A0A077ZKZ0_TRITR Loading...

Derlin

May be involved in the degradation of misfolded endoplasmic reticulum (ER) luminal proteins.

AlphaFold DB , UniProt , Accession A0A077ZKZ0, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 266 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
1M59.9Low83.4Confident212 Ų212107.7 Ų107.7100%1.04456%0.557SS**  0-54.40-68.5175.9-161.700110.5E3 G4 D5M1-E3 VanDerWaalsContact C-N 3.33Å; M1-E3 PolarHBondContact O-N 2.83Å; M1-G4 PolarHBondContact O-N 2.97Å; M1-D5 PolarHBondContact O-N 2.98Å
2A70.6Confident84Confident66 Ų66114.1 Ų114.155%0.54557%0.568SS.*Hα-helixtrans-54.6-35.7-179.800000116.2G4 D5 L6A2-G4 VanDerWaalsContact C-N 3.31Å; A2-G4 PolarHBondContact O-N 3.08Å; A2-D5 PolarHBondContact O-N 3.49Å; A2-L6 WeakPolarHBondContact O-CG 3.48Å; A2-L6 PolarHBondContact O-N 2.76Å
3E73.8Confident84.6Confident170 Ų170105.6 Ų105.679%0.79453%0.526SS*.Hα-helixtrans-62.3-38.1177.6-69.4-178.4171.700112.5M1 V7M1-E3 VanDerWaalsContact C-N 3.33Å; M1-E3 PolarHBondContact O-N 2.83Å; E3-V7 WeakPolarHBondContact O-CB 3.45Å; E3-V7 VanDerWaalsContact O-CG2 3.25Å; E3-V7 WeakPolarHBondContact O-CG2 3.35Å; E3-V7 PolarHBondContact O-N 3.3Å
4G86.2Confident85.1Confident47 Ų4799.9 Ų99.949%0.48550%0.501SS..Hα-helixtrans-67.5-42.417600000111.7M1 A2 V7 E8M1-G4 PolarHBondContact O-N 2.97Å; A2-G4 VanDerWaalsContact C-N 3.31Å; A2-G4 PolarHBondContact O-N 3.08Å; G4-V7 PolarHBondContact O-N 3.36Å; G4-E8 WeakPolarHBondContact O-CB 3.36Å; G4-E8 PolarHBondContact O-N 2.99Å
5D90.2Very high85.4Confident110 Ų11099.9 Ų99.959%0.58850%0.499SS*.Hα-helixtrans-67.5-40.4-176.6-57.3-31.2000112.2M1 A2 E8 W9M1-D5 PolarHBondContact O-N 2.98Å; A2-D5 PolarHBondContact O-N 3.49Å; D5-E8 PolarHBondContact O-N 3.34Å; D5-W9 WeakPolarHBondContact O-CB 3.34Å; D5-W9 PolarHBondContact O-N 2.69Å
6L87.1Confident85.9Confident118 Ų11894.6 Ų94.662%0.61847%0.472SS*.Hα-helixtrans-69.3-43.5178-72.3176.7000112.2A2 E8 W9 L10A2-L6 WeakPolarHBondContact O-CG 3.48Å; A2-L6 PolarHBondContact O-N 2.76Å; L6-E8 VanDerWaalsContact C-N 3.29Å; L6-E8 PolarHBondContact O-N 3.23Å; L6-W9 PolarHBondContact O-N 3.38Å; L6-L10 VanDerWaalsContact O-CB 3.31Å; L6-L10 WeakPolarHBondContact O-CB 3.37Å; L6-L10 PolarHBondContact O-N 2.82Å
7V89Confident86.4Confident69 Ų6989 Ų8942%0.41844%0.444SS..Hα-helixtrans-64.4-39.7176.7171.80000110.1E3 G4 L10 R11E3-V7 WeakPolarHBondContact O-CB 3.45Å; E3-V7 VanDerWaalsContact O-CG2 3.25Å; E3-V7 WeakPolarHBondContact O-CG2 3.35Å; E3-V7 PolarHBondContact O-N 3.3Å; G4-V7 PolarHBondContact O-N 3.36Å; V7-L10 PolarHBondContact O-N 3.49Å; V7-R11 WeakPolarHBondContact O-CB 3.31Å; V7-R11 VanDerWaalsContact O-CG 3.23Å; V7-R11 WeakPolarHBondContact O-CG 3.12Å; V7-R11 PolarHBondContact O-N 2.78Å
