPolarHBondContact O-CG 3.46Å; G230-L234 PolarHBondContact O-N 2.92Å; G230-W294 VanDerWaalsContact C-CH2 3.49Å; G230-W294 VanDerWaalsContact CA-CH2 3.44Å; G230-W294 WeakPolarHBondContact O-CH2 3.26Å
231E90.3Very high90.7Very high51 Ų5153.3 Ų53.324%0.23823%0.233CC..Hα-helixtrans-66-36.5178.6-61.4-171.6-124.800112.7R228 V229 L234 K235 V301R228-E231 HydrophobicContact CB-CB 4.5Å; R228-E231 IonicContact CZ-OE1 2.67Å; R228-E231 VanDerWaalsContact CZ-OE1 3.28Å; R228-E231 IonicContact CZ-OE2 3.68Å; R228-E231 IonicContact NE-OE1 2.77Å; R228-E231 PolarHBondContact NE-OE1 2.67Å; R228-E231 IonicContact NE-OE2 2.73Å; R228-E231 IonicContact NH2-OE1 3.13Å; R228-E231 PolarHBondContact NH2-OE1 2.72Å; R228-E231 IonicContact NH2-OE2 3.54Å; R228-E231 PolarHBondContact NH2-OE2 3.17Å; R228-E231 PolarHBondContact O-N 2.97Å; R228-E231 VanDerWaalsContact O-N 3.13Å; V229-E231 VanDerWaalsContact C-N 3.33Å; V229-E231 PolarHBondContact O-N 2.7Å; E231-L234 PolarHBondContact O-N 2.94Å; E231-K235 VanDerWaalsContact O-CB 3.28Å; E231-K235 WeakPolarHBondContact O-CB 3.33Å; E231-K235 PolarHBondContact O-N 3.29Å; E231-V301 HydrophobicContact CG-CG1 4.38Å; E231-V301 HydrophobicContact CG-CG2 3.66Å
232L89.8Confident90.3Very high27 Ų2752.2 Ų52.214%0.14123%0.229CC..Hα-helixtrans-63.3-44.5173.4-70.4172.4000111.2V90 L93 R228 V229 G230 K235 V236V90-L232 HydrophobicContact CB-CD1 4.38Å; V90-L232 HydrophobicContact CG1-CD1 3.88Å; V90-L232 HydrophobicContact CG2-CD1 4.3Å; L93-L232 HydrophobicContact CB-CB 4.37Å; R228-L232 PolarHBondContact O-N 3.49Å; V229-L232 WeakPolarHBondContact O-CB 3.12Å; V229-L232 PolarHBondContact O-N 2.99Å; G230-L232 VanDerWaalsContact C-N 3.34Å; G230-L232 PolarHBondContact O-N 3.41Å; L232-K235 PolarHBondContact O-N 2.86Å; L232-V236 WeakPolarHBondContact O-CB 3.44Å; L232-V236 VanDerWaalsContact O-CG2 3.3Å; L232-V236 WeakPolarHBondContact O-CG2 3.38Å; L232-V236 PolarHBondContact O-N 2.83Å
233L90.9Very high90.1Very high0 Ų047.4 Ų47.40%021%0.21CC..Hα-helixtrans-60.6-46.8175.9-70.8171.7000111.6L93 L104 I108 L111 V229 G230 K235 V236 W237 I288 L291L93-L233 HydrophobicContact CD1-CD2 3.75Å; L93-L233 HydrophobicContact CD1-CG 4.27Å; L93-L233 HydrophobicContact CD2-CD2 4.2Å; L104-L233 HydrophobicContact CD1-CD2 3.72Å; I108-L233 HydrophobicContact CG1-CD2 4.09Å; L111-L233 HydrophobicContact CD1-CD1 3.83Å; L111-L233 HydrophobicContact CD1-CD2 4.38Å; L111-L233 HydrophobicContact CD1-CG 4.46Å; V229-L233 HydrophobicContact CG1-CD1 4.25Å; V229-L233 HydrophobicContact CG1-CG 4.36Å; V229-L233 WeakPolarHBondContact O-CG 3.32Å; V229-L233 PolarHBondContact O-N 2.91Å; G230-L233 WeakPolarHBondContact O-CB 3.45Å; G230-L233 PolarHBondContact O-N 2.83Å; L233-K235 VanDerWaalsContact C-N 3.34Å; L233-K235 PolarHBondContact O-N 3.15Å; L233-V236 PolarHBondContact O-N 3Å; L233-W237 VanDerWaalsContact O-CB 3.27Å; L233-W237 WeakPolarHBondContact O-CB 3.3Å; L233-W237 PolarHBondContact O-N 3.17Å; L233-I288 HydrophobicContact CB-CD1 4.13Å; L233-I288 HydrophobicContact CB-CG1 4.22Å; L233-I288 HydrophobicContact CB-CG2 4.13Å; L233-I288 HydrophobicContact CD1-CG1 4.32Å; L233-L291 HydrophobicContact CD1-CD1 3.77Å
234L90Very high89.9Confident3 Ų348.5 Ų48.52%0.01622%0.221CC..Hα-helixtrans-57.7-47.8175.4-70.1175.6000111.2G230 E231 V236 W237 L238 I288 W294 V301 L305 M308G230-L234 WeakPolarHBondContact O-CG 3.46Å; G230-L234 PolarHBondContact O-N 2.92Å; E231-L234 PolarHBondContact O-N 2.94Å; L234-V236 PolarHBondContact O-N 2.77Å; L234-W237 PolarHBondContact O-N 2.95Å; L234-L238 VanDerWaalsContact O-CB 3.27Å; L234-L238 WeakPolarHBondContact O-CB 3.43Å; L234-L238 VanDerWaalsContact O-CG 3.27Å; L234-L238 WeakPolarHBondContact O-CG 3.46Å; L234-L238 PolarHBondContact O-N 3.1Å; L234-I288 HydrophobicContact CD2-CG2 4.12Å; L234-W294 HydrophobicContact CD1-CH2 3.64Å; L234-W294 HydrophobicContact CD1-CZ3 3.58Å; L234-W294 HydrophobicContact CD2-CH2 4.24Å; L234-W294 HydrophobicContact CG-CH2 3.72Å; L234-W294 HydrophobicContact CG-CZ3 4.2Å; L234-V301 HydrophobicContact CD1-CG1 4.1Å; L234-L305 HydrophobicContact CD1-CD2 3.84Å; L234-L305 HydrophobicContact CD1-CG 4.02Å; L234-L305 HydrophobicContact CD2-CD2 3.91Å; L234-L305 HydrophobicContact CG-CD2 4.46Å; L234-M308 HydrophobicContact CD2-CB 4.3Å; L234-M308 HydrophobicContact CD2-CE 3.59Å; L234-M308 HydrophobicContact CD2-SD 3.5Å; L234-M308 VanDerWaalsContact CD2-SD 3.5Å
235K89.2Confident89.7Confident113 Ų11350 Ų5049%0.49123%0.231SC..Hα-helixtrans-62.1-44.3-179.9-178.4-178.1177.2-174.90111.9E231 L232 L233 K239E231-K235 VanDerWaalsContact O-CB 3.28Å; E231-K235 WeakPolarHBondContact O-CB 3.33Å; E231-K235 PolarHBondContact O-N 3.29Å; L232-K235 PolarHBondContact O-N 2.86Å; L233-K235 VanDerWaalsContact C-N 3.34Å; L233-K235 PolarHBondContact O-N 3.15Å; K235-K239 HydrophobicContact CG-CD 4.31Å; K235-K239 WeakPolarHBondContact O-CB 3.39Å; K235-K239 VanDerWaalsContact O-CG 3.22Å; K235-K239 WeakPolarHBondContact O-CG 3.29Å; K235-K239 PolarHBondContact O-N 3.13Å
236V89.3Confident89.6Confident28 Ų2846.8 Ų46.817%0.1722%0.217CC..Hα-helixtrans-66-44.1178.3169.70000110.4L93 P99 L104 L232 L233 L234 K239 S240L93-V236 HydrophobicContact CB-CG2 4.46Å; L93-V236 HydrophobicContact CD2-CG1 4.46Å; L93-V236 HydrophobicContact CD2-CG2 4.16Å; L93-V236 WeakPolarHBondContact O-CG2 3.35Å; P99-V236 HydrophobicContact CG-CG1 3.72Å; P99-V236 HydrophobicContact CG-CG2 4.47Å; L104-V236 HydrophobicContact CD1-CG1 4.14Å; L104-V236 HydrophobicContact CD2-CG1 4.37Å; L232-V236 WeakPolarHBondContact O-CB 3.44Å; L232-V236 VanDerWaalsContact O-CG2 3.3Å; L232-V236 WeakPolarHBondContact O-CG2 3.38Å; L232-V236 PolarHBondContact O-N 2.83Å; L233-V236 PolarHBondContact O-N 3Å; L234-V236 PolarHBondContact O-N 2.77Å; V236-K239 PolarHBondContact O-N 3.43Å; V236-S240 PolarHBondContact O-N 3.31Å
237W90.7Very high89.5Confident0 Ų043.2 Ų43.20%020%0.2CC..Hα-helixtrans-65.5-48.9-179.7-172.298000112L233 L234 K239 S240 I243 R281 A285 I288 M308 T311 C312L233-W237 VanDerWaalsContact O-CB 3.27Å; L233-W237 WeakPolarHBondContact O-CB 3.3Å; L233-W237 PolarHBondContact O-N 3.17Å; L234-W237 PolarHBondContact O-N 2.95Å; W237-K239 PolarHBondContact O-N 3.48Å; W237-S240 WeakPolarHBondContact O-CB 3.25Å; W237-S240 PolarHBondContact O-N 3.45Å; W237-I243 HydrophobicContact CD2-CG2 4.42Å; W237-I243 HydrophobicContact CE3-CG2 3.97Å; W237-I243 HydrophobicContact CH2-CB 4.49Å; W237-I243 HydrophobicContact CH2-CD1 4.34Å; W237-I243 HydrophobicContact CH2-CG1 4.42Å; W237-I243 HydrophobicContact CH2-CG2 3.32Å; W237-I243 HydrophobicContact CZ2-CD1 3.95Å; W237-I243 HydrophobicContact CZ2-CG1 4.06Å; W237-I243 HydrophobicContact CZ2-CG2 3.82Å; W237-I243 HydrophobicContact CZ3-CG2 3.4Å; W237-I243 VanDerWaalsContact CZ3-CG2 3.4Å; W237-R281 PolarHBondContact NE1-O 3.34Å; W237-A285 HydrophobicContact CD2-CB 4.42Å; W237-A285 HydrophobicContact CH2-CB 4.35Å; W237-A285 HydrophobicContact CZ2-CB 3.65Å; W237-I288 HydrophobicContact CB-CD1 4.17Å; W237-I288 HydrophobicContact CG-CD1 4.32Å; W237-M308 HydrophobicContact CB-SD 4.42Å; W237-M308 HydrophobicContact CD2-CG 4.18Å; W237-M308 HydrophobicContact CD2-SD 3.74Å; W237-M308 HydrophobicContact CE3-CB 4.31Å; W237-M308 HydrophobicContact CE3-CG 3.6Å; W237-M308 HydrophobicContact CE3-SD 3.61Å; W237-M308 HydrophobicContact CG-SD 4.09Å; W237-M308 HydrophobicContact CH2-CG 3.99Å; W237-M308 HydrophobicContact CZ3-CB 4.12Å; W237-M308 HydrophobicContact CZ3-CG 3.5Å; W237-M308 VanDerWaalsContact CZ3-CG 3.5Å; W237-M308 HydrophobicContact CZ3-SD 4.15Å; W237-T311 HydrophobicContact CH2-CG2 3.94Å; W237-T311 HydrophobicContact CZ3-CG2 4.09Å; W237-C312 WeakPolarHBondContact CH2-SG 3.37Å; W237-C312 WeakPolarHBondContact CZ2-SG 3.41Å
238L90.3Very high89.4Confident18 Ų1845.2 Ų45.29%0.09421%0.209CC..Hα-helixtrans-64.6-21.9179.8-73.2168.5000113.2L234 K247 D307 M308L234-L238 VanDerWaalsContact O-CB 3.27Å; L234-L238 WeakPolarHBondContact O-CB 3.43Å; L234-L238 VanDerWaalsContact O-CG 3.27Å; L234-L238 WeakPolarHBondContact O-CG 3.46Å; L234-L238 PolarHBondContact O-N 3.1Å; L238-K247 HydrophobicContact CD2-CD 4.13Å; L238-D307 HydrophobicContact CD1-CB 4.48Å; L238-D307 HydrophobicContact CD2-CB 4.17Å; L238-M308 HydrophobicContact CD2-CB 4.21Å
239K87.9Confident89.1Confident143 Ų14340.4 Ų40.462%0.62219%0.192SC*.THydrogen-bonded Turntrans-89.4-0.6175.2-72.8-176.8177.7-158.70113.7K235 V236 W237 R241K235-K239 HydrophobicContact CG-CD 4.31Å; K235-K239 WeakPolarHBondContact O-CB 3.39Å; K235-K239 VanDerWaalsContact O-CG 3.22Å; K235-K239 WeakPolarHBondContact O-CG 3.29Å; K235-K239 PolarHBondContact O-N 3.13Å; V236-K239 PolarHBondContact O-N 3.43Å; W237-K239 PolarHBondContact O-N 3.48Å; K239-R241 PolarHBondContact O-N 3.31Å
240S87.2Confident88.8Confident14 Ų1442.1 Ų42.110%0.09820%0.199CC..  trans-60.8126.6176.9172.70000110.3V236 W237 L242 I243 A244V236-S240 PolarHBondContact O-N 3.31Å; W237-S240 WeakPolarHBondContact O-CB 3.25Å; W237-S240 PolarHBondContact O-N 3.45Å; S240-L242 PolarHBondContact O-N 3.42Å; S240-L242 PolarHBondContact OG-N 2.94Å; S240-I243 PolarHBondContact O-N 2.89Å; S240-A244 PolarHBondContact O-N 2.71Å
241R85.9Confident88.6Confident183 Ų18345.1 Ų45.169%0.69121%0.211SC*.THydrogen-bonded Turntrans-57.5-31178-71-179.3173.3-169.5-9.7113.2K239 I243 P245K239-R241 PolarHBondContact O-N 3.31Å; R241-I243 VanDerWaalsContact C-N 3.25Å; R241-I243 PolarHBondContact O-N 3.35Å; R241-P245 VanDerWaalsContact O-CD 3.26Å; R241-P245 WeakPolarHBondContact O-CD 3.3Å
242L86.3Confident88.1Confident28 Ų2844.5 Ų44.515%0.14721%0.214CC..THydrogen-bonded Turntrans-71.1-26.9179-169.367.2000112S240 F246 R270 H274 K277 I278 R281S240-L242 PolarHBondContact O-N 3.42Å; S240-L242 PolarHBondContact OG-N 2.94Å; L242-F246 VanDerWaalsContact O-CE2 3.3Å; L242-F246 WeakPolarHBondContact O-CE2 3.37Å; L242-R270 PolarHBondContact O-NH1 2.87Å; L242-H274 HydrophobicContact CD1-CB 3.83Å; L242-K277 HydrophobicContact CD2-CB 3.61Å; L242-I278 HydrophobicContact CD1-CG1 4.07Å; L242-I278 HydrophobicContact CD2-CG1 3.9Å; L242-I278 HydrophobicContact CG-CG1 3.87Å; L242-R281 HydrophobicContact CD2-CG 3.99Å