8E90.8Very high86.8Confident81 Ų8186.9 Ų86.938%0.37943%0.43SS..Hα-helixtrans-66.4-44.3176.5-177.755.1-154.100112.1G4 D5 L6 L10 R11 R12G4-E8 WeakPolarHBondContact O-CB 3.36Å; G4-E8 PolarHBondContact O-N 2.99Å; D5-E8 PolarHBondContact O-N 3.34Å; L6-E8 VanDerWaalsContact C-N 3.29Å; L6-E8 PolarHBondContact O-N 3.23Å; E8-L10 VanDerWaalsContact C-N 3.31Å; E8-L10 PolarHBondContact O-N 3.4Å; E8-R11 PolarHBondContact O-N 2.94Å; E8-R12 WeakPolarHBondContact O-CG 3.31Å; E8-R12 PolarHBondContact O-N 2.85Å; E8-R12 IonicContact OE1-NE 3.42Å; E8-R12 IonicContact OE1-NH2 2.72Å
9W90.4Very high87.2Confident94 Ų9489.8 Ų89.836%0.35644%0.437SS..Hα-helixtrans-58.1-45.5172.617178.8000111.4D5 L6 R11 R12 V13 F21 Y82D5-W9 WeakPolarHBondContact O-CB 3.34Å; D5-W9 PolarHBondContact O-N 2.69Å; L6-W9 PolarHBondContact O-N 3.38Å; W9-R11 VanDerWaalsContact C-N 3.28Å; W9-R11 PolarHBondContact O-N 3.34Å; W9-R12 WeakPolarHBondContact O-CB 3.39Å; W9-R12 PolarHBondContact O-N 3.46Å; W9-R12 VanDerWaalsContact O-N 3.12Å; W9-V13 PolarHBondContact O-N 3.47Å; W9-F21 HydrophobicContact CH2-CD1 4.27Å; W9-F21 AromaticContact CH2-CE1 3.55Å; W9-F21 HydrophobicContact CH2-CE1 3.55Å; W9-F21 AromaticContact CH2-CZ 3.86Å; W9-F21 HydrophobicContact CH2-CZ 3.86Å; W9-F21 HydrophobicContact CZ3-CE1 4.1Å; W9-Y82 AromaticContact CE2-CE2 3.98Å; W9-Y82 AromaticContact CE2-CZ 3.98Å; W9-Y82 HydrophobicContact CH2-CD2 4.39Å; W9-Y82 HydrophobicContact CH2-CE2 4.03Å; W9-Y82 AromaticContact CZ2-CD2 3.96Å; W9-Y82 HydrophobicContact CZ2-CD2 3.96Å; W9-Y82 HydrophobicContact CZ2-CE1 4.49Å; W9-Y82 AromaticContact CZ2-CE2 3.31Å; W9-Y82 HydrophobicContact CZ2-CE2 3.31Å; W9-Y82 AromaticContact CZ2-CZ 3.64Å; W9-Y82 AromaticContact NE1-CZ 3.82Å; W9-Y82 PolarHBondContact NE1-OH 2.76Å; W9-Y82 VanDerWaalsContact NE1-OH 3.07Å
10L90.1Very high87.6Confident51 Ų5186 Ų8627%0.26742%0.417SS..Hα-helixtrans-65.9-31.7179.8-168.466000112.2L6 V7 E8 R12 V13 R18 V22L6-L10 VanDerWaalsContact O-CB 3.31Å; L6-L10 WeakPolarHBondContact O-CB 3.37Å; L6-L10 PolarHBondContact O-N 2.82Å; V7-L10 PolarHBondContact O-N 3.49Å; E8-L10 VanDerWaalsContact C-N 3.31Å; E8-L10 PolarHBondContact O-N 3.4Å; L10-R12 VanDerWaalsContact C-N 3.31Å; L10-V13 WeakPolarHBondContact O-CB 3.45Å; L10-V13 PolarHBondContact O-N 3.04Å; L10-R18 HydrophobicContact CD1-CG 3.7Å; L10-R18 HydrophobicContact CG-CG 3.86Å; L10-R18 WeakPolarHBondContact O-CD 3.17Å; L10-V22 HydrophobicContact CD1-CG2 3.67Å; L10-V22 HydrophobicContact CD2-CG2 4.04Å; L10-V22 HydrophobicContact CG-CG2 4.45Å
11R89.6Confident87.9Confident167 Ų16782.9 Ų82.963%0.6340%0.402SS*.Hα-helixtrans-68.8-27.1173.9-77.2171.8-176.31762113.3V7 E8 W9 V13V7-R11 WeakPolarHBondContact O-CB 3.31Å; V7-R11 VanDerWaalsContact O-CG 3.23Å; V7-R11 WeakPolarHBondContact O-CG 3.12Å; V7-R11 PolarHBondContact O-N 2.78Å; E8-R11 PolarHBondContact O-N 2.94Å; W9-R11 VanDerWaalsContact C-N 3.28Å; W9-R11 PolarHBondContact O-N 3.34Å; R11-V13 VanDerWaalsContact C-N 3.3Å