243I88.9Confident87.6Confident0 Ų044.9 Ų44.90%022%0.215CC..THydrogen-bonded Turntrans-103.9-32.4-170.3-64.6-62.2000112.7W237 S240 R241 P245 F246 K247 R281 T311W237-I243 HydrophobicContact CD2-CG2 4.42Å; W237-I243 HydrophobicContact CE3-CG2 3.97Å; W237-I243 HydrophobicContact CH2-CB 4.49Å; W237-I243 HydrophobicContact CH2-CD1 4.34Å; W237-I243 HydrophobicContact CH2-CG1 4.42Å; W237-I243 HydrophobicContact CH2-CG2 3.32Å; W237-I243 HydrophobicContact CZ2-CD1 3.95Å; W237-I243 HydrophobicContact CZ2-CG1 4.06Å; W237-I243 HydrophobicContact CZ2-CG2 3.82Å; W237-I243 HydrophobicContact CZ3-CG2 3.4Å; W237-I243 VanDerWaalsContact CZ3-CG2 3.4Å; S240-I243 PolarHBondContact O-N 2.89Å; R241-I243 VanDerWaalsContact C-N 3.25Å; R241-I243 PolarHBondContact O-N 3.35Å; I243-P245 VanDerWaalsContact C-CD 3.42Å; I243-P245 VanDerWaalsContact C-N 3.31Å; I243-F246 HydrophobicContact CD1-CD2 4.39Å; I243-F246 WeakPolarHBondContact O-CB 3.16Å; I243-F246 PolarHBondContact O-N 3.39Å; I243-K247 PolarHBondContact O-N 3.27Å; I243-R281 HydrophobicContact CD1-CB 3.6Å; I243-R281 HydrophobicContact CD1-CG 4.13Å; I243-R281 HydrophobicContact CG1-CB 3.95Å; I243-R281 HydrophobicContact CG1-CG 4.07Å; I243-T311 HydrophobicContact CG2-CG2 3.46Å; I243-T311 VanDerWaalsContact CG2-CG2 3.46Å
244A89.9Confident86.9Confident34 Ų3448.9 Ų48.928%0.28124%0.24SC..Hα-helixtrans-50.6-41.8-179.200000113.8S240 F246 K247 E248S240-A244 PolarHBondContact O-N 2.71Å; A244-F246 VanDerWaalsContact C-N 3.32Å; A244-F246 PolarHBondContact O-N 3.28Å; A244-K247 WeakPolarHBondContact O-CB 3.42Å; A244-K247 PolarHBondContact O-N 3.34Å; A244-K247 VanDerWaalsContact O-N 3.09Å; A244-E248 PolarHBondContact O-N 2.86Å; A244-E248 VanDerWaalsContact O-N 3.11Å
245P89.6Confident86.3Confident32 Ų3252.5 Ų52.521%0.20826%0.262CS..Hα-helixtrans-61-38176.5-23.534.4000113.3R241 I243 K247 E248 L249 E267R241-P245 VanDerWaalsContact O-CD 3.26Å; R241-P245 WeakPolarHBondContact O-CD 3.3Å; I243-P245 VanDerWaalsContact C-CD 3.42Å; I243-P245 VanDerWaalsContact C-N 3.31Å; P245-K247 VanDerWaalsContact C-N 3.28Å; P245-K247 PolarHBondContact O-N 2.97Å; P245-E248 PolarHBondContact O-N 2.88Å; P245-L249 WeakPolarHBondContact O-CG 3.19Å; P245-L249 PolarHBondContact O-N 3.43Å; P245-E267 WeakPolarHBondContact CB-OE2 3.4Å
246F89.2Confident85.9Confident1 Ų152.8 Ų52.80%0.00427%0.269CS..Hα-helixtrans-68.3-30.5176.6-59-61.3000112.3L242 I243 A244 L249 Y250 R270 V271 I278 T311 M314 A315 C318L242-F246 VanDerWaalsContact O-CE2 3.3Å; L242-F246 WeakPolarHBondContact O-CE2 3.37Å; I243-F246 HydrophobicContact CD1-CD2 4.39Å; I243-F246 WeakPolarHBondContact O-CB 3.16Å; I243-F246 PolarHBondContact O-N 3.39Å; A244-F246 VanDerWaalsContact C-N 3.32Å; A244-F246 PolarHBondContact O-N 3.28Å; F246-L249 HydrophobicContact CD1-CD1 4.25Å; F246-L249 PolarHBondContact O-N 2.84Å; F246-Y250 VanDerWaalsContact O-CB 3.29Å; F246-Y250 WeakPolarHBondContact O-CB 3.33Å; F246-Y250 PolarHBondContact O-N 3.44Å; F246-R270 VanDerWaalsContact CZ-NH2 3.25Å; F246-V271 HydrophobicContact CE1-CG2 3.59Å; F246-V271 HydrophobicContact CZ-CG2 3.51Å; F246-I278 HydrophobicContact CE2-CD1 3.86Å; F246-I278 HydrophobicContact CE2-CG1 4.03Å; F246-I278 HydrophobicContact CE2-CG2 4.18Å; F246-I278 HydrophobicContact CZ-CD1 3.71Å; F246-I278 HydrophobicContact CZ-CG1 4.38Å; F246-T311 HydrophobicContact CB-CG2 3.79Å; F246-M314 HydrophobicContact CB-CG 4.41Å; F246-A315 HydrophobicContact CB-CB 4.14Å; F246-A315 HydrophobicContact CD1-CB 4.15Å; F246-A315 HydrophobicContact CD2-CB 3.59Å; F246-A315 HydrophobicContact CE2-CB 3.99Å; F246-A315 HydrophobicContact CG-CB 3.7Å; F246-A315 HydrophobicContact CZ-CB 4.43Å; F246-C318 HydrophobicContact CD1-CB 4.42Å; F246-C318 HydrophobicContact CE1-CB 3.87Å
247K90.3Very high85.4Confident33 Ų3356 Ų5614%0.14329%0.292CS..Hα-helixtrans-65.8-43.9174.1179.9176.8179.31570110.9L238 I243 A244 P245 Y250 K251 D307 T311L238-K247 HydrophobicContact CD2-CD 4.13Å; I243-K247 PolarHBondContact O-N 3.27Å; A244-K247 WeakPolarHBondContact O-CB 3.42Å; A244-K247 PolarHBondContact O-N 3.34Å; A244-K247 VanDerWaalsContact O-N 3.09Å; P245-K247 VanDerWaalsContact C-N 3.28Å; P245-K247 PolarHBondContact O-N 2.97Å; K247-Y250 PolarHBondContact O-N 3.36Å; K247-K251 VanDerWaalsContact CE-CE 3.46Å; K247-K251 WeakPolarHBondContact O-CG 3.17Å; K247-K251 PolarHBondContact O-N 2.7Å; K247-D307 WeakPolarHBondContact CE-OD2 3.4Å; K247-D307 IonicContact NZ-OD2 2.94Å; K247-D307 PolarHBondContact NZ-OD2 3.18Å; K247-T311 WeakPolarHBondContact CA-OG1 3.27Å; K247-T311 HydrophobicContact CB-CG2 3.98Å; K247-T311 WeakPolarHBondContact CB-OG1 3.22Å
248E89.1Confident84.4Confident118 Ų11857.9 Ų57.955%0.55131%0.308SS*.Hα-helixtrans-65.4-41.2176.1-61.1-48.9129.100111.4A244 P245 Y250 K251 A252A244-E248 PolarHBondContact O-N 2.86Å; A244-E248 VanDerWaalsContact O-N 3.11Å; P245-E248 PolarHBondContact O-N 2.88Å; E248-Y250 PolarHBondContact O-N 2.86Å; E248-K251 PolarHBondContact O-N 3.14Å; E248-A252 VanDerWaalsContact O-CB 3.3Å; E248-A252 WeakPolarHBondContact O-CB 3.26Å; E248-A252 PolarHBondContact O-N 2.88Å
249L84.2Confident83.4Confident19 Ų1963.1 Ų63.110%0.09934%0.343CS..Hα-helixtrans-60.4-45.4173.1-72.8173.8000112.2P245 F246 A252 H253 M314P245-L249 WeakPolarHBondContact O-CG 3.19Å; P245-L249 PolarHBondContact O-N 3.43Å; F246-L249 HydrophobicContact CD1-CD1 4.25Å; F246-L249 PolarHBondContact O-N 2.84Å; L249-A252 PolarHBondContact O-N 3.13Å; L249-H253 WeakPolarHBondContact O-CB 3.36Å; L249-H253 PolarHBondContact O-N 3Å; L249-H253 PolarHBondContact O-ND1 3.29Å; L249-M314 HydrophobicContact CB-CG 3.97Å; L249-M314 HydrophobicContact CB-SD 4.37Å
250Y84.7Confident82.5Confident35 Ų3561.5 Ų61.514%0.13734%0.341CS..Hα-helixtrans-58.4-48.2175.6164.2-109.8000111.3F246 K247 E248 V254 V255F246-Y250 VanDerWaalsContact O-CB 3.29Å; F246-Y250 WeakPolarHBondContact O-CB 3.33Å; F246-Y250 PolarHBondContact O-N 3.44Å; K247-Y250 PolarHBondContact O-N 3.36Å; E248-Y250 PolarHBondContact O-N 2.86Å; Y250-V254 HydrophobicContact CD2-CB 3.72Å; Y250-V254 HydrophobicContact CD2-CG1 4.21Å; Y250-V254 HydrophobicContact CD2-CG2 3.82Å; Y250-V254 HydrophobicContact CE2-CB 3.74Å; Y250-V254 HydrophobicContact CE2-CG1 3.76Å; Y250-V254 HydrophobicContact CE2-CG2 4.23Å; Y250-V254 WeakPolarHBondContact O-CA 3.49Å; Y250-V254 VanDerWaalsContact O-CB 3.3Å; Y250-V254 WeakPolarHBondContact O-CB 3.28Å; Y250-V254 PolarHBondContact O-N 3.4Å; Y250-V255 HydrophobicContact CD1-CG2 4.35Å; Y250-V255 HydrophobicContact CE1-CG2 3.73Å; Y250-V255 HydrophobicContact CE2-CG2 4.29Å; Y250-V255 PolarHBondContact O-N 2.82Å
251K87.1Confident81.8Confident68 Ų6863.6 Ų63.630%0.29635%0.348SS..Iπ-helixtrans-64.3-45.3179.1-74.2-174.8174.1-167.10112.5K247 E248 H253 V255 N256 D307K247-K251 VanDerWaalsContact CE-CE 3.46Å; K247-K251 WeakPolarHBondContact O-CG 3.17Å; K247-K251 PolarHBondContact O-N 2.7Å; E248-K251 PolarHBondContact O-N 3.14Å; K251-H253 PolarHBondContact O-N 2.9Å; K251-V255 WeakPolarHBondContact O-CB 3.44Å; K251-V255 PolarHBondContact O-N 3.43Å; K251-N256 WeakPolarHBondContact O-CB 3.45Å; K251-N256 VanDerWaalsContact O-CG 3.3Å; K251-N256 PolarHBondContact O-N 3.38Å; K251-N256 PolarHBondContact O-ND2 3.2Å; K251-D307 WeakPolarHBondContact CE-OD1 3.29Å; K251-D307 IonicContact NZ-OD2 3.51Å
252A80.6Confident81.1Confident38 Ų3857.7 Ų57.731%0.31433%0.33SS..Iπ-helixtrans-62.3-44.9-179.600000112.2E248 L249 N256 A258E248-A252 VanDerWaalsContact O-CB 3.3Å; E248-A252 WeakPolarHBondContact O-CB 3.26Å; E248-A252 PolarHBondContact O-N 2.88Å; L249-A252 PolarHBondContact O-N 3.13Å; A252-N256 WeakPolarHBondContact O-CB 3.42Å; A252-A258 VanDerWaalsContact O-CB 3.29Å; A252-A258 WeakPolarHBondContact O-CB 3.41Å; A252-A258 PolarHBondContact O-N 3.36Å
253H77.8Confident80.4Confident35 Ų3556.5 Ų56.516%0.16232%0.324CS..Iπ-helixtrans-96.9-36.2-169.3-61.994.8000114.2L249 K251 N260 F261 I262L249-H253 WeakPolarHBondContact O-CB 3.36Å; L249-H253 PolarHBondContact O-N 3Å; L249-H253 PolarHBondContact O-ND1 3.29Å; K251-H253 PolarHBondContact O-N 2.9Å; H253-N260 PolarHBondContact CD2-O 2.7Å; H253-N260 PolarHBondContact NE2-O 3.22Å; H253-F261 HydrophobicContact CB-CD2 4.06Å; H253-F261 AromaticContact CD2-CD2 3.96Å; H253-F261 AromaticContact CG-CD2 3.79Å; H253-I262 PolarHBondContact NE2-N 3.47Å
254V77.4Confident79.7Confident84 Ų8458.7 Ų58.751%0.50934%0.338SS..Iπ-helixtrans-96.5-44.2-175.5-1740000111.2Y250 M314Y250-V254 HydrophobicContact CD2-CB 3.72Å; Y250-V254 HydrophobicContact CD2-CG1 4.21Å; Y250-V254 HydrophobicContact CD2-CG2 3.82Å; Y250-V254 HydrophobicContact CE2-CB 3.74Å; Y250-V254 HydrophobicContact CE2-CG1 3.76Å; Y250-V254 HydrophobicContact CE2-CG2 4.23Å; Y250-V254 WeakPolarHBondContact O-CA 3.49Å; Y250-V254 VanDerWaalsContact O-CB 3.3Å; Y250-V254 WeakPolarHBondContact O-CB 3.28Å; Y250-V254 PolarHBondContact O-N 3.4Å; V254-M314 HydrophobicContact CG2-CE 3.92Å
255V76.8Confident79Confident79 Ų7957.5 Ų57.548%0.47933%0.327SS..Iπ-helixtrans-81.7-44.7-176.8-177.80000111.6Y250 K251 S257Y250-V255 HydrophobicContact CD1-CG2 4.35Å; Y250-V255 HydrophobicContact CE1-CG2 3.73Å; Y250-V255 HydrophobicContact CE2-CG2 4.29Å; Y250-V255 PolarHBondContact O-N 2.82Å; K251-V255 WeakPolarHBondContact O-CB 3.44Å; K251-V255 PolarHBondContact O-N 3.43Å; V255-S257 VanDerWaalsContact C-N 3.31Å
256N80Confident78.5Confident119 Ų11961.8 Ų61.864%0.63634%0.344SS*.SBendtrans-89.63.2-179.5-60.5-25.1000113.1K251 A252 A258K251-N256 WeakPolarHBondContact O-CB 3.45Å; K251-N256 VanDerWaalsContact O-CG 3.3Å; K251-N256 PolarHBondContact O-N 3.38Å; K251-N256 PolarHBondContact O-ND2 3.2Å; A252-N256 WeakPolarHBondContact O-CB 3.42Å; N256-A258 VanDerWaalsContact C-N 3.34Å; N256-A258 PolarHBondContact O-N 2.91Å
257S78.7Confident78Confident95 Ų9563.9 Ų63.966%0.66435%0.354SS*.  trans51.945.7176.9-56.40000114.1V255V255-S257 VanDerWaalsContact C-N 3.31Å
258A70.8Confident77.4Confident39 Ų3962.6 Ų62.632%0.32235%0.349SS..  trans-59.1137.4173.200000110.2A252 N256 N260A252-A258 VanDerWaalsContact O-CB 3.29Å; A252-A258 WeakPolarHBondContact O-CB 3.41Å; A252-A258 PolarHBondContact O-N 3.36Å; N256-A258 VanDerWaalsContact C-N 3.34Å; N256-A258 PolarHBondContact O-N 2.91Å; A258-N260 VanDerWaalsContact C-N 3.31Å; A258-N260 PolarHBondContact O-N 3.15Å
259P69.5Low77Confident128 Ų12859.7 Ų59.783%0.83134%0.335SS*.SBendtrans-67.5-29.8-168.724.5-34.1000113.6
260N69.5Low77Confident110 Ų11060.4 Ų60.459%0.58834%0.336SS*.SBendtrans-124.6132.8-176.4-63.8-30.5000109.8H253 A258 I262H253-N260 PolarHBondContact CD2-O 2.7Å; H253-N260 PolarHBondContact NE2-O 3.22Å; A258-N260 VanDerWaalsContact C-N 3.31Å; A258-N260 PolarHBondContact O-N 3.15Å; N260-I262 HydrophobicContact CB-CD1 4.22Å; N260-I262 HydrophobicContact CB-CG1 4.07Å; N260-I262 PolarHBondContact O-N 2.93Å
261F71Confident76.9Confident57 Ų5758.8 Ų58.825%0.2533%0.33CS..  trans-80.2105.5171.1-176.5-109.2000109.9H253 V263 M314 I321 F338H253-F261 HydrophobicContact CB-CD2 4.06Å; H253-F261 AromaticContact CD2-CD2 3.96Å; H253-F261 AromaticContact CG-CD2 3.79Å; F261-V263 HydrophobicContact CD1-CG2 4.21Å; F261-V263 HydrophobicContact CE1-CG2 3.37Å; F261-V263 HydrophobicContact CE2-CG2 4.27Å; F261-V263 HydrophobicContact CZ-CG2 3.41Å; F261-V263 VanDerWaalsContact CZ-CG2 3.41Å; F261-M314 HydrophobicContact CD2-CE 4.43Å; F261-M314 HydrophobicContact CE2-CE 3.69Å; F261-M314 HydrophobicContact CE2-SD 3.38Å; F261-M314 WeakPolarHBondContact CE2-SD 3.47Å; F261-M314 HydrophobicContact CZ-CE 4.47Å; F261-M314 HydrophobicContact CZ-SD 3.6Å; F261-M314 VanDerWaalsContact CZ-SD 3.6Å; F261-I321 HydrophobicContact CE1-CD1 4.4Å; F261-F338 HydrophobicContact CD1-CB 4.32Å; F261-F338 AromaticContact CD1-CD2 3.81Å; F261-F338 HydrophobicContact CD1-CD2 3.81Å; F261-F338 HydrophobicContact CD1-CG 4.44Å; F261-F338 AromaticContact CE1-CD2 3.91Å; F261-F338 HydrophobicContact CE1-CD2 3.91Å; F261-F338 HydrophobicContact CE1-CE2 4.44Å
262I70.8Confident76.5Confident59 Ų5959.8 Ų59.830%0.30334%0.336SS..EExtended strand (participates in β ladder)trans-117.5122.2-178.6-56.6176.1000108.7H253 N260 C335H253-I262 PolarHBondContact NE2-N 3.47Å; N260-I262 HydrophobicContact CB-CD1 4.22Å; N260-I262 HydrophobicContact CB-CG1 4.07Å; N260-I262 PolarHBondContact O-N 2.93Å; I262-C335 HydrophobicContact CG2-CB 3.68Å
263V73.2Confident76.7Confident4 Ų465.6 Ų65.62%0.02435%0.35CS..EExtended strand (participates in β ladder)trans-106.1121.6171.3-173.60000108.1F261 E267 I336 F338F261-V263 HydrophobicContact CD1-CG2 4.21Å; F261-V263 HydrophobicContact CE1-CG2 3.37Å; F261-V263 HydrophobicContact CE2-CG2 4.27Å; F261-V263 HydrophobicContact CZ-CG2 3.41Å; F261-V263 VanDerWaalsContact CZ-CG2 3.41Å; V263-E267 HydrophobicContact CG1-CB 4Å; V263-I336 PolarHBondContact N-O 3.34Å; V263-I336 PolarHBondContact O-N 3.27Å; V263-I336 VanDerWaalsContact O-N 3.11Å; V263-F338 HydrophobicContact CB-CE2 3.98Å; V263-F338 HydrophobicContact CG2-CD2 4.24Å; V263-F338 HydrophobicContact CG2-CE2 3.81Å
264P73.8Confident77.1Confident45 Ų4566.7 Ų66.729%0.29236%0.355SS..EExtended strand (participates in β ladder)trans-56.4145.4173-24.534000111.5E266 E267 Y268P264-E266 PolarHBondContact O-N 2.92Å; P264-E267 HydrophobicContact CB-CB 4.31Å; P264-E267 HydrophobicContact CB-CG 4.3Å; P264-E267 HydrophobicContact CG-CG 4.3Å; P264-E267 WeakPolarHBondContact O-CB 3.45Å; P264-E267 PolarHBondContact O-N 3.44Å; P264-E267 VanDerWaalsContact O-N 3.09Å; P264-Y268 PolarHBondContact O-N 3.3Å
265V75.4Confident77.3Confident10 Ų1063.8 Ų63.86%0.06134%0.338CS..Hα-helixtrans-60.1-37.8-178.6175.30000110.9E267 Y268 E269 I336V265-E267 VanDerWaalsContact C-N 3.3Å; V265-E267 PolarHBondContact O-N 3.23Å; V265-Y268 WeakPolarHBondContact O-CB 3.47Å; V265-Y268 PolarHBondContact O-N 2.92Å; V265-E269 HydrophobicContact CG1-CG 4.32Å; V265-E269 WeakPolarHBondContact O-CG 3.33Å; V265-E269 PolarHBondContact O-N 3.18Å; V265-I336 HydrophobicContact CG2-CG1 3.9Å
266E78.7Confident77.5Confident121 Ų12162 Ų6257%0.56534%0.336SS*.Hα-helixtrans-63.9-37.2178.5-59.875.9-165.700111.9P264 R270P264-E266 PolarHBondContact O-N 2.92Å; E266-R270 VanDerWaalsContact O-CB 3.23Å; E266-R270 WeakPolarHBondContact O-CB 3.39Å; E266-R270 PolarHBondContact O-N 3.22Å
267E78.9Confident77.7Confident45 Ų4560 Ų6021%0.2132%0.321CS..Hα-helixtrans-70.2-41175.9-77.1-61.7141.500111P245 V263 P264 V265 R270 V271P245-E267 WeakPolarHBondContact CB-OE2 3.4Å; V263-E267 HydrophobicContact CG1-CB 4Å; P264-E267 HydrophobicContact CB-CB 4.31Å; P264-E267 HydrophobicContact CB-CG 4.3Å; P264-E267 HydrophobicContact CG-CG 4.3Å; P264-E267 WeakPolarHBondContact O-CB 3.45Å; P264-E267 PolarHBondContact O-N 3.44Å; P264-E267 VanDerWaalsContact O-N 3.09Å; V265-E267 VanDerWaalsContact C-N 3.3Å; V265-E267 PolarHBondContact O-N 3.23Å; E267-R270 WeakPolarHBondContact O-CB 3.34Å; E267-R270 PolarHBondContact O-N 3.39Å; E267-R270 IonicContact OE1-NE 2.61Å; E267-R270 IonicContact OE2-CZ 3.62Å; E267-R270 IonicContact OE2-NE 3.72Å; E267-R270 PolarHBondContact OE2-NE 2.88Å; E267-R270 IonicContact OE2-NH2 3.93Å; E267-R270 PolarHBondContact OE2-NH2 3.2Å; E267-V271 WeakPolarHBondContact O-CG2 3.41Å; E267-V271 PolarHBondContact O-N 3.22Å
268Y76.5Confident77.9Confident7 Ų755.6 Ų55.63%0.02729%0.29CS..Hα-helixtrans-59.4-50.8173.2178.6-90.7000111.8P264 V265 R270 V271 Q272 I321 A322 F327 I336P264-Y268 PolarHBondContact O-N 3.3Å; V265-Y268 WeakPolarHBondContact O-CB 3.47Å; V265-Y268 PolarHBondContact O-N 2.92Å; Y268-R270 VanDerWaalsContact C-N 3.27Å; Y268-R270 PolarHBondContact O-N 3.43Å; Y268-V271 WeakPolarHBondContact O-CB 3.49Å; Y268-V271 PolarHBondContact O-N 2.81Å; Y268-V271 VanDerWaalsContact O-N 3.15Å; Y268-Q272 HydrophobicContact CD1-CG 4.39Å; Y268-Q272 HydrophobicContact CE1-CG 4.03Å; Y268-Q272 VanDerWaalsContact CE1-NE2 3.33Å; Y268-Q272 PolarHBondContact O-N 3.13Å; Y268-Q272 PolarHBondContact OH-NE2 3.37Å; Y268-I321 HydrophobicContact CE2-CG2 4.19Å; Y268-A322 HydrophobicContact CD2-CB 4.34Å; Y268-A322 VanDerWaalsContact CE2-CA 3.45Å; Y268-A322 HydrophobicContact CE2-CB 4.01Å; Y268-A322 PolarHBondContact OH-O 2.85Å; Y268-F327 HydrophobicContact CE1-CB 4.32Å; Y268-F327 HydrophobicContact CE1-CD2 4.34Å; Y268-F327 HydrophobicContact CE1-CG 4.25Å; Y268-I336 HydrophobicContact CD1-CD1 3.75Å; Y268-I336 HydrophobicContact CD2-CD1 3.63Å; Y268-I336 HydrophobicContact CE1-CD1 4.28Å; Y268-I336 HydrophobicContact CE2-CD1 4.14Å; Y268-I336 HydrophobicContact CG-CD1 3.4Å; Y268-I336 VanDerWaalsContact CG-CD1 3.4Å
269E81Confident78.5Confident57 Ų5756.7 Ų56.727%0.26629%0.289SS..Hα-helixtrans-62.5-35.2176.6-71.1-178.6170.700111.5V265 R273 R329V265-E269 HydrophobicContact CG1-CG 4.32Å; V265-E269 WeakPolarHBondContact O-CG 3.33Å; V265-E269 PolarHBondContact O-N 3.18Å; E269-R273 WeakPolarHBondContact O-CB 3.32Å; E269-R273 WeakPolarHBondContact O-CG 3.21Å; E269-R273 PolarHBondContact O-N 3.38Å; E269-R273 PolarHBondContact O-NE 3.42Å; E269-R273 VanDerWaalsContact O-NE 3.13Å; E269-R329 IonicContact OE1-CZ 2.91Å; E269-R329 IonicContact OE1-NH1 2.87Å; E269-R329 PolarHBondContact OE1-NH1 3.13Å; E269-R329 IonicContact OE1-NH2 3.95Å
270R84.5Confident79.1Confident33 Ų3353.9 Ų53.913%0.12526%0.264CS..Hα-helixtrans-65-42.6174.3-176.5-172.470.280.43111.3L242 F246 E266 E267 Y268 R273 H274L242-R270 PolarHBondContact O-NH1 2.87Å; F246-R270 VanDerWaalsContact CZ-NH2 3.25Å; E266-R270 VanDerWaalsContact O-CB 3.23Å; E266-R270 WeakPolarHBondContact O-CB 3.39Å; E266-R270 PolarHBondContact O-N 3.22Å; E267-R270 WeakPolarHBondContact O-CB 3.34Å; E267-R270 PolarHBondContact O-N 3.39Å; E267-R270 IonicContact OE1-NE 2.61Å; E267-R270 IonicContact OE2-CZ 3.62Å; E267-R270 IonicContact OE2-NE 3.72Å; E267-R270 PolarHBondContact OE2-NE 2.88Å; E267-R270 IonicContact OE2-NH2 3.93Å; E267-R270 PolarHBondContact OE2-NH2 3.2Å; Y268-R270 VanDerWaalsContact C-N 3.27Å; Y268-R270 PolarHBondContact O-N 3.43Å; R270-R273 PolarHBondContact O-N 3.04Å; R270-H274 PolarHBondContact O-N 2.84Å; R270-H274 VanDerWaalsContact O-N 3.09Å; R270-H274 PolarHBondContact O-ND1 3.13Å
271V83Confident79.8Confident2 Ų250 Ų501%0.01224%0.242CC..Hα-helixtrans-61.6-49.3176.7176.30000110F246 E267 Y268 R273 H274 C275 I278 C318 A319 A322F246-V271 HydrophobicContact CE1-CG2 3.59Å; F246-V271 HydrophobicContact CZ-CG2 3.51Å; E267-V271 WeakPolarHBondContact O-CG2 3.41Å; E267-V271 PolarHBondContact O-N 3.22Å; Y268-V271 WeakPolarHBondContact O-CB 3.49Å; Y268-V271 PolarHBondContact O-N 2.81Å; Y268-V271 VanDerWaalsContact O-N 3.15Å; V271-R273 VanDerWaalsContact C-N 3.32Å; V271-R273 PolarHBondContact O-N 3.05Å; V271-H274 CarbonylContact O-C 3.49Å; V271-H274 PolarHBondContact O-N 3.09Å; V271-H274 VanDerWaalsContact O-N 3.15Å; V271-C275 WeakPolarHBondContact O-CA 3.48Å; V271-C275 PolarHBondContact O-N 2.73Å; V271-I278 HydrophobicContact CB-CD1 4.31Å; V271-I278 HydrophobicContact CG1-CD1 4.07Å; V271-I278 HydrophobicContact CG2-CD1 4.42Å; V271-C318 HydrophobicContact CG1-CB 4.45Å; V271-C318 HydrophobicContact CG2-CB 4.22Å; V271-A319 HydrophobicContact CG1-CB 4.16Å; V271-A322 HydrophobicContact CB-CB 4.29Å; V271-A322 HydrophobicContact CG1-CB 3.76Å
272Q79.3Confident80.5Confident89 Ų8947.6 Ų47.642%0.41623%0.231SC..Hα-helixtrans-54.9-48.1176.9-74.2-172.1-4100111.5Y268 H274 A322Y268-Q272 HydrophobicContact CD1-CG 4.39Å; Y268-Q272 HydrophobicContact CE1-CG 4.03Å; Y268-Q272 VanDerWaalsContact CE1-NE2 3.33Å; Y268-Q272 PolarHBondContact O-N 3.13Å; Y268-Q272 PolarHBondContact OH-NE2 3.37Å; Q272-H274 VanDerWaalsContact C-N 3.3Å; Q272-H274 PolarHBondContact O-N 2.65Å; Q272-A322 HydrophobicContact CG-CB 3.65Å; Q272-A322 PolarHBondContact NE2-O 3.49Å
273R84.4Confident81.1Confident160 Ų16047.2 Ų47.260%0.60423%0.232SC*.Hα-helixtrans-65-28.8179.9-77.5179.7-79.5123.2-6.7114.4E269 R270 V271E269-R273 WeakPolarHBondContact O-CB 3.32Å; E269-R273 WeakPolarHBondContact O-CG 3.21Å; E269-R273 PolarHBondContact O-N 3.38Å; E269-R273 PolarHBondContact O-NE 3.42Å; E269-R273 VanDerWaalsContact O-NE 3.13Å; R270-R273 PolarHBondContact O-N 3.04Å; V271-R273 VanDerWaalsContact C-N 3.32Å; V271-R273 PolarHBondContact O-N 3.05Å