12R90.7Very high89.6Confident184 Ų18475.4 Ų75.469%0.69437%0.368SS*.Hα-helixtrans-74.6-22.6175.2-66173.2-172.4-174.71.9112.8E8 W9 L10E8-R12 WeakPolarHBondContact O-CG 3.31Å; E8-R12 PolarHBondContact O-N 2.85Å; E8-R12 IonicContact OE1-NE 3.42Å; E8-R12 IonicContact OE1-NH2 2.72Å; W9-R12 WeakPolarHBondContact O-CB 3.39Å; W9-R12 PolarHBondContact O-N 3.46Å; W9-R12 VanDerWaalsContact O-N 3.12Å; L10-R12 VanDerWaalsContact C-N 3.31Å
13V91.7Very high90.7Very high4 Ų473 Ų732%0.02435%0.35CS..SBendtrans-70.3131.2175.5-170.60000108.9W9 L10 R11 T17 R18 Y82W9-V13 PolarHBondContact O-N 3.47Å; L10-V13 WeakPolarHBondContact O-CB 3.45Å; L10-V13 PolarHBondContact O-N 3.04Å; R11-V13 VanDerWaalsContact C-N 3.3Å; V13-T17 HydrophobicContact CG1-CG2 3.69Å; V13-R18 HydrophobicContact CB-CB 4.1Å; V13-R18 HydrophobicContact CG1-CB 3.97Å; V13-Y82 HydrophobicContact CG1-CE2 4.3Å; V13-Y82 HydrophobicContact CG2-CE2 3.61Å
14P92Very high91.6Very high26 Ų2665 Ų6517%0.16931%0.312CS..  trans-52.2149.3173.5-27.936.2000112.4I16 T17 R18 T86 E89 T90P14-I16 PolarHBondContact O-N 2.92Å; P14-T17 PolarHBondContact O-N 3.38Å; P14-R18 WeakPolarHBondContact O-CB 3.19Å; P14-R18 PolarHBondContact O-N 3.47Å; P14-T86 HydrophobicContact CG-CG2 3.96Å; P14-E89 HydrophobicContact CB-CB 4.22Å; P14-E89 HydrophobicContact CB-CG 3.75Å; P14-E89 VanDerWaalsContact CB-OE1 3.3Å; P14-E89 WeakPolarHBondContact CB-OE1 3.44Å; P14-E89 VanDerWaalsContact CB-OE2 3.31Å; P14-E89 WeakPolarHBondContact CB-OE2 3.35Å; P14-E89 HydrophobicContact CG-CB 4.47Å; P14-E89 HydrophobicContact CG-CG 4.45Å; P14-T90 HydrophobicContact CG-CG2 3.73Å
15E89.4Confident91.9Very high100 Ų10064.5 Ų64.547%0.46730%0.3SS..Hα-helixtrans-59.4-47-165.8-61.8-176.8169.300113.2R18 Y19E15-R18 WeakPolarHBondContact O-CB 3.18Å; E15-R18 PolarHBondContact O-N 3.03Å; E15-Y19 WeakPolarHBondContact O-CD2 3.38Å; E15-Y19 PolarHBondContact O-N 3.36Å; E15-Y19 VanDerWaalsContact O-N 3.16Å
16I92.6Very high92Very high14 Ų1463.8 Ų63.87%0.07230%0.296CS..Hα-helixtrans-70.6-48.2-175.1-55.3-52.2000110.1P14 R18 Y19 W20 E89 P97 Y100 L101 L104 F227P14-I16 PolarHBondContact O-N 2.92Å; I16-R18 PolarHBondContact O-N 3.3Å; I16-Y19 PolarHBondContact O-N 3.44Å; I16-W20 PolarHBondContact O-N 2.83Å; I16-E89 WeakPolarHBondContact CB-OE1 3.34Å; I16-E89 PolarHBondContact N-OE1 2.95Å; I16-E89 VanDerWaalsContact N-OE1 3.16Å; I16-P97 HydrophobicContact CG1-CB 4.27Å; I16-Y100 HydrophobicContact CB-CD1 3.73Å; I16-Y100 HydrophobicContact CB-CE1 3.68Å; I16-Y100 HydrophobicContact CG1-CD1 4.1Å; I16-Y100 HydrophobicContact CG2-CD1 3.74Å; I16-Y100 HydrophobicContact CG2-CE1 3.53Å; I16-L101 HydrophobicContact CD1-CB 4.4Å; I16-L101 HydrophobicContact CD1-CD1 3.89Å; I16-L101 HydrophobicContact CG1-CB 4.41Å; I16-L104 HydrophobicContact CG2-CD1 3.62Å; I16-F227 HydrophobicContact CD1-CD1 3.88Å; I16-F227 HydrophobicContact CD1-CD2 4.1Å; I16-F227 HydrophobicContact CD1-CE1 3.38Å; I16-F227 HydrophobicContact CD1-CE2 3.64Å; I16-F227 HydrophobicContact CD1-CG 4.21Å; I16-F227 HydrophobicContact CD1-CZ 3.25Å