274H85.6Confident81.7Confident57 Ų5747.6 Ų47.626%0.26423%0.234SC..THydrogen-bonded Turntrans-119.420.7-172.5-57.892.8000113.5L242 R270 V271 Q272 G276 K277 I278L242-H274 HydrophobicContact CD1-CB 3.83Å; R270-H274 PolarHBondContact O-N 2.84Å; R270-H274 VanDerWaalsContact O-N 3.09Å; R270-H274 PolarHBondContact O-ND1 3.13Å; V271-H274 CarbonylContact O-C 3.49Å; V271-H274 PolarHBondContact O-N 3.09Å; V271-H274 VanDerWaalsContact O-N 3.15Å; Q272-H274 VanDerWaalsContact C-N 3.3Å; Q272-H274 PolarHBondContact O-N 2.65Å; H274-G276 VanDerWaalsContact C-N 3.34Å; H274-G276 PolarHBondContact O-N 3.1Å; H274-K277 PolarHBondContact O-N 3.02Å; H274-K277 VanDerWaalsContact O-N 3.09Å; H274-I278 HydrophobicContact CB-CD1 4.3Å; H274-I278 HydrophobicContact CB-CG1 4.48Å; H274-I278 WeakPolarHBondContact O-CG1 3.24Å; H274-I278 PolarHBondContact O-N 2.73Å
275C82.2Confident82.4Confident23 Ų2345.5 Ų45.516%0.15522%0.22CC..Hα-helixtrans-55.3-46.3-171.7-171.40000112.7V271 K277 I278 Q279 I323V271-C275 WeakPolarHBondContact O-CA 3.48Å; V271-C275 PolarHBondContact O-N 2.73Å; C275-K277 PolarHBondContact O-N 2.85Å; C275-I278 WeakPolarHBondContact O-CB 3.32Å; C275-I278 PolarHBondContact O-N 2.89Å; C275-I278 VanDerWaalsContact O-N 3.16Å; C275-Q279 PolarHBondContact O-N 3.25Å; C275-I323 VanDerWaalsContact SG-CD1 3.59Å
276G80Confident82.9Confident42 Ų4245.5 Ų45.543%0.43322%0.221SC..Hα-helixtrans-60.5-44.5176.700000113.5H274 I278 Q279 E280H274-G276 VanDerWaalsContact C-N 3.34Å; H274-G276 PolarHBondContact O-N 3.1Å; G276-I278 VanDerWaalsContact C-N 3.31Å; G276-I278 PolarHBondContact O-N 2.78Å; G276-Q279 PolarHBondContact O-N 2.75Å; G276-E280 PolarHBondContact O-N 2.92Å
277K84.8Confident83.3Confident77 Ų7741.7 Ų41.734%0.33521%0.207SC..Hα-helixtrans-64.7-35.2175.8-65.1-173.6-176.3178.50111.3E162 L242 H274 C275 R281E162-K277 IonicContact OE1-NZ 3.7Å; E162-K277 PolarHBondContact OE1-NZ 2.82Å; L242-K277 HydrophobicContact CD2-CB 3.61Å; H274-K277 PolarHBondContact O-N 3.02Å; H274-K277 VanDerWaalsContact O-N 3.09Å; C275-K277 PolarHBondContact O-N 2.85Å; K277-R281 VanDerWaalsContact O-CG 3.3Å; K277-R281 WeakPolarHBondContact O-CG 3.35Å; K277-R281 PolarHBondContact O-N 2.97Å; K277-R281 VanDerWaalsContact O-N 3.13Å
278I84.3Confident83.8Confident2 Ų239.6 Ų39.61%0.0120%0.197CC..Hα-helixtrans-66.9-45.5176.3-68.1163.4000110L242 F246 V271 H274 C275 G276 E280 R281 T282 A315L242-I278 HydrophobicContact CD1-CG1 4.07Å; L242-I278 HydrophobicContact CD2-CG1 3.9Å; L242-I278 HydrophobicContact CG-CG1 3.87Å; F246-I278 HydrophobicContact CE2-CD1 3.86Å; F246-I278 HydrophobicContact CE2-CG1 4.03Å; F246-I278 HydrophobicContact CE2-CG2 4.18Å; F246-I278 HydrophobicContact CZ-CD1 3.71Å; F246-I278 HydrophobicContact CZ-CG1 4.38Å; V271-I278 HydrophobicContact CB-CD1 4.31Å; V271-I278 HydrophobicContact CG1-CD1 4.07Å; V271-I278 HydrophobicContact CG2-CD1 4.42Å; H274-I278 HydrophobicContact CB-CD1 4.3Å; H274-I278 HydrophobicContact CB-CG1 4.48Å; H274-I278 WeakPolarHBondContact O-CG1 3.24Å; H274-I278 PolarHBondContact O-N 2.73Å; C275-I278 WeakPolarHBondContact O-CB 3.32Å; C275-I278 PolarHBondContact O-N 2.89Å; C275-I278 VanDerWaalsContact O-N 3.16Å; G276-I278 VanDerWaalsContact C-N 3.31Å; G276-I278 PolarHBondContact O-N 2.78Å; I278-E280 VanDerWaalsContact C-N 3.33Å; I278-E280 PolarHBondContact O-N 3.46Å; I278-R281 WeakPolarHBondContact O-CB 3.48Å; I278-R281 PolarHBondContact O-N 3.42Å; I278-R281 VanDerWaalsContact O-N 3.1Å; I278-T282 PolarHBondContact O-N 2.93Å; I278-T282 PolarHBondContact O-OG1 3.27Å; I278-T282 VanDerWaalsContact O-OG1 3.11Å; I278-A315 HydrophobicContact CG2-CB 3.94Å
279Q81.5Confident84.3Confident63 Ų6340.4 Ų40.429%0.29420%0.202SC..Hα-helixtrans-60.2-42176.9-176.3-170.8-1400112.3L176 C275 G276 R281 T282 T283L176-Q279 HydrophobicContact CD2-CG 4.13Å; C275-Q279 PolarHBondContact O-N 3.25Å; G276-Q279 PolarHBondContact O-N 2.75Å; Q279-R281 VanDerWaalsContact C-N 3.31Å; Q279-R281 PolarHBondContact O-N 2.98Å; Q279-T282 PolarHBondContact O-N 2.89Å; Q279-T283 PolarHBondContact O-N 3.16Å; Q279-T283 PolarHBondContact O-OG1 2.92Å
280E83.1Confident84.5Confident68 Ų6839.1 Ų39.132%0.31820%0.204SC..Hα-helixtrans-58.5-43.8173.5-172.7-166.8157.600111N105 G276 I278 T283 N284N105-E280 PolarHBondContact ND2-OE1 3.2Å; G276-E280 PolarHBondContact O-N 2.92Å; I278-E280 VanDerWaalsContact C-N 3.33Å; I278-E280 PolarHBondContact O-N 3.46Å; E280-T283 PolarHBondContact O-N 2.93Å; E280-N284 PolarHBondContact O-N 2.9Å; E280-N284 PolarHBondContact O-ND2 3.09Å
281R84.9Confident84.7Confident30 Ų3037.6 Ų37.611%0.11320%0.199CC..Hα-helixtrans-65.6-39176-68.6-61.2-172.9174.22.1113.2L104 W237 L242 I243 K277 I278 Q279 T283 N284 A285L104-R281 VanDerWaalsContact CD2-NH1 3.34Å; W237-R281 PolarHBondContact NE1-O 3.34Å; L242-R281 HydrophobicContact CD2-CG 3.99Å; I243-R281 HydrophobicContact CD1-CB 3.6Å; I243-R281 HydrophobicContact CD1-CG 4.13Å; I243-R281 HydrophobicContact CG1-CB 3.95Å; I243-R281 HydrophobicContact CG1-CG 4.07Å; K277-R281 VanDerWaalsContact O-CG 3.3Å; K277-R281 WeakPolarHBondContact O-CG 3.35Å; K277-R281 PolarHBondContact O-N 2.97Å; K277-R281 VanDerWaalsContact O-N 3.13Å; I278-R281 WeakPolarHBondContact O-CB 3.48Å; I278-R281 PolarHBondContact O-N 3.42Å; I278-R281 VanDerWaalsContact O-N 3.1Å; Q279-R281 VanDerWaalsContact C-N 3.31Å; Q279-R281 PolarHBondContact O-N 2.98Å; R281-T283 VanDerWaalsContact C-N 3.33Å; R281-N284 WeakPolarHBondContact O-CB 3.39Å; R281-N284 PolarHBondContact O-N 3.32Å; R281-A285 PolarHBondContact O-N 3.11Å
282T84.7Confident84.9Confident5 Ų539.5 Ų39.53%0.03121%0.211CC..Hα-helixtrans-64.8-41175-54.70000110.6V180 I278 Q279 N284 A285 C286 C312V180-T282 HydrophobicContact CG2-CG2 4.09Å; I278-T282 PolarHBondContact O-N 2.93Å; I278-T282 PolarHBondContact O-OG1 3.27Å; I278-T282 VanDerWaalsContact O-OG1 3.11Å; Q279-T282 PolarHBondContact O-N 2.89Å; T282-N284 VanDerWaalsContact C-N 3.34Å; T282-N284 PolarHBondContact O-N 3.41Å; T282-A285 WeakPolarHBondContact O-CB 3.26Å; T282-A285 PolarHBondContact O-N 3.5Å; T282-A285 VanDerWaalsContact O-N 3.13Å; T282-C286 PolarHBondContact O-N 2.85Å; T282-C286 PolarHBondContact O-SG 3.39Å; T282-C286 VanDerWaalsContact O-SG 3.35Å; T282-C312 HydrophobicContact CG2-CB 4.16Å
283T84.1Confident85.3Confident51 Ų5136 Ų3631%0.31320%0.195SC..Hα-helixtrans-62.5-41.1175.2-55.70000111.8Q279 E280 R281 A285 C286 S287Q279-T283 PolarHBondContact O-N 3.16Å; Q279-T283 PolarHBondContact O-OG1 2.92Å; E280-T283 PolarHBondContact O-N 2.93Å; R281-T283 VanDerWaalsContact C-N 3.33Å; T283-A285 VanDerWaalsContact C-N 3.33Å; T283-A285 PolarHBondContact O-N 3.29Å; T283-C286 PolarHBondContact O-N 2.89Å; T283-S287 PolarHBondContact O-N 3.35Å; T283-S287 PolarHBondContact O-OG 3.19Å
284N86Confident85.3Confident13 Ų1330.4 Ų30.47%0.0717%0.174CC..Hα-helixtrans-60.8-41.4173-76.9-30.6000112.2N105 I108 E280 R281 T282 S287 I288N105-N284 PolarHBondContact OD1-ND2 2.95Å; N105-N284 PolarHBondContact OD1-OD1 2.9Å; I108-N284 HydrophobicContact CD1-CB 3.74Å; E280-N284 PolarHBondContact O-N 2.9Å; E280-N284 PolarHBondContact O-ND2 3.09Å; R281-N284 WeakPolarHBondContact O-CB 3.39Å; R281-N284 PolarHBondContact O-N 3.32Å; T282-N284 VanDerWaalsContact C-N 3.34Å; T282-N284 PolarHBondContact O-N 3.41Å; N284-S287 WeakPolarHBondContact O-CB 3.32Å; N284-S287 PolarHBondContact O-N 2.88Å; N284-I288 VanDerWaalsContact O-CG1 3.27Å; N284-I288 WeakPolarHBondContact O-CG1 3.41Å; N284-I288 PolarHBondContact O-N 3.28Å
285A87.8Confident84.8Confident0 Ų033.9 Ų33.90%020%0.195CC..Hα-helixtrans-62.3-47.1176.900000111.4W237 R281 T282 T283 S287 I288 L289 M308 C312W237-A285 HydrophobicContact CD2-CB 4.42Å; W237-A285 HydrophobicContact CH2-CB 4.35Å; W237-A285 HydrophobicContact CZ2-CB 3.65Å; R281-A285 PolarHBondContact O-N 3.11Å; T282-A285 WeakPolarHBondContact O-CB 3.26Å; T282-A285 PolarHBondContact O-N 3.5Å; T282-A285 VanDerWaalsContact O-N 3.13Å; T283-A285 VanDerWaalsContact C-N 3.33Å; T283-A285 PolarHBondContact O-N 3.29Å; A285-S287 PolarHBondContact O-N 2.98Å; A285-I288 PolarHBondContact O-N 2.89Å; A285-I288 VanDerWaalsContact O-N 3.13Å; A285-L289 WeakPolarHBondContact O-CG 3.3Å; A285-L289 PolarHBondContact O-N 3.38Å; A285-M308 HydrophobicContact CB-CE 3.92Å; A285-M308 HydrophobicContact CB-CG 4.04Å; A285-M308 HydrophobicContact CB-SD 3.97Å; A285-M308 VanDerWaalsContact O-CE 3.31Å; A285-M308 WeakPolarHBondContact O-CE 3.5Å; A285-C312 WeakPolarHBondContact CB-SG 3.32Å
286C85.8Confident84.3Confident11 Ų1138.9 Ų38.97%0.07422%0.22CC..Hα-helixtrans-57.2-40174.6-62.40000111.7T282 T283 L289 G290T282-C286 PolarHBondContact O-N 2.85Å; T282-C286 PolarHBondContact O-SG 3.39Å; T282-C286 VanDerWaalsContact O-SG 3.35Å; T283-C286 PolarHBondContact O-N 2.89Å; C286-L289 PolarHBondContact O-N 3.48Å; C286-G290 PolarHBondContact O-N 2.87Å
287S86.7Confident83.9Confident41 Ų4138.6 Ų38.629%0.28721%0.213SC..Hα-helixtrans-66.3-40177.2-56.50000112.3I108 T283 N284 A285 G290I108-S287 VanDerWaalsContact CG2-CB 3.49Å; T283-S287 PolarHBondContact O-N 3.35Å; T283-S287 PolarHBondContact O-OG 3.19Å; N284-S287 WeakPolarHBondContact O-CB 3.32Å; N284-S287 PolarHBondContact O-N 2.88Å; A285-S287 PolarHBondContact O-N 2.98Å; S287-G290 PolarHBondContact O-N 3.41Å
288I89.9Confident83.6Confident0 Ų042.9 Ų42.90%023%0.227CC..Hα-helixtrans-64.8-46.7174.6-67.7163000110.3I108 L233 L234 W237 N284 A285 G290 L291 W294 M308I108-I288 HydrophobicContact CD1-CD1 3.78Å; I108-I288 HydrophobicContact CD1-CG1 3.77Å; I108-I288 HydrophobicContact CG1-CD1 4.29Å; I108-I288 HydrophobicContact CG1-CG1 3.9Å; L233-I288 HydrophobicContact CB-CD1 4.13Å; L233-I288 HydrophobicContact CB-CG1 4.22Å; L233-I288 HydrophobicContact CB-CG2 4.13Å; L233-I288 HydrophobicContact CD1-CG1 4.32Å; L234-I288 HydrophobicContact CD2-CG2 4.12Å; W237-I288 HydrophobicContact CB-CD1 4.17Å; W237-I288 HydrophobicContact CG-CD1 4.32Å; N284-I288 VanDerWaalsContact O-CG1 3.27Å; N284-I288 WeakPolarHBondContact O-CG1 3.41Å; N284-I288 PolarHBondContact O-N 3.28Å; A285-I288 PolarHBondContact O-N 2.89Å; A285-I288 VanDerWaalsContact O-N 3.13Å; I288-G290 PolarHBondContact O-N 3.43Å; I288-L291 WeakPolarHBondContact O-CB 3.35Å; I288-L291 PolarHBondContact O-N 3.24Å; I288-L291 VanDerWaalsContact O-N 3.15Å; I288-W294 HydrophobicContact CG2-CH2 4.19Å; I288-W294 HydrophobicContact CG2-CZ2 3.72Å; I288-W294 VanDerWaalsContact O-CZ2 3.32Å; I288-W294 WeakPolarHBondContact O-CZ2 3.3Å; I288-W294 PolarHBondContact O-NE1 3.36Å; I288-W294 VanDerWaalsContact O-NE1 3.16Å; I288-M308 HydrophobicContact CB-CE 3.93Å; I288-M308 HydrophobicContact CG2-CE 3.85Å