17T94.3Very high92.1Very high0 Ų060 Ų600%028%0.276CS..Hα-helixtrans-57.1-39.2174.3-68.70000111.8V13 P14 W20 F21 S85 T86 E89 Y100V13-T17 HydrophobicContact CG1-CG2 3.69Å; P14-T17 PolarHBondContact O-N 3.38Å; T17-W20 PolarHBondContact O-N 3.01Å; T17-F21 WeakPolarHBondContact O-CB 3.31Å; T17-F21 PolarHBondContact O-N 2.98Å; T17-S85 WeakPolarHBondContact CB-OG 3.27Å; T17-S85 WeakPolarHBondContact CG2-OG 3.27Å; T17-S85 PolarHBondContact OG1-O 3.43Å; T17-S85 PolarHBondContact OG1-OG 3.45Å; T17-T86 WeakPolarHBondContact CG2-OG1 3.27Å; T17-E89 VanDerWaalsContact CB-OE2 3.22Å; T17-E89 WeakPolarHBondContact CB-OE2 3.46Å; T17-E89 PolarHBondContact N-OE2 3.41Å; T17-E89 PolarHBondContact OG1-OE2 3.45Å; T17-Y100 PolarHBondContact OG1-OH 2.67Å
18R94.6Very high92.1Very high52 Ų5256.8 Ų56.820%0.19626%0.256CS..Hα-helixtrans-60.2-50.4177.8178.8178.269.1-164.91.3111.8L10 V13 P14 E15 I16 W20 F21 V22L10-R18 HydrophobicContact CD1-CG 3.7Å; L10-R18 HydrophobicContact CG-CG 3.86Å; L10-R18 WeakPolarHBondContact O-CD 3.17Å; V13-R18 HydrophobicContact CB-CB 4.1Å; V13-R18 HydrophobicContact CG1-CB 3.97Å; P14-R18 WeakPolarHBondContact O-CB 3.19Å; P14-R18 PolarHBondContact O-N 3.47Å; E15-R18 WeakPolarHBondContact O-CB 3.18Å; E15-R18 PolarHBondContact O-N 3.03Å; I16-R18 PolarHBondContact O-N 3.3Å; R18-W20 VanDerWaalsContact C-N 3.32Å; R18-W20 PolarHBondContact O-N 3.06Å; R18-F21 PolarHBondContact O-N 3.04Å; R18-V22 HydrophobicContact CG-CG2 4.43Å; R18-V22 WeakPolarHBondContact O-CB 3.43Å; R18-V22 WeakPolarHBondContact O-CG2 3.41Å; R18-V22 PolarHBondContact O-N 2.87Å
19Y93.6Very high92Very high142 Ų14256.5 Ų56.556%0.55726%0.257SS*.Hα-helixtrans-62.9-41.5178.6-69.4-62.8000111.7E15 I16 G23E15-Y19 WeakPolarHBondContact O-CD2 3.38Å; E15-Y19 PolarHBondContact O-N 3.36Å; E15-Y19 VanDerWaalsContact O-N 3.16Å; I16-Y19 PolarHBondContact O-N 3.44Å; Y19-G23 PolarHBondContact O-N 3.26Å
20W94.7Very high91.9Very high12 Ų1254.8 Ų54.85%0.04525%0.254CS..Hα-helixtrans-63.9-50.5177.9-171.812.3000111.7I16 T17 R18 G23 T24 L61 F62 L81 L104 L124 M127 V128 V131I16-W20 PolarHBondContact O-N 2.83Å; T17-W20 PolarHBondContact O-N 3.01Å; R18-W20 VanDerWaalsContact C-N 3.32Å; R18-W20 PolarHBondContact O-N 3.06Å; W20-G23 PolarHBondContact O-N 3.35Å; W20-T24 VanDerWaalsContact O-CG2 3.28Å; W20-T24 WeakPolarHBondContact O-CG2 3.44Å; W20-T24 PolarHBondContact O-N 3.36Å; W20-T24 PolarHBondContact O-OG1 3.29Å; W20-L61 VanDerWaalsContact NE1-CD2 3.35Å; W20-F62 AromaticContact CD1-CE1 3.93Å; W20-L81 HydrophobicContact CD2-CD1 3.39Å; W20-L81 VanDerWaalsContact CE2-CD1 3.47Å; W20-L81 HydrophobicContact CE3-CD1 3.35Å; W20-L81 HydrophobicContact CG-CD1 4.13Å; W20-L81 HydrophobicContact CH2-CD1 3.47Å; W20-L81 VanDerWaalsContact CH2-CD1 3.47Å; W20-L81 HydrophobicContact CZ2-CD1 3.52Å; W20-L81 HydrophobicContact CZ3-CD1 3.37Å; W20-L104 HydrophobicContact CE3-CD1 4.07Å; W20-L104 HydrophobicContact CE3-CD2 4.18Å; W20-L104 HydrophobicContact CH2-CD2 4.23Å; W20-L104 HydrophobicContact CZ3-CD1 4.34Å; W20-L104 HydrophobicContact CZ3-CD2 3.62Å; W20-L124 HydrophobicContact CZ2-CD1 4.28Å; W20-M127 HydrophobicContact CH2-CB 4.13Å; W20-M127 HydrophobicContact CH2-CE 4.46Å; W20-M127 HydrophobicContact CZ2-CB 3.77Å; W20-V128 HydrophobicContact CH2-CG2 4.31Å; W20-V128 HydrophobicContact CZ2-CG2 4.06Å; W20-V131 HydrophobicContact CH2-CG2 3.91Å; W20-V131 HydrophobicContact CZ3-CG2 3.92Å
21F95.3Very high91.7Very high21 Ų2152.7 Ų52.79%0.09225%0.245CC..Hα-helixtrans-57.9-52.4177.9-178.2-92.6000111.9W9 T17 R18 G23 T24 V25 L78 L81 Y82W9-F21 HydrophobicContact CH2-CD1 4.27Å; W9-F21 AromaticContact CH2-CE1 3.55Å; W9-F21 HydrophobicContact CH2-CE1 3.55Å; W9-F21 AromaticContact CH2-CZ 3.86Å; W9-F21 HydrophobicContact CH2-CZ 3.86Å; W9-F21 HydrophobicContact CZ3-CE1 4.1Å; T17-F21 WeakPolarHBondContact O-CB 3.31Å; T17-F21 PolarHBondContact O-N 2.98Å; R18-F21 PolarHBondContact O-N 3.04Å; F21-G23 VanDerWaalsContact C-N 3.32Å; F21-G23 PolarHBondContact O-N 3.11Å; F21-T24 WeakPolarHBondContact CA-OG1 3.44Å; F21-T24 PolarHBondContact O-N 3.41Å; F21-T24 VanDerWaalsContact O-N 3.15Å; F21-T24 PolarHBondContact O-OG1 3.16Å; F21-V25 HydrophobicContact CD1-CG2 4.21Å; F21-V25 HydrophobicContact CE1-CG2 3.84Å; F21-V25 HydrophobicContact CZ-CG2 4.03Å; F21-V25 WeakPolarHBondContact O-CG2 3.45Å; F21-V25 PolarHBondContact O-N 3.46Å; F21-L78 HydrophobicContact CD2-CG 4.33Å; F21-L78 HydrophobicContact CE2-CD1 4.31Å; F21-L78 HydrophobicContact CE2-CD2 3.39Å; F21-L78 HydrophobicContact CE2-CG 3.51Å; F21-L78 HydrophobicContact CZ-CD1 4.38Å; F21-L78 HydrophobicContact CZ-CD2 3.66Å; F21-L78 HydrophobicContact CZ-CG 3.99Å; F21-L81 HydrophobicContact CB-CD2 4.43Å; F21-L81 HydrophobicContact CD2-CD2 4.25Å; F21-Y82 HydrophobicContact CD2-CD2 4.19Å; F21-Y82 HydrophobicContact CE2-CD2 4.17Å; F21-Y82 HydrophobicContact CE2-CG 4.36Å
22V94.8Very high91.4Very high56 Ų5651.5 Ų51.534%0.33924%0.24SC..Hα-helixtrans-60-43.1179172.40000111L10 R18 T24 V25 L26L10-V22 HydrophobicContact CD1-CG2 3.67Å; L10-V22 HydrophobicContact CD2-CG2 4.04Å; L10-V22 HydrophobicContact CG-CG2 4.45Å; R18-V22 HydrophobicContact CG-CG2 4.43Å; R18-V22 WeakPolarHBondContact O-CB 3.43Å; R18-V22 WeakPolarHBondContact O-CG2 3.41Å; R18-V22 PolarHBondContact O-N 2.87Å; V22-T24 VanDerWaalsContact C-N 3.34Å; V22-T24 PolarHBondContact O-N 3.47Å; V22-V25 PolarHBondContact O-N 2.99Å; V22-L26 WeakPolarHBondContact O-CB 3.22Å; V22-L26 PolarHBondContact O-N 3.05Å