289L87.3Confident83.2Confident24 Ų2445.8 Ų45.813%0.12626%0.258CS..Hα-helixtrans-60.9-34.3177.9-68.3174.2000112.2F184 A285 C286 L291 W294 L305 M308F184-L289 HydrophobicContact CE1-CD1 3.94Å; A285-L289 WeakPolarHBondContact O-CG 3.3Å; A285-L289 PolarHBondContact O-N 3.38Å; C286-L289 PolarHBondContact O-N 3.48Å; L289-L291 PolarHBondContact O-N 2.87Å; L289-W294 VanDerWaalsContact O-CD1 3.27Å; L289-W294 PolarHBondContact O-NE1 3.41Å; L289-L305 HydrophobicContact CD2-CD2 3.42Å; L289-L305 VanDerWaalsContact CD2-CD2 3.42Å; L289-M308 HydrophobicContact CD1-CE 4.11Å; L289-M308 HydrophobicContact CD2-CE 3.53Å; L289-M308 HydrophobicContact CG-CE 3.41Å; L289-M308 VanDerWaalsContact CG-CE 3.41Å
290G85.1Confident83.2Confident30 Ų3046.4 Ų46.431%0.30927%0.269SS..THydrogen-bonded Turntrans-72.8-9.7177.700000115.4Y187 C286 S287 I288Y187-G290 WeakPolarHBondContact OH-CA 3.26Å; C286-G290 PolarHBondContact O-N 2.87Å; S287-G290 PolarHBondContact O-N 3.41Å; I288-G290 PolarHBondContact O-N 3.43Å
291L88.5Confident83.3Confident2 Ų243.5 Ų43.51%0.0126%0.256CS..SBendtrans-69137.5177.5-65.2173.2000110.5N112 L233 I288 L289 L293 W294N112-L291 HydrophobicContact CB-CD2 3.94Å; L233-L291 HydrophobicContact CD1-CD1 3.77Å; I288-L291 WeakPolarHBondContact O-CB 3.35Å; I288-L291 PolarHBondContact O-N 3.24Å; I288-L291 VanDerWaalsContact O-N 3.15Å; L289-L291 PolarHBondContact O-N 2.87Å; L291-L293 HydrophobicContact CB-CD1 3.97Å; L291-L293 HydrophobicContact CB-CG 3.94Å; L291-L293 HydrophobicContact CD1-CD1 3.97Å; L291-L293 PolarHBondContact O-N 2.78Å; L291-W294 PolarHBondContact O-NE1 3.19Å; L291-W294 VanDerWaalsContact O-NE1 3.08Å
292P88Confident83.4Confident41 Ų4145.2 Ų45.227%0.26627%0.269SS..THydrogen-bonded Turntrans-75.947.7178.832.9-37.4000112.8C115 Q221C115-P292 HydrophobicContact CB-CG 3.73Å; Q221-P292 HydrophobicContact CG-CG 4.02Å
293L87.4Confident83.5Confident17 Ų1748.1 Ų48.19%0.08929%0.29CS..THydrogen-bonded Turntrans-109-4.7-174.9-58.1178.9000113.1L224 K225 L291L224-L293 HydrophobicContact CB-CD1 4.34Å; L224-L293 HydrophobicContact CB-CD2 3.54Å; L224-L293 HydrophobicContact CD1-CD2 4.3Å; K225-L293 HydrophobicContact CG-CD2 4.05Å; L291-L293 HydrophobicContact CB-CD1 3.97Å; L291-L293 HydrophobicContact CB-CG 3.94Å; L291-L293 HydrophobicContact CD1-CD1 3.97Å; L291-L293 PolarHBondContact O-N 2.78Å
294W84.7Confident83.8Confident41 Ų4147.5 Ų47.516%0.15529%0.288CS..  trans-101.7-5.3-165.7-46.1116.3000115.6G230 L234 I288 L289 L291 D296 A297 V301 L305G230-W294 VanDerWaalsContact C-CH2 3.49Å; G230-W294 VanDerWaalsContact CA-CH2 3.44Å; G230-W294 WeakPolarHBondContact O-CH2 3.26Å; L234-W294 HydrophobicContact CD1-CH2 3.64Å; L234-W294 HydrophobicContact CD1-CZ3 3.58Å; L234-W294 HydrophobicContact CD2-CH2 4.24Å; L234-W294 HydrophobicContact CG-CH2 3.72Å; L234-W294 HydrophobicContact CG-CZ3 4.2Å; I288-W294 HydrophobicContact CG2-CH2 4.19Å; I288-W294 HydrophobicContact CG2-CZ2 3.72Å; I288-W294 VanDerWaalsContact O-CZ2 3.32Å; I288-W294 WeakPolarHBondContact O-CZ2 3.3Å; I288-W294 PolarHBondContact O-NE1 3.36Å; I288-W294 VanDerWaalsContact O-NE1 3.16Å; L289-W294 VanDerWaalsContact O-CD1 3.27Å; L289-W294 PolarHBondContact O-NE1 3.41Å; L291-W294 PolarHBondContact O-NE1 3.19Å; L291-W294 VanDerWaalsContact O-NE1 3.08Å; W294-D296 PolarHBondContact O-N 3.43Å; W294-A297 VanDerWaalsContact O-CB 3.26Å; W294-A297 WeakPolarHBondContact O-CB 3.34Å; W294-A297 PolarHBondContact O-N 2.94Å; W294-A297 VanDerWaalsContact O-N 3.09Å; W294-V301 HydrophobicContact CE3-CG1 3.96Å; W294-V301 HydrophobicContact CZ3-CG1 3.91Å; W294-L305 HydrophobicContact CD2-CD1 4.24Å; W294-L305 HydrophobicContact CD2-CD2 4.01Å; W294-L305 HydrophobicContact CE3-CD1 4.01Å; W294-L305 HydrophobicContact CE3-CD2 4.02Å; W294-L305 HydrophobicContact CE3-CG 4.43Å; W294-L305 HydrophobicContact CG-CD1 4.47Å; W294-L305 HydrophobicContact CH2-CD2 4.2Å; W294-L305 HydrophobicContact CZ2-CD2 4.22Å; W294-L305 HydrophobicContact CZ3-CD2 4.11Å
295N74.6Confident83.9Confident131 Ų13148.2 Ų48.270%0.70129%0.291SS*.THydrogen-bonded Turntrans-58.6-25-172.7-60.9-6.3000113.8
296D70.6Confident83.9Confident128 Ų12853.1 Ų53.168%0.68432%0.317SS*.THydrogen-bonded Turntrans-118.430-176.5-48.5-63.8000111.3K225 W294 R298K225-D296 IonicContact NZ-OD2 2.88Å; K225-D296 PolarHBondContact NZ-OD2 3.47Å; W294-D296 PolarHBondContact O-N 3.43Å; D296-R298 PolarHBondContact O-N 3Å
297A72.5Confident84.1Confident35 Ų3553.6 Ų53.629%0.28932%0.319SS..  trans-63.9125-173.200000112.3W294 V301 V302W294-A297 VanDerWaalsContact O-CB 3.26Å; W294-A297 WeakPolarHBondContact O-CB 3.34Å; W294-A297 PolarHBondContact O-N 2.94Å; W294-A297 VanDerWaalsContact O-N 3.09Å; A297-V301 HydrophobicContact CB-CB 4.11Å; A297-V301 HydrophobicContact CB-CG1 3.99Å; A297-V302 HydrophobicContact CB-CG2 4.12Å
298R77.5Confident84.3Confident167 Ų16751.6 Ų51.663%0.6331%0.305SS*.  trans-68.4158.4172.6-60.3179.3-179.5-173.3-0.8110.7D296 S300 V301 V302D296-R298 PolarHBondContact O-N 3Å; R298-S300 VanDerWaalsContact C-N 3.25Å; R298-S300 PolarHBondContact O-N 3.19Å; R298-S300 VanDerWaalsContact O-N 3.09Å; R298-V301 HydrophobicContact CB-CG2 4.37Å; R298-V301 WeakPolarHBondContact O-CA 3.43Å; R298-V301 WeakPolarHBondContact O-CB 3.31Å; R298-V301 PolarHBondContact O-N 2.88Å; R298-V302 PolarHBondContact O-N 2.86Å
299G77.4Confident84.2Confident63 Ų6353.5 Ų53.565%0.64932%0.317SS*.Hα-helixtrans-52.1-37.1-179.300000115V301 V302 S303G299-V301 VanDerWaalsContact C-N 3.34Å; G299-V301 PolarHBondContact O-N 3.44Å; G299-V302 PolarHBondContact O-N 3.49Å; G299-S303 PolarHBondContact O-N 3.38Å; G299-S303 VanDerWaalsContact O-N 3.09Å
300S80Confident84.1Confident76 Ų7652.8 Ų52.853%0.53132%0.315SS..Hα-helixtrans-65.9-33.9174.859.10000113.6R298 S304R298-S300 VanDerWaalsContact C-N 3.25Å; R298-S300 PolarHBondContact O-N 3.19Å; R298-S300 VanDerWaalsContact O-N 3.09Å; S300-S304 PolarHBondContact O-N 3.38Å; S300-S304 VanDerWaalsContact O-N 3.14Å; S300-S304 PolarHBondContact O-OG 2.94Å
301V86Confident84.3Confident7 Ų751.3 Ų51.34%0.04230%0.3CS..Hα-helixtrans-72.2-42.5177-177.40000109.6E231 L234 W294 A297 R298 G299 S303 S304 L305E231-V301 HydrophobicContact CG-CG1 4.38Å; E231-V301 HydrophobicContact CG-CG2 3.66Å; L234-V301 HydrophobicContact CD1-CG1 4.1Å; W294-V301 HydrophobicContact CE3-CG1 3.96Å; W294-V301 HydrophobicContact CZ3-CG1 3.91Å; A297-V301 HydrophobicContact CB-CB 4.11Å; A297-V301 HydrophobicContact CB-CG1 3.99Å; R298-V301 HydrophobicContact CB-CG2 4.37Å; R298-V301 WeakPolarHBondContact O-CA 3.43Å; R298-V301 WeakPolarHBondContact O-CB 3.31Å; R298-V301 PolarHBondContact O-N 2.88Å; G299-V301 VanDerWaalsContact C-N 3.34Å; G299-V301 PolarHBondContact O-N 3.44Å; V301-S303 VanDerWaalsContact C-N 3.34Å; V301-S303 PolarHBondContact O-N 2.94Å; V301-S304 CarbonylContact O-C 3.56Å; V301-S304 WeakPolarHBondContact O-CA 3.27Å; V301-S304 WeakPolarHBondContact O-CB 3.46Å; V301-S304 PolarHBondContact O-N 3.37Å; V301-L305 HydrophobicContact CG1-CD1 4.05Å; V301-L305 HydrophobicContact CG1-CG 4.29Å; V301-L305 WeakPolarHBondContact O-CG 3.43Å; V301-L305 PolarHBondContact O-N 2.89Å
302V86.4Confident84.2Confident66 Ų6651.2 Ų51.240%0.430%0.3SS..Hα-helixtrans-57.1-47.2175.11780000111A297 R298 G299 S304 L305 L306A297-V302 HydrophobicContact CB-CG2 4.12Å; R298-V302 PolarHBondContact O-N 2.86Å; G299-V302 PolarHBondContact O-N 3.49Å; V302-S304 VanDerWaalsContact C-N 3.3Å; V302-S304 PolarHBondContact O-N 2.86Å; V302-L305 PolarHBondContact O-N 3.43Å; V302-L306 HydrophobicContact CG1-CD1 4.34Å; V302-L306 WeakPolarHBondContact O-CG 3.12Å; V302-L306 PolarHBondContact O-N 3.14Å
303S87.4Confident84Confident66 Ų6653.5 Ų53.546%0.46231%0.309SS..Hα-helixtrans-60.3-39174.8174.20000112.5G299 V301 L306 D307G299-S303 PolarHBondContact O-N 3.38Å; G299-S303 VanDerWaalsContact O-N 3.09Å; V301-S303 VanDerWaalsContact C-N 3.34Å; V301-S303 PolarHBondContact O-N 2.94Å; S303-L306 PolarHBondContact O-N 3.09Å; S303-D307 WeakPolarHBondContact O-CB 3.3Å; S303-D307 PolarHBondContact O-N 3.46Å
304S89.7Confident83.8Confident39 Ų3953.7 Ų53.727%0.27331%0.31SS..Hα-helixtrans-69.1-35.3177.3-59.10000112.9S300 V301 V302 M308S300-S304 PolarHBondContact O-N 3.38Å; S300-S304 VanDerWaalsContact O-N 3.14Å; S300-S304 PolarHBondContact O-OG 2.94Å; V301-S304 CarbonylContact O-C 3.56Å; V301-S304 WeakPolarHBondContact O-CA 3.27Å; V301-S304 WeakPolarHBondContact O-CB 3.46Å; V301-S304 PolarHBondContact O-N 3.37Å; V302-S304 VanDerWaalsContact C-N 3.3Å; V302-S304 PolarHBondContact O-N 2.86Å; S304-M308 WeakPolarHBondContact O-CB 3.38Å; S304-M308 PolarHBondContact O-N 3.34Å
305L89.2Confident83.9Confident27 Ų2751.7 Ų51.714%0.14130%0.302CS..Hα-helixtrans-66.1-44.4174-72.1167.4000110.6L234 L289 W294 V301 V302 M308 T309L234-L305 HydrophobicContact CD1-CD2 3.84Å; L234-L305 HydrophobicContact CD1-CG 4.02Å; L234-L305 HydrophobicContact CD2-CD2 3.91Å; L234-L305 HydrophobicContact CG-CD2 4.46Å; L289-L305 HydrophobicContact CD2-CD2 3.42Å; L289-L305 VanDerWaalsContact CD2-CD2 3.42Å; W294-L305 HydrophobicContact CD2-CD1 4.24Å; W294-L305 HydrophobicContact CD2-CD2 4.01Å; W294-L305 HydrophobicContact CE3-CD1 4.01Å; W294-L305 HydrophobicContact CE3-CD2 4.02Å; W294-L305 HydrophobicContact CE3-CG 4.43Å; W294-L305 HydrophobicContact CG-CD1 4.47Å; W294-L305 HydrophobicContact CH2-CD2 4.2Å; W294-L305 HydrophobicContact CZ2-CD2 4.22Å; W294-L305 HydrophobicContact CZ3-CD2 4.11Å; V301-L305 HydrophobicContact CG1-CD1 4.05Å; V301-L305 HydrophobicContact CG1-CG 4.29Å; V301-L305 WeakPolarHBondContact O-CG 3.43Å; V301-L305 PolarHBondContact O-N 2.89Å; V302-L305 PolarHBondContact O-N 3.43Å; L305-M308 PolarHBondContact O-N 2.94Å; L305-T309 WeakPolarHBondContact O-CB 3.14Å; L305-T309 PolarHBondContact O-N 2.92Å; L305-T309 PolarHBondContact O-OG1 3.17Å; L305-T309 VanDerWaalsContact O-OG1 3.13Å
306L88.2Confident84.1Confident103 Ų10346.4 Ų46.454%0.53928%0.277SS..Hα-helixtrans-61.8-45.1174-69.8173.2000111.7V302 S303 M308 T309 G310V302-L306 HydrophobicContact CG1-CD1 4.34Å; V302-L306 WeakPolarHBondContact O-CG 3.12Å; V302-L306 PolarHBondContact O-N 3.14Å; S303-L306 PolarHBondContact O-N 3.09Å; L306-M308 VanDerWaalsContact C-N 3.29Å; L306-M308 PolarHBondContact O-N 2.83Å; L306-T309 PolarHBondContact O-N 3.41Å; L306-G310 PolarHBondContact O-N 3.06Å
307D90Very high84.5Confident21 Ų2141.9 Ų41.911%0.11226%0.26CS..Hα-helixtrans-55.1-45.8173-93.60.7000110.6L238 K247 K251 S303 T311L238-D307 HydrophobicContact CD1-CB 4.48Å; L238-D307 HydrophobicContact CD2-CB 4.17Å; K247-D307 WeakPolarHBondContact CE-OD2 3.4Å; K247-D307 IonicContact NZ-OD2 2.94Å; K247-D307 PolarHBondContact NZ-OD2 3.18Å; K251-D307 WeakPolarHBondContact CE-OD1 3.29Å; K251-D307 IonicContact NZ-OD2 3.51Å; S303-D307 WeakPolarHBondContact O-CB 3.3Å; S303-D307 PolarHBondContact O-N 3.46Å; D307-T311 WeakPolarHBondContact O-CB 3.27Å; D307-T311 PolarHBondContact O-N 2.9Å; D307-T311 PolarHBondContact O-OG1 2.96Å
308M90.5Very high84.8Confident0 Ų040.4 Ų40.40%025%0.248CC..Hα-helixtrans-66.3-48.3180-178157.598.300112.3L234 W237 L238 A285 I288 L289 S304 L305 L306 T311 C312L234-M308 HydrophobicContact CD2-CB 4.3Å; L234-M308 HydrophobicContact CD2-CE 3.59Å; L234-M308 HydrophobicContact CD2-SD 3.5Å; L234-M308 VanDerWaalsContact CD2-SD 3.5Å; W237-M308 HydrophobicContact CB-SD 4.42Å; W237-M308 HydrophobicContact CD2-CG 4.18Å; W237-M308 HydrophobicContact CD2-SD 3.74Å; W237-M308 HydrophobicContact CE3-CB 4.31Å; W237-M308 HydrophobicContact CE3-CG 3.6Å; W237-M308 HydrophobicContact CE3-SD 3.61Å; W237-M308 HydrophobicContact CG-SD 4.09Å; W237-M308 HydrophobicContact CH2-CG 3.99Å; W237-M308 HydrophobicContact CZ3-CB 4.12Å; W237-M308 HydrophobicContact CZ3-CG 3.5Å; W237-M308 VanDerWaalsContact CZ3-CG 3.5Å; W237-M308 HydrophobicContact CZ3-SD 4.15Å; L238-M308 HydrophobicContact CD2-CB 4.21Å; A285-M308 HydrophobicContact CB-CE 3.92Å; A285-M308 HydrophobicContact CB-CG 4.04Å; A285-M308 HydrophobicContact CB-SD 3.97Å; A285-M308 VanDerWaalsContact O-CE 3.31Å; A285-M308 WeakPolarHBondContact O-CE 3.5Å; I288-M308 HydrophobicContact CB-CE 3.93Å; I288-M308 HydrophobicContact CG2-CE 3.85Å; L289-M308 HydrophobicContact CD1-CE 4.11Å; L289-M308 HydrophobicContact CD2-CE 3.53Å; L289-M308 HydrophobicContact CG-CE 3.41Å; L289-M308 VanDerWaalsContact CG-CE 3.41Å; S304-M308 WeakPolarHBondContact O-CB 3.38Å; S304-M308 PolarHBondContact O-N 3.34Å; L305-M308 PolarHBondContact O-N 2.94Å; L306-M308 VanDerWaalsContact C-N 3.29Å; L306-M308 PolarHBondContact O-N 2.83Å; M308-T311 PolarHBondContact O-N 3.4Å; M308-C312 WeakPolarHBondContact O-CB 3.45Å; M308-C312 PolarHBondContact O-N 3.33Å; M308-C312 PolarHBondContact O-SG 3.36Å
309T87.1Confident84.8Confident39 Ų3933 Ų3324%0.23922%0.223CC..Hα-helixtrans-60.2-50.2178.7-63.40000111.2F184 L305 L306 T311 C312 L313F184-T309 HydrophobicContact CD1-CG2 4.3Å; F184-T309 HydrophobicContact CE1-CG2 3.74Å; F184-T309 HydrophobicContact CZ-CG2 4.31Å; L305-T309 WeakPolarHBondContact O-CB 3.14Å; L305-T309 PolarHBondContact O-N 2.92Å; L305-T309 PolarHBondContact O-OG1 3.17Å; L305-T309 VanDerWaalsContact O-OG1 3.13Å; L306-T309 PolarHBondContact O-N 3.41Å; T309-T311 VanDerWaalsContact C-N 3.35Å; T309-T311 PolarHBondContact O-N 3.21Å; T309-C312 WeakPolarHBondContact O-CB 3.44Å; T309-C312 PolarHBondContact O-N 3.15Å; T309-L313 HydrophobicContact CG2-CD1 4.28Å; T309-L313 WeakPolarHBondContact O-CG 3.49Å; T309-L313 PolarHBondContact O-N 3.43Å
310G86Confident84.6Confident9 Ų931.5 Ų31.59%0.09320%0.199CC..Hα-helixtrans-61.5-41.8177.600000112.8L306 C312 L313 M314L306-G310 PolarHBondContact O-N 3.06Å; G310-C312 VanDerWaalsContact C-N 3.35Å; G310-C312 PolarHBondContact O-N 3.09Å; G310-L313 PolarHBondContact O-N 3.06Å; G310-M314 WeakPolarHBondContact O-CB 3.49Å; G310-M314 PolarHBondContact O-N 2.87Å
311T89Confident84.2Confident0 Ų030.2 Ų30.20%019%0.185CC..Hα-helixtrans-63.1-40174.9-59.30000112.1W237 I243 F246 K247 D307 M308 T309 M314 A315W237-T311 HydrophobicContact CH2-CG2 3.94Å; W237-T311 HydrophobicContact CZ3-CG2 4.09Å; I243-T311 HydrophobicContact CG2-CG2 3.46Å; I243-T311 VanDerWaalsContact CG2-CG2 3.46Å; F246-T311 HydrophobicContact CB-CG2 3.79Å; K247-T311 WeakPolarHBondContact CA-OG1 3.27Å; K247-T311 HydrophobicContact CB-CG2 3.98Å; K247-T311 WeakPolarHBondContact CB-OG1 3.22Å; D307-T311 WeakPolarHBondContact O-CB 3.27Å; D307-T311 PolarHBondContact O-N 2.9Å; D307-T311 PolarHBondContact O-OG1 2.96Å; M308-T311 PolarHBondContact O-N 3.4Å; T309-T311 VanDerWaalsContact C-N 3.35Å; T309-T311 PolarHBondContact O-N 3.21Å; T311-M314 PolarHBondContact O-N 3.15Å; T311-A315 WeakPolarHBondContact O-CB 3.33Å; T311-A315 PolarHBondContact O-N 2.89Å
312C87Confident83.6Confident0 Ų030.1 Ų30.10%019%0.185CC..Hα-helixtrans-64.9-44.6177.4-74.10000112.3F184 W237 T282 A285 M308 T309 G310 M314 A315 A316F184-C312 HydrophobicContact CE2-CB 4.45Å; F184-C312 HydrophobicContact CZ-CB 3.91Å; W237-C312 WeakPolarHBondContact CH2-SG 3.37Å; W237-C312 WeakPolarHBondContact CZ2-SG 3.41Å; T282-C312 HydrophobicContact CG2-CB 4.16Å; A285-C312 WeakPolarHBondContact CB-SG 3.32Å; M308-C312 WeakPolarHBondContact O-CB 3.45Å; M308-C312 PolarHBondContact O-N 3.33Å; M308-C312 PolarHBondContact O-SG 3.36Å; T309-C312 WeakPolarHBondContact O-CB 3.44Å; T309-C312 PolarHBondContact O-N 3.15Å; G310-C312 VanDerWaalsContact C-N 3.35Å; G310-C312 PolarHBondContact O-N 3.09Å; C312-M314 VanDerWaalsContact C-N 3.33Å; C312-A315 PolarHBondContact O-N 3.01Å; C312-A316 WeakPolarHBondContact O-CB 3.14Å; C312-A316 PolarHBondContact O-N 2.92Å
313L82.6Confident82.8Confident88 Ų8830.9 Ų30.946%0.46119%0.186SC..Hα-helixtrans-62.9-42.3176.2-69.3172.5000111F184 T309 G310 A316 G317F184-L313 HydrophobicContact CD2-CD2 3.82Å; F184-L313 HydrophobicContact CE2-CD2 3.69Å; F184-L313 HydrophobicContact CE2-CG 4.17Å; F184-L313 HydrophobicContact CZ-CD2 4.44Å; F184-L313 HydrophobicContact CZ-CG 4.47Å; T309-L313 HydrophobicContact CG2-CD1 4.28Å; T309-L313 WeakPolarHBondContact O-CG 3.49Å; T309-L313 PolarHBondContact O-N 3.43Å; G310-L313 PolarHBondContact O-N 3.06Å; L313-A316 PolarHBondContact O-N 3.05Å; L313-G317 PolarHBondContact O-N 3.48Å
314M84.5Confident81.7Confident21 Ų2130.6 Ų30.610%0.10318%0.176CC..Hα-helixtrans-61.1-47.2175.1-172.659.476.100111.7F246 L249 V254 F261 G310 T311 C312 A316 G317 C318F246-M314 HydrophobicContact CB-CG 4.41Å; L249-M314 HydrophobicContact CB-CG 3.97Å; L249-M314 HydrophobicContact CB-SD 4.37Å; V254-M314 HydrophobicContact CG2-CE 3.92Å; F261-M314 HydrophobicContact CD2-CE 4.43Å; F261-M314 HydrophobicContact CE2-CE 3.69Å; F261-M314 HydrophobicContact CE2-SD 3.38Å; F261-M314 WeakPolarHBondContact CE2-SD 3.47Å; F261-M314 HydrophobicContact CZ-CE 4.47Å; F261-M314 HydrophobicContact CZ-SD 3.6Å; F261-M314 VanDerWaalsContact CZ-SD 3.6Å; G310-M314 WeakPolarHBondContact O-CB 3.49Å; G310-M314 PolarHBondContact O-N 2.87Å; T311-M314 PolarHBondContact O-N 3.15Å; C312-M314 VanDerWaalsContact C-N 3.33Å; M314-A316 PolarHBondContact O-N 3.18Å; M314-G317 PolarHBondContact O-N 3.3Å; M314-C318 WeakPolarHBondContact O-CB 3.05Å; M314-C318 PolarHBondContact O-N 2.85Å; M314-C318 PolarHBondContact O-SG 3.24Å; M314-C318 VanDerWaalsContact O-SG 3.34Å
315A85.2Confident80.4Confident0 Ų031.2 Ų31.20%018%0.18CC..Hα-helixtrans-61.9-43.2177.900000112.2F246 I278 T311 C312 A319F246-A315 HydrophobicContact CB-CB 4.14Å; F246-A315 HydrophobicContact CD1-CB 4.15Å; F246-A315 HydrophobicContact CD2-CB 3.59Å; F246-A315 HydrophobicContact CE2-CB 3.99Å; F246-A315 HydrophobicContact CG-CB 3.7Å; F246-A315 HydrophobicContact CZ-CB 4.43Å; I278-A315 HydrophobicContact CG2-CB 3.94Å; T311-A315 WeakPolarHBondContact O-CB 3.33Å; T311-A315 PolarHBondContact O-N 2.89Å; C312-A315 PolarHBondContact O-N 3.01Å; A315-A319 VanDerWaalsContact O-CB 3.32Å; A315-A319 WeakPolarHBondContact O-CB 3.3Å; A315-A319 PolarHBondContact O-N 3.34Å
316A79.8Confident78.7Confident20 Ų2035.7 Ų35.717%0.16521%0.211CC..Hα-helixtrans-65.3-44176.900000111.9V180 C312 L313 M314 A319 M320V180-A316 HydrophobicContact CG1-CB 4.17Å; V180-A316 HydrophobicContact CG2-CB 4.42Å; C312-A316 WeakPolarHBondContact O-CB 3.14Å; C312-A316 PolarHBondContact O-N 2.92Å; L313-A316 PolarHBondContact O-N 3.05Å; M314-A316 PolarHBondContact O-N 3.18Å; A316-A319 PolarHBondContact O-N 2.92Å; A316-M320 WeakPolarHBondContact O-CG 3.45Å; A316-M320 PolarHBondContact O-N 2.83Å
317G78.4Confident77Confident32 Ų3234.8 Ų34.833%0.3320%0.203SC..Hα-helixtrans-60.3-48.6175.800000112.1L313 M314 A319 M320 I321L313-G317 PolarHBondContact O-N 3.48Å; M314-G317 PolarHBondContact O-N 3.3Å; G317-A319 VanDerWaalsContact C-N 3.33Å; G317-A319 PolarHBondContact O-N 2.96Å; G317-M320 PolarHBondContact O-N 3.17Å; G317-I321 VanDerWaalsContact O-CG1 3.26Å; G317-I321 WeakPolarHBondContact O-CG1 3.17Å; G317-I321 PolarHBondContact O-N 3.25Å
318C79.6Confident75.2Confident5 Ų541 Ų413%0.03424%0.236CC..Hα-helixtrans-60.2-41.4175.1-70.40000112.2F246 V271 M314 I321 A322F246-C318 HydrophobicContact CD1-CB 4.42Å; F246-C318 HydrophobicContact CE1-CB 3.87Å; V271-C318 HydrophobicContact CG1-CB 4.45Å; V271-C318 HydrophobicContact CG2-CB 4.22Å; M314-C318 WeakPolarHBondContact O-CB 3.05Å; M314-C318 PolarHBondContact O-N 2.85Å; M314-C318 PolarHBondContact O-SG 3.24Å; M314-C318 VanDerWaalsContact O-SG 3.34Å; C318-I321 PolarHBondContact O-N 3.44Å; C318-A322 WeakPolarHBondContact O-CB 3.37Å; C318-A322 PolarHBondContact O-N 2.89Å
319A76.9Confident73.2Confident12 Ų1248.3 Ų48.310%0.09926%0.264CS..Hα-helixtrans-63.3-42.8177.400000112.1V271 A315 A316 G317 A322 I323V271-A319 HydrophobicContact CG1-CB 4.16Å; A315-A319 VanDerWaalsContact O-CB 3.32Å; A315-A319 WeakPolarHBondContact O-CB 3.3Å; A315-A319 PolarHBondContact O-N 3.34Å; A316-A319 PolarHBondContact O-N 2.92Å; G317-A319 VanDerWaalsContact C-N 3.33Å; G317-A319 PolarHBondContact O-N 2.96Å; A319-A322 WeakPolarHBondContact O-CB 3.26Å; A319-A322 PolarHBondContact O-N 3.35Å; A319-I323 WeakPolarHBondContact O-CD1 3.29Å; A319-I323 VanDerWaalsContact O-CG1 3.32Å; A319-I323 WeakPolarHBondContact O-CG1 3.38Å; A319-I323 PolarHBondContact O-N 3.36Å