23G93.1Very high91.1Very high15 Ų1550.2 Ų50.216%0.15524%0.24CC..Hα-helixtrans-59.9-43.917600000112.4Y19 W20 F21 V25 L27Y19-G23 PolarHBondContact O-N 3.26Å; W20-G23 PolarHBondContact O-N 3.35Å; F21-G23 VanDerWaalsContact C-N 3.32Å; F21-G23 PolarHBondContact O-N 3.11Å; G23-V25 VanDerWaalsContact C-N 3.26Å; G23-V25 PolarHBondContact O-N 2.98Å; G23-L27 WeakPolarHBondContact O-CB 3.44Å; G23-L27 PolarHBondContact O-N 2.86Å; G23-L27 VanDerWaalsContact O-N 3.11Å
24T93Very high90.5Very high1 Ų156.7 Ų56.71%0.00627%0.274CS..Hα-helixtrans-70.2-19.9178.259.70000114.3W20 F21 V22 P28 F62 Y74 L81 L124W20-T24 VanDerWaalsContact O-CG2 3.28Å; W20-T24 WeakPolarHBondContact O-CG2 3.44Å; W20-T24 PolarHBondContact O-N 3.36Å; W20-T24 PolarHBondContact O-OG1 3.29Å; F21-T24 WeakPolarHBondContact CA-OG1 3.44Å; F21-T24 PolarHBondContact O-N 3.41Å; F21-T24 VanDerWaalsContact O-N 3.15Å; F21-T24 PolarHBondContact O-OG1 3.16Å; V22-T24 VanDerWaalsContact C-N 3.34Å; V22-T24 PolarHBondContact O-N 3.47Å; T24-P28 WeakPolarHBondContact O-CD 3.35Å; T24-P28 WeakPolarHBondContact O-CG 3.17Å; T24-F62 WeakPolarHBondContact CA-O 3.3Å; T24-F62 HydrophobicContact CG2-CD1 4.22Å; T24-Y74 PolarHBondContact O-OH 3.45Å; T24-L81 HydrophobicContact CG2-CD2 3.99Å; T24-L81 VanDerWaalsContact OG1-CD2 3.29Å; T24-L81 WeakPolarHBondContact OG1-CD2 3.37Å; T24-L124 HydrophobicContact CG2-CD1 3.47Å; T24-L124 VanDerWaalsContact CG2-CD1 3.47Å; T24-L124 HydrophobicContact CG2-CD2 4.18Å; T24-L124 HydrophobicContact CG2-CG 4.47Å
25V93.2Very high89.9Confident37 Ų3760.4 Ų60.422%0.22430%0.296CS..Hα-helixtrans-86.1-50.3173.8171.90000110.5F21 V22 G23 I29 Y74 L78F21-V25 HydrophobicContact CD1-CG2 4.21Å; F21-V25 HydrophobicContact CE1-CG2 3.84Å; F21-V25 HydrophobicContact CZ-CG2 4.03Å; F21-V25 WeakPolarHBondContact O-CG2 3.45Å; F21-V25 PolarHBondContact O-N 3.46Å; V22-V25 PolarHBondContact O-N 2.99Å; G23-V25 VanDerWaalsContact C-N 3.26Å; G23-V25 PolarHBondContact O-N 2.98Å; V25-I29 HydrophobicContact CG1-CD1 3.62Å; V25-I29 WeakPolarHBondContact O-CB 3.21Å; V25-I29 WeakPolarHBondContact O-CD1 3.41Å; V25-I29 WeakPolarHBondContact O-CG1 3.48Å; V25-I29 PolarHBondContact O-N 2.93Å; V25-Y74 WeakPolarHBondContact CA-OH 3.41Å; V25-L78 HydrophobicContact CG2-CD1 3.48Å; V25-L78 VanDerWaalsContact CG2-CD1 3.48Å; V25-L78 HydrophobicContact CG2-CG 4.37Å
26L91.5Very high89.2Confident95 Ų9557.7 Ų57.750%0.49729%0.286SS..Hα-helixtrans-66.9-46.1-171.3-175.264.4000111.8V22 I29 L30V22-L26 WeakPolarHBondContact O-CB 3.22Å; V22-L26 PolarHBondContact O-N 3.05Å; L26-I29 PolarHBondContact O-N 3.42Å; L26-L30 HydrophobicContact CD1-CD1 4.21Å; L26-L30 HydrophobicContact CD1-CG 4.31Å; L26-L30 HydrophobicContact CG-CD1 3.91Å; L26-L30 HydrophobicContact CG-CG 4.41Å; L26-L30 WeakPolarHBondContact O-CB 3.15Å; L26-L30 VanDerWaalsContact O-CG 3.27Å; L26-L30 WeakPolarHBondContact O-CG 3.48Å; L26-L30 PolarHBondContact O-N 2.91Å