320M73.1Confident71.6Confident30 Ų3054.7 Ų54.715%0.14828%0.283CS..Hα-helixtrans-60.7-49.4175.1-74.8-64.4-63.700111.5V177 A316 G317 A322 I323 Y324 A353V177-M320 HydrophobicContact CG2-CE 3.27Å; V177-M320 HydrophobicContact CG2-CG 4.16Å; V177-M320 HydrophobicContact CG2-SD 3.43Å; V177-M320 WeakPolarHBondContact CG2-SD 3.45Å; A316-M320 WeakPolarHBondContact O-CG 3.45Å; A316-M320 PolarHBondContact O-N 2.83Å; G317-M320 PolarHBondContact O-N 3.17Å; M320-A322 VanDerWaalsContact C-N 3.26Å; M320-A322 PolarHBondContact O-N 2.96Å; M320-I323 PolarHBondContact O-N 3.47Å; M320-Y324 HydrophobicContact CE-CD2 3.49Å; M320-Y324 VanDerWaalsContact CE-CD2 3.49Å; M320-Y324 HydrophobicContact CE-CE2 3.26Å; M320-Y324 VanDerWaalsContact O-CD2 3.26Å; M320-Y324 WeakPolarHBondContact O-CD2 3.44Å; M320-Y324 PolarHBondContact O-N 2.93Å; M320-Y324 HydrophobicContact SD-CD2 4.09Å; M320-Y324 HydrophobicContact SD-CE2 3.66Å; M320-A353 HydrophobicContact CE-CB 4.48Å
321I72.7Confident70Confident49 Ų4960 Ų6025%0.25132%0.316SS..Hα-helixtrans-59.3-42.1178.5-69.6169000111F261 Y268 G317 C318 I323 S325 F338F261-I321 HydrophobicContact CE1-CD1 4.4Å; Y268-I321 HydrophobicContact CE2-CG2 4.19Å; G317-I321 VanDerWaalsContact O-CG1 3.26Å; G317-I321 WeakPolarHBondContact O-CG1 3.17Å; G317-I321 PolarHBondContact O-N 3.25Å; C318-I321 PolarHBondContact O-N 3.44Å; I321-I323 VanDerWaalsContact C-N 3.3Å; I321-I323 PolarHBondContact O-N 2.59Å; I321-S325 WeakPolarHBondContact O-CB 3.34Å; I321-S325 PolarHBondContact O-N 3.33Å; I321-F338 HydrophobicContact CB-CE1 4.47Å; I321-F338 HydrophobicContact CB-CZ 4.5Å; I321-F338 HydrophobicContact CD1-CD1 4.48Å; I321-F338 HydrophobicContact CD1-CG 4.48Å; I321-F338 HydrophobicContact CG2-CD1 3.92Å; I321-F338 HydrophobicContact CG2-CE1 3.09Å; I321-F338 HydrophobicContact CG2-CE2 4.02Å; I321-F338 HydrophobicContact CG2-CZ 3.16Å
322A72.4Confident68.5Low5 Ų567.4 Ų67.44%0.04136%0.356CS..Hα-helixtrans-63.6-30.8178.500000114.3Y268 V271 Q272 C318 A319 M320Y268-A322 HydrophobicContact CD2-CB 4.34Å; Y268-A322 VanDerWaalsContact CE2-CA 3.45Å; Y268-A322 HydrophobicContact CE2-CB 4.01Å; Y268-A322 PolarHBondContact OH-O 2.85Å; V271-A322 HydrophobicContact CB-CB 4.29Å; V271-A322 HydrophobicContact CG1-CB 3.76Å; Q272-A322 HydrophobicContact CG-CB 3.65Å; Q272-A322 PolarHBondContact NE2-O 3.49Å; C318-A322 WeakPolarHBondContact O-CB 3.37Å; C318-A322 PolarHBondContact O-N 2.89Å; A319-A322 WeakPolarHBondContact O-CB 3.26Å; A319-A322 PolarHBondContact O-N 3.35Å; M320-A322 VanDerWaalsContact C-N 3.26Å; M320-A322 PolarHBondContact O-N 2.96Å
323I70Confident67.2Low82 Ų8272.8 Ų72.842%0.42138%0.381SS..Hα-helixtrans-84.4-44.7178-68.3163.2000111.3L176 C275 A319 M320 I321L176-I323 HydrophobicContact CD1-CD1 4.18Å; C275-I323 VanDerWaalsContact SG-CD1 3.59Å; A319-I323 WeakPolarHBondContact O-CD1 3.29Å; A319-I323 VanDerWaalsContact O-CG1 3.32Å; A319-I323 WeakPolarHBondContact O-CG1 3.38Å; A319-I323 PolarHBondContact O-N 3.36Å; M320-I323 PolarHBondContact O-N 3.47Å; I321-I323 VanDerWaalsContact C-N 3.3Å; I321-I323 PolarHBondContact O-N 2.59Å
324Y64.1Low66.1Low60 Ų6073 Ų7324%0.23539%0.389CS..Hα-helixtrans-99.8-13.8-165.8-69.5-75.3000115.4E173 M320 P326 A353E173-Y324 VanDerWaalsContact C-OH 3.24Å; E173-Y324 VanDerWaalsContact CA-OH 3.25Å; E173-Y324 WeakPolarHBondContact CA-OH 3.38Å; E173-Y324 HydrophobicContact CB-CE1 4.42Å; E173-Y324 WeakPolarHBondContact CB-OH 3.36Å; E173-Y324 PolarHBondContact O-OH 3.09Å; M320-Y324 HydrophobicContact CE-CD2 3.49Å; M320-Y324 VanDerWaalsContact CE-CD2 3.49Å; M320-Y324 HydrophobicContact CE-CE2 3.26Å; M320-Y324 VanDerWaalsContact O-CD2 3.26Å; M320-Y324 WeakPolarHBondContact O-CD2 3.44Å; M320-Y324 PolarHBondContact O-N 2.93Å; M320-Y324 HydrophobicContact SD-CD2 4.09Å; M320-Y324 HydrophobicContact SD-CE2 3.66Å; Y324-P326 WeakPolarHBondContact O-CD 3.3Å; Y324-A353 HydrophobicContact CE1-CB 4.04Å; Y324-A353 HydrophobicContact CE2-CB 4.26Å; Y324-A353 WeakPolarHBondContact OH-CB 3.41Å
325S61.6Low64.7Low52 Ų5274.2 Ų74.236%0.36440%0.4SS..SBendtrans-85.4117.2177.8-166.20000110.1I321 F327I321-S325 WeakPolarHBondContact O-CB 3.34Å; I321-S325 PolarHBondContact O-N 3.33Å; S325-F327 VanDerWaalsContact C-N 3.32Å; S325-F327 PolarHBondContact O-N 2.87Å
326P53.9Low63.2Low122 Ų12275.3 Ų75.379%0.79241%0.405SS*.  trans-66.194.5172.226.5-31.5000108.8Y324 N328Y324-P326 WeakPolarHBondContact O-CD 3.3Å; P326-N328 PolarHBondContact O-N 2.73Å
327F53Low61.9Low83 Ų8378.9 Ų78.936%0.36443%0.428SS..  trans-72.1110178.3-175.9-109.2000109.7Y268 S325 R329 I336Y268-F327 HydrophobicContact CE1-CB 4.32Å; Y268-F327 HydrophobicContact CE1-CD2 4.34Å; Y268-F327 HydrophobicContact CE1-CG 4.25Å; S325-F327 VanDerWaalsContact C-N 3.32Å; S325-F327 PolarHBondContact O-N 2.87Å; F327-R329 HydrophobicContact CD1-CB 4.06Å; F327-R329 HydrophobicContact CE1-CB 3.35Å; F327-R329 HydrophobicContact CE1-CG 3.62Å; F327-R329 HydrophobicContact CZ-CB 3.84Å; F327-R329 HydrophobicContact CZ-CG 3.79Å; F327-I336 HydrophobicContact CD2-CD1 4.05Å; F327-I336 HydrophobicContact CE2-CD1 3.69Å; F327-I336 HydrophobicContact CE2-CG1 4.1Å
328N51.4Low60.7Low152 Ų15279.8 Ų79.881%0.81342%0.423SS*.  trans-102.493.7165.9-153.58000107.3P326 R330P326-N328 PolarHBondContact O-N 2.73Å; N328-R330 PolarHBondContact O-N 3.19Å
329R48.7Very low59.1Low154 Ų15484.3 Ų84.358%0.58145%0.454SS*.  trans-54.8110.7-178.7-164.2177-172.5142.55.5109.3E269 F327E269-R329 IonicContact OE1-CZ 2.91Å; E269-R329 IonicContact OE1-NH1 2.87Å; E269-R329 PolarHBondContact OE1-NH1 3.13Å; E269-R329 IonicContact OE1-NH2 3.95Å; F327-R329 HydrophobicContact CD1-CB 4.06Å; F327-R329 HydrophobicContact CE1-CB 3.35Å; F327-R329 HydrophobicContact CE1-CG 3.62Å; F327-R329 HydrophobicContact CZ-CB 3.84Å; F327-R329 HydrophobicContact CZ-CG 3.79Å
330R53.7Low57.6Low172 Ų17289.4 Ų89.465%0.64949%0.49SS*.  trans-79.1133.2161.5-74.9-177.7178.2167.5-0.7107.8N328 D332 E333N328-R330 PolarHBondContact O-N 3.19Å; R330-D332 PolarHBondContact O-N 3.35Å; R330-D332 VanDerWaalsContact O-N 3.08Å; R330-E333 IonicContact NH1-OE1 3.7Å; R330-E333 PolarHBondContact O-N 2.87Å
331P53.5Low56.3Low121 Ų12191.4 Ų91.479%0.78651%0.505SS*.THydrogen-bonded Turntrans-61.6-18.9-172.420.1-30.5000114.6
332D57Low55Low155 Ų15592 Ų9283%0.82951%0.514SS*.THydrogen-bonded Turntrans-105.52.5-171.6-63.4-30.4000115.3R330R330-D332 PolarHBondContact O-N 3.35Å; R330-D332 VanDerWaalsContact O-N 3.08Å
333E58.8Low53.8Low114 Ų11495 Ų9553%0.53354%0.538SS..  trans-98.1118.7-177.8-73176.7-169.300111.8R330R330-E333 IonicContact NH1-OE1 3.7Å; R330-E333 PolarHBondContact O-N 2.87Å
334S59.8Low52.6Low91 Ų9195.5 Ų95.564%0.63655%0.547SS*.SBendtrans-83.9-11.4175.355.10000113.9
335C54.9Low51.8Low48 Ų4894.9 Ų94.932%0.32455%0.552SS.*EExtended strand (participates in β ladder)trans-142.4145.6-172.6-68.30000110.4I262I262-C335 HydrophobicContact CG2-CB 3.68Å
336I54.5Low51.1Low22 Ų2295.6 Ų95.611%0.11355%0.554CS.*EExtended strand (participates in β ladder)trans-96.1110.9170.9-49.9178.7000107.9V263 V265 Y268 F327 F338V263-I336 PolarHBondContact N-O 3.34Å; V263-I336 PolarHBondContact O-N 3.27Å; V263-I336 VanDerWaalsContact O-N 3.11Å; V265-I336 HydrophobicContact CG2-CG1 3.9Å; Y268-I336 HydrophobicContact CD1-CD1 3.75Å; Y268-I336 HydrophobicContact CD2-CD1 3.63Å; Y268-I336 HydrophobicContact CE1-CD1 4.28Å; Y268-I336 HydrophobicContact CE2-CD1 4.14Å; Y268-I336 HydrophobicContact CG-CD1 3.4Å; Y268-I336 VanDerWaalsContact CG-CD1 3.4Å; F327-I336 HydrophobicContact CD2-CD1 4.05Å; F327-I336 HydrophobicContact CE2-CD1 3.69Å; F327-I336 HydrophobicContact CE2-CG1 4.1Å; I336-F338 HydrophobicContact CB-CE2 4.06Å; I336-F338 HydrophobicContact CB-CZ 3.95Å; I336-F338 HydrophobicContact CG2-CD1 4.32Å; I336-F338 HydrophobicContact CG2-CD2 4.42Å; I336-F338 HydrophobicContact CG2-CE1 3.6Å; I336-F338 HydrophobicContact CG2-CE2 3.75Å; I336-F338 HydrophobicContact CG2-CZ 3.26Å
337C52.1Low51Low95 Ų9593.9 Ų93.964%0.64254%0.541SS*.EExtended strand (participates in β ladder)trans-86.6112.8171.6-72.20000109S339C337-S339 PolarHBondContact O-N 2.91Å
338F53Low50.7Low52 Ų5294.4 Ų94.423%0.22855%0.548CS..  trans-85.6111.2167.3-59.9-73.5000107.7F261 V263 I321 I336F261-F338 HydrophobicContact CD1-CB 4.32Å; F261-F338 AromaticContact CD1-CD2 3.81Å; F261-F338 HydrophobicContact CD1-CD2 3.81Å; F261-F338 HydrophobicContact CD1-CG 4.44Å; F261-F338 AromaticContact CE1-CD2 3.91Å; F261-F338 HydrophobicContact CE1-CD2 3.91Å; F261-F338 HydrophobicContact CE1-CE2 4.44Å; V263-F338 HydrophobicContact CB-CE2 3.98Å; V263-F338 HydrophobicContact CG2-CD2 4.24Å; V263-F338 HydrophobicContact CG2-CE2 3.81Å; I321-F338 HydrophobicContact CB-CE1 4.47Å; I321-F338 HydrophobicContact CB-CZ 4.5Å; I321-F338 HydrophobicContact CD1-CD1 4.48Å; I321-F338 HydrophobicContact CD1-CG 4.48Å; I321-F338 HydrophobicContact CG2-CD1 3.92Å; I321-F338 HydrophobicContact CG2-CE1 3.09Å; I321-F338 HydrophobicContact CG2-CE2 4.02Å; I321-F338 HydrophobicContact CG2-CZ 3.16Å; I336-F338 HydrophobicContact CB-CE2 4.06Å; I336-F338 HydrophobicContact CB-CZ 3.95Å; I336-F338 HydrophobicContact CG2-CD1 4.32Å; I336-F338 HydrophobicContact CG2-CD2 4.42Å; I336-F338 HydrophobicContact CG2-CE1 3.6Å; I336-F338 HydrophobicContact CG2-CE2 3.75Å; I336-F338 HydrophobicContact CG2-CZ 3.26Å
339S45.7Very low50.7Low99 Ų9990.5 Ų90.569%0.69253%0.526SS*.  trans-60142.5165.755.90000108.6C337 C341C337-S339 PolarHBondContact O-N 2.91Å; S339-C341 PolarHBondContact O-N 3.23Å
340S46.1Very low50.6Low120 Ų12084.9 Ų84.984%0.83951%0.507SS*.  trans-46.6109.4172.841.60000109.8S342S340-S342 PolarHBondContact O-N 3Å
341C44.6Very low50.3Low71 Ų7178 Ų7848%0.4849%0.49SS..  trans-73.4126.6170.8-85.30000106.9S339 V346S339-C341 PolarHBondContact O-N 3.23Å; C341-V346 HydrophobicContact CB-CG2 3.84Å