27L89.4Confident88.4Confident38 Ų3863.8 Ų63.820%0.19931%0.312CS..Hα-helixtrans-65.7-47.7-175.2-78.7168.7000113.2G23 I29 L30 A31 F41 F62G23-L27 WeakPolarHBondContact O-CB 3.44Å; G23-L27 PolarHBondContact O-N 2.86Å; G23-L27 VanDerWaalsContact O-N 3.11Å; L27-I29 VanDerWaalsContact C-N 3.34Å; L27-I29 PolarHBondContact O-N 2.98Å; L27-L30 PolarHBondContact O-N 3.36Å; L27-A31 WeakPolarHBondContact O-CB 3.39Å; L27-A31 PolarHBondContact O-N 3.46Å; L27-F41 HydrophobicContact CD2-CE2 4.43Å; L27-F41 HydrophobicContact CD2-CZ 4.17Å; L27-F62 HydrophobicContact CD1-CB 3.37Å; L27-F62 HydrophobicContact CD1-CD2 4.4Å; L27-F62 HydrophobicContact CD1-CG 4.03Å
28P89.2Confident87.5Confident2 Ų266.1 Ų66.11%0.01333%0.327CS..Hα-helixtrans-63.6-34.9174.9-28.640.5000114T24 A31 R32 I66 Y74T24-P28 WeakPolarHBondContact O-CD 3.35Å; T24-P28 WeakPolarHBondContact O-CG 3.17Å; P28-A31 PolarHBondContact O-N 3.39Å; P28-R32 WeakPolarHBondContact O-CB 3.25Å; P28-R32 PolarHBondContact O-N 2.89Å; P28-I66 HydrophobicContact CB-CD1 3.41Å; P28-I66 VanDerWaalsContact CB-CD1 3.41Å; P28-I66 HydrophobicContact CB-CG1 3.9Å; P28-Y74 HydrophobicContact CB-CE2 4.36Å; P28-Y74 HydrophobicContact CG-CE2 4.13Å
29I88.9Confident86.5Confident75 Ų7567.1 Ų67.139%0.38535%0.346SS..Hα-helixtrans-65.9-47.1175.3-69.6172.2000110.6V25 L26 L27 A31 R32 F33V25-I29 HydrophobicContact CG1-CD1 3.62Å; V25-I29 WeakPolarHBondContact O-CB 3.21Å; V25-I29 WeakPolarHBondContact O-CD1 3.41Å; V25-I29 WeakPolarHBondContact O-CG1 3.48Å; V25-I29 PolarHBondContact O-N 2.93Å; L26-I29 PolarHBondContact O-N 3.42Å; L27-I29 VanDerWaalsContact C-N 3.34Å; L27-I29 PolarHBondContact O-N 2.98Å; I29-A31 PolarHBondContact O-N 3.43Å; I29-R32 WeakPolarHBondContact O-CB 3.45Å; I29-R32 PolarHBondContact O-N 3.28Å; I29-F33 HydrophobicContact CG2-CD2 3.96Å; I29-F33 HydrophobicContact CG2-CE2 3.69Å; I29-F33 VanDerWaalsContact O-CD2 3.27Å; I29-F33 WeakPolarHBondContact O-CD2 3.41Å; I29-F33 PolarHBondContact O-N 3.02Å; I29-F33 VanDerWaalsContact O-N 3.16Å
30L88.6Confident85.6Confident58 Ų5867.8 Ų67.830%0.30435%0.347SS..Hα-helixtrans-59.3-38.8174.5-71.8173.1000111.6L26 L27 R32 F33 V35L26-L30 HydrophobicContact CD1-CD1 4.21Å; L26-L30 HydrophobicContact CD1-CG 4.31Å; L26-L30 HydrophobicContact CG-CD1 3.91Å; L26-L30 HydrophobicContact CG-CG 4.41Å; L26-L30 WeakPolarHBondContact O-CB 3.15Å; L26-L30 VanDerWaalsContact O-CG 3.27Å; L26-L30 WeakPolarHBondContact O-CG 3.48Å; L26-L30 PolarHBondContact O-N 2.91Å; L27-L30 PolarHBondContact O-N 3.36Å; L30-R32 VanDerWaalsContact C-N 3.32Å; L30-R32 PolarHBondContact O-N 3.12Å; L30-F33 PolarHBondContact O-N 3.3Å; L30-V35 WeakPolarHBondContact O-CB 3.49Å; L30-V35 PolarHBondContact O-N 3.36Å