342S47.1Very low50.1Low63 Ų6378.4 Ų78.444%0.44148%0.479SS..  trans-57.6146.9169.265.40000109S340 P344 S345 V346S340-S342 PolarHBondContact O-N 3Å; S342-P344 VanDerWaalsContact O-N 3.13Å; S342-S345 WeakPolarHBondContact O-CA 3.43Å; S342-S345 VanDerWaalsContact O-CB 3.29Å; S342-S345 WeakPolarHBondContact O-CB 3.05Å; S342-S345 PolarHBondContact O-N 3.29Å; S342-S345 PolarHBondContact OG-OG 3.43Å; S342-V346 PolarHBondContact O-N 2.67Å
343A45.5Very low49.6Very low66 Ų6671.1 Ų71.155%0.54544%0.441SS..Hα-helixtrans-48-40176.300000112.9S345 V346 V347A343-S345 VanDerWaalsContact C-N 3.29Å; A343-S345 PolarHBondContact O-N 2.77Å; A343-V346 PolarHBondContact O-N 3.48Å; A343-V347 WeakPolarHBondContact O-CG2 3.46Å; A343-V347 PolarHBondContact O-N 3.38Å
344P44.7Very low48.9Very low93 Ų9369.8 Ų69.860%0.60444%0.44SS*.Hα-helixtrans-58.2-35.1172.1-2635000114.6S342 N348S342-P344 VanDerWaalsContact O-N 3.13Å; P344-N348 VanDerWaalsContact O-CB 3.25Å; P344-N348 WeakPolarHBondContact O-CB 3.43Å; P344-N348 PolarHBondContact O-N 3.36Å
345S47.8Very low48.2Very low48 Ų4869.4 Ų69.434%0.33644%0.438SS..Hα-helixtrans-70.4-40.5178.2-55.40000111.4S342 A343 N348 I349S342-S345 WeakPolarHBondContact O-CA 3.43Å; S342-S345 VanDerWaalsContact O-CB 3.29Å; S342-S345 WeakPolarHBondContact O-CB 3.05Å; S342-S345 PolarHBondContact O-N 3.29Å; S342-S345 PolarHBondContact OG-OG 3.43Å; A343-S345 VanDerWaalsContact C-N 3.29Å; A343-S345 PolarHBondContact O-N 2.77Å; S345-N348 PolarHBondContact O-N 3.32Å; S345-I349 VanDerWaalsContact O-CG1 3.3Å; S345-I349 WeakPolarHBondContact O-CG1 3.39Å; S345-I349 PolarHBondContact O-N 3.15Å
346V47.8Very low47.2Very low66 Ų6669.8 Ų69.840%0.444%0.441SS..Hα-helixtrans-63.9-47173.6-179.90000110.2C341 S342 A343 N348 I349 I350C341-V346 HydrophobicContact CB-CG2 3.84Å; S342-V346 PolarHBondContact O-N 2.67Å; A343-V346 PolarHBondContact O-N 3.48Å; V346-N348 VanDerWaalsContact C-N 3.26Å; V346-N348 PolarHBondContact O-N 3.39Å; V346-I349 PolarHBondContact O-N 3.01Å; V346-I349 VanDerWaalsContact O-N 3.14Å; V346-I350 HydrophobicContact CG1-CD1 3.87Å; V346-I350 HydrophobicContact CG1-CG1 4.41Å; V346-I350 VanDerWaalsContact O-CG1 3.3Å; V346-I350 WeakPolarHBondContact O-CG1 3.44Å; V346-I350 PolarHBondContact O-N 2.87Å
347V50.5Low46.5Very low86 Ų8673 Ų7352%0.52146%0.463SS..Hα-helixtrans-60-36.2174.9173.30000111.3A343 G351A343-V347 WeakPolarHBondContact O-CG2 3.46Å; A343-V347 PolarHBondContact O-N 3.38Å; V347-G351 WeakPolarHBondContact O-CA 3.46Å; V347-G351 PolarHBondContact O-N 2.96Å
348N48.3Very low45.9Very low95 Ų9573.3 Ų73.351%0.50847%0.473SS..Hα-helixtrans-72.3-35.9175.8-165.16.6000112.2P344 S345 V346 G351 K352P344-N348 VanDerWaalsContact O-CB 3.25Å; P344-N348 WeakPolarHBondContact O-CB 3.43Å; P344-N348 PolarHBondContact O-N 3.36Å; S345-N348 PolarHBondContact O-N 3.32Å; V346-N348 VanDerWaalsContact C-N 3.26Å; V346-N348 PolarHBondContact O-N 3.39Å; N348-G351 CarbonylContact O-C 3.45Å; N348-G351 PolarHBondContact O-N 2.91Å; N348-K352 WeakPolarHBondContact O-CB 3.23Å; N348-K352 VanDerWaalsContact O-CG 3.3Å; N348-K352 WeakPolarHBondContact O-CG 3.43Å; N348-K352 PolarHBondContact O-N 3.29Å
349I50.1Low45Very low69 Ų6982.1 Ų82.135%0.35450%0.504SS..Hα-helixtrans-65.1-47.6173-68.6163.3000110.1S345 V346 G351 K352 A353S345-I349 VanDerWaalsContact O-CG1 3.3Å; S345-I349 WeakPolarHBondContact O-CG1 3.39Å; S345-I349 PolarHBondContact O-N 3.15Å; V346-I349 PolarHBondContact O-N 3.01Å; V346-I349 VanDerWaalsContact O-N 3.14Å; I349-G351 VanDerWaalsContact C-N 3.3Å; I349-G351 PolarHBondContact O-N 3.46Å; I349-K352 PolarHBondContact O-N 3.5Å; I349-A353 PolarHBondContact O-N 3.36Å
350I47.3Very low44.2Very low36 Ų3686.2 Ų86.219%0.18552%0.515CS..Hα-helixtrans-60.4-44.8174-64.6171.1000109.6V177 V346 K352 A353 V354 L370V177-I350 HydrophobicContact CG1-CD1 4.17Å; V177-I350 HydrophobicContact CG1-CG1 4.14Å; V177-I350 HydrophobicContact CG1-CG2 4.03Å; V346-I350 HydrophobicContact CG1-CD1 3.87Å; V346-I350 HydrophobicContact CG1-CG1 4.41Å; V346-I350 VanDerWaalsContact O-CG1 3.3Å; V346-I350 WeakPolarHBondContact O-CG1 3.44Å; V346-I350 PolarHBondContact O-N 2.87Å; I350-K352 VanDerWaalsContact C-N 3.35Å; I350-K352 PolarHBondContact O-N 3.38Å; I350-A353 WeakPolarHBondContact O-CB 3.5Å; I350-A353 PolarHBondContact O-N 2.9Å; I350-V354 HydrophobicContact CG2-CG2 4.38Å; I350-V354 VanDerWaalsContact O-CG2 3.29Å; I350-V354 WeakPolarHBondContact O-CG2 3.41Å; I350-V354 PolarHBondContact O-N 3.31Å; I350-L370 HydrophobicContact CD1-CD1 4.17Å
351G47Very low43.4Very low29 Ų2984.1 Ų84.130%0.29951%0.512SS..Hα-helixtrans-60.8-40.817800000112.3V347 N348 I349 V354 S355V347-G351 WeakPolarHBondContact O-CA 3.46Å; V347-G351 PolarHBondContact O-N 2.96Å; N348-G351 CarbonylContact O-C 3.45Å; N348-G351 PolarHBondContact O-N 2.91Å; I349-G351 VanDerWaalsContact C-N 3.3Å; I349-G351 PolarHBondContact O-N 3.46Å; G351-V354 PolarHBondContact O-N 3.32Å; G351-S355 WeakPolarHBondContact O-CA 3.45Å; G351-S355 WeakPolarHBondContact O-CB 3.3Å; G351-S355 PolarHBondContact O-N 3.11Å; G351-S355 PolarHBondContact O-OG 3.29Å
352K49.8Very low42.7Very low129 Ų12988.6 Ų88.656%0.56153%0.531SS*.Hα-helixtrans-65.8-41.9172.8-79179.5179.8-175.70112.2N348 I349 I350 V354 S355 S356N348-K352 WeakPolarHBondContact O-CB 3.23Å; N348-K352 VanDerWaalsContact O-CG 3.3Å; N348-K352 WeakPolarHBondContact O-CG 3.43Å; N348-K352 PolarHBondContact O-N 3.29Å; I349-K352 PolarHBondContact O-N 3.5Å; I350-K352 VanDerWaalsContact C-N 3.35Å; I350-K352 PolarHBondContact O-N 3.38Å; K352-V354 VanDerWaalsContact C-N 3.28Å; K352-V354 PolarHBondContact O-N 2.94Å; K352-S355 WeakPolarHBondContact CA-OG 3.49Å; K352-S355 CarbonylContact O-C 3.28Å; K352-S355 PolarHBondContact O-N 3.01Å; K352-S356 VanDerWaalsContact O-CB 3.32Å; K352-S356 WeakPolarHBondContact O-CB 3.47Å; K352-S356 PolarHBondContact O-N 3.39Å
353A45.5Very low41.9Very low2 Ų290.9 Ų90.92%0.01755%0.547CS..Hα-helixtrans-61.1-39.2174.800000111.4E173 G174 M320 Y324 I349 I350E173-A353 CarbonylContact C-O 3.6Å; E173-A353 VanDerWaalsContact C-O 3.28Å; E173-A353 VanDerWaalsContact CB-O 3.32Å; E173-A353 WeakPolarHBondContact CB-O 3.27Å; G174-A353 WeakPolarHBondContact CA-O 3.49Å; G174-A353 PolarHBondContact N-O 3.38Å; M320-A353 HydrophobicContact CE-CB 4.48Å; Y324-A353 HydrophobicContact CE1-CB 4.04Å; Y324-A353 HydrophobicContact CE2-CB 4.26Å; Y324-A353 WeakPolarHBondContact OH-CB 3.41Å; I349-A353 PolarHBondContact O-N 3.36Å; I350-A353 WeakPolarHBondContact O-CB 3.5Å; I350-A353 PolarHBondContact O-N 2.9Å
354V45.8Very low41.1Very low86 Ų8695 Ų9552%0.52156%0.56SS.*Hα-helixtrans-75.1-37.6175.9175.80000112.3I350 G351 K352I350-V354 HydrophobicContact CG2-CG2 4.38Å; I350-V354 VanDerWaalsContact O-CG2 3.29Å; I350-V354 WeakPolarHBondContact O-CG2 3.41Å; I350-V354 PolarHBondContact O-N 3.31Å; G351-V354 PolarHBondContact O-N 3.32Å; K352-V354 VanDerWaalsContact C-N 3.28Å; K352-V354 PolarHBondContact O-N 2.94Å
355S43Very low40.5Very low83 Ų8396.1 Ų96.158%0.5857%0.565SS**Hα-helixtrans-929.8-175.162.80000114.8G351 K352 P357G351-S355 WeakPolarHBondContact O-CA 3.45Å; G351-S355 WeakPolarHBondContact O-CB 3.3Å; G351-S355 PolarHBondContact O-N 3.11Å; G351-S355 PolarHBondContact O-OG 3.29Å; K352-S355 WeakPolarHBondContact CA-OG 3.49Å; K352-S355 CarbonylContact O-C 3.28Å; K352-S355 PolarHBondContact O-N 3.01Å; S355-P357 WeakPolarHBondContact O-CD 3.44Å
356S35.1Very low39.5Very low56 Ų56100.3 Ų100.339%0.39258%0.583SS.*  trans-99.667.8164-1700000110E173 K352 A358E173-S356 WeakPolarHBondContact OE2-CB 3.29Å; E173-S356 PolarHBondContact OE2-OG 3.09Å; K352-S356 VanDerWaalsContact O-CB 3.32Å; K352-S356 WeakPolarHBondContact O-CB 3.47Å; K352-S356 PolarHBondContact O-N 3.39Å; S356-A358 PolarHBondContact O-N 3.11Å
357P39.9Very low38.5Very low89 Ų89102.7 Ų102.758%0.57860%0.603SS**  trans-79.3114.9165.232.2-27.9000106.6S355 R359S355-P357 WeakPolarHBondContact O-CD 3.44Å; P357-R359 VanDerWaalsContact C-N 3.31Å; P357-R359 PolarHBondContact O-N 3.08Å
358A38.5Very low37.2Very low102 Ų102103.8 Ų103.884%0.84361%0.605SS**  trans-51.3105.4158.500000107.2S356 M360S356-A358 PolarHBondContact O-N 3.11Å; A358-M360 PolarHBondContact O-N 3.49Å
359R34.6Very low36Very low236 Ų236104.1 Ų104.189%0.89162%0.621SS**SBendtrans6.8103.5174-76.6174.9167.6175-3.7114.8P357P357-R359 VanDerWaalsContact C-N 3.31Å; P357-R359 PolarHBondContact O-N 3.08Å
360M28.5Very low34.9Very low185 Ų185104.7 Ų104.791%0.91162%0.624SS**  157.3133.6126.4-86.6-175.6-15700111A358A358-M360 PolarHBondContact O-N 3.49Å
361G30Very low33.9Very low76 Ų76116.1 Ų116.178%0.78467%0.673SS**  trans9189.1143.400000117.6
362N29.1Very low33.3Very low165 Ų165120.5 Ų120.588%0.88269%0.692SS**  trans8.9118.3145.4-72.1-11.3000118.4
363S31.5Very low32.4Very low111 Ų111120.1 Ų120.178%0.77670%0.699SS**  176.7129.510755.90000111.4
364N28.4Very low31.7Very low152 Ų152126.6 Ų126.681%0.81374%0.737SS**  trans4.1112.8164.1-73.2-6.6000118.3
365V33Very low30.9Very low118 Ų118129 Ų12972%0.71575%0.749SS**  trans-12196.6155.5-174.80000107.1
366D25.6Very low30.1Very low135 Ų135131.9 Ų131.972%0.72276%0.76SS**  trans-73.5123.7171.4-80.3-40.3000109.9
367S26Very low29.8Very low117 Ų117136.9 Ų136.982%0.81878%0.784SS**  trans35.9102.9149.7-57.60000119.2
368I24.9Very low29Very low109 Ų109140.4 Ų140.456%0.55980%0.799SS**  trans-103115156.8-61.6175.5000108.4
369A22.5Very low28.3Very low101 Ų101143.3 Ų143.384%0.83580%0.796SS**  trans-75.7130.4171.100000110.1
370L26.7Very low27.8Very low81 Ų81135.6 Ų135.642%0.42479%0.788SS.*  trans-122.3131.2175.5-89.2156.8000109.3I181 I350I181-L370 HydrophobicContact CD1-CD1 3.44Å; I181-L370 VanDerWaalsContact CD1-CD1 3.44Å; I181-L370 HydrophobicContact CD1-CD2 3.7Å; I181-L370 HydrophobicContact CD1-CG 4.19Å; I181-L370 HydrophobicContact CG1-CD2 4.47Å; I181-L370 HydrophobicContact CG2-CD2 3.84Å; I350-L370 HydrophobicContact CD1-CD1 4.17Å
371F27.2Very low27.7Very low277 Ų277131.1 Ų131.1100%1.21578%0.777SS**  trans-61.50178.7-81.4-87.2000113.1

Retrieved 371 of 371 residues in 1010.6 ms (Link to these results)

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