31A85.3Confident84.7Confident8 Ų868.7 Ų68.77%0.06635%0.352CS..Hα-helixtrans-66.3-34.5175.600000112.6L27 P28 I29 N34 V36 V38 I63L27-A31 WeakPolarHBondContact O-CB 3.39Å; L27-A31 PolarHBondContact O-N 3.46Å; P28-A31 PolarHBondContact O-N 3.39Å; I29-A31 PolarHBondContact O-N 3.43Å; A31-N34 PolarHBondContact O-N 3.36Å; A31-N34 VanDerWaalsContact O-N 3.13Å; A31-V36 VanDerWaalsContact CA-O 3.27Å; A31-V36 WeakPolarHBondContact CA-O 3.28Å; A31-V38 HydrophobicContact CB-CG2 3.86Å; A31-I63 HydrophobicContact CB-CD1 4.46Å
32R82.9Confident84Confident142 Ų14268.7 Ų68.754%0.53635%0.353SS..Hα-helixtrans-67.4-34.9177-175.162.7179.2-159.53.7112.8P28 I29 L30 N34 I66P28-R32 WeakPolarHBondContact O-CB 3.25Å; P28-R32 PolarHBondContact O-N 2.89Å; I29-R32 WeakPolarHBondContact O-CB 3.45Å; I29-R32 PolarHBondContact O-N 3.28Å; L30-R32 VanDerWaalsContact C-N 3.32Å; L30-R32 PolarHBondContact O-N 3.12Å; R32-N34 PolarHBondContact O-N 2.85Å; R32-I66 PolarHBondContact NH1-O 3.07Å
33F85.4Confident83.1Confident157 Ų15766.1 Ų66.169%0.68934%0.337SS*.THydrogen-bonded Turntrans-75.56.7173.3-73.1-68.4000113.5I29 L30 V35I29-F33 HydrophobicContact CG2-CD2 3.96Å; I29-F33 HydrophobicContact CG2-CE2 3.69Å; I29-F33 VanDerWaalsContact O-CD2 3.27Å; I29-F33 WeakPolarHBondContact O-CD2 3.41Å; I29-F33 PolarHBondContact O-N 3.02Å; I29-F33 VanDerWaalsContact O-N 3.16Å; L30-F33 PolarHBondContact O-N 3.3Å; F33-V35 HydrophobicContact CB-CG2 3.87Å; F33-V35 PolarHBondContact O-N 3.23Å
34N78.6Confident82.4Confident140 Ų14068.2 Ų68.275%0.74935%0.345SS*.THydrogen-bonded Turntrans5715-173.4-65.6-55000114.3A31 R32 V36A31-N34 PolarHBondContact O-N 3.36Å; A31-N34 VanDerWaalsContact O-N 3.13Å; R32-N34 PolarHBondContact O-N 2.85Å; N34-V36 PolarHBondContact O-N 3.02Å
35V78.7Confident81.4Confident103 Ų10373 Ų7362%0.62436%0.364SS*.SBendtrans-64.8-34.3173.2-179.50000109.3L30 F33L30-V35 WeakPolarHBondContact O-CB 3.49Å; L30-V35 PolarHBondContact O-N 3.36Å; F33-V35 HydrophobicContact CB-CG2 3.87Å; F33-V35 PolarHBondContact O-N 3.23Å
36V76Confident80.4Confident43 Ų4374.9 Ų74.926%0.26137%0.373SS..SBendtrans-133.6137.2172.4-159.20000111.6A31 N34 F41A31-V36 VanDerWaalsContact CA-O 3.27Å; A31-V36 WeakPolarHBondContact CA-O 3.28Å; N34-V36 PolarHBondContact O-N 3.02Å; V36-F41 HydrophobicContact CB-CE2 3.67Å; V36-F41 HydrophobicContact CB-CZ 4.25Å; V36-F41 HydrophobicContact CG1-CD2 4Å; V36-F41 HydrophobicContact CG1-CE2 3.07Å; V36-F41 HydrophobicContact CG1-CZ 3.45Å; V36-F41 VanDerWaalsContact CG1-CZ 3.45Å; V36-F41 HydrophobicContact CG2-CE2 4.31Å; V36-F41 HydrophobicContact CG2-CZ 4.5Å
37K76Confident79.7Confident142 Ų14272.4 Ų72.462%0.61736%0.36SS*.  trans-78.5125.9178.3-70.3178.1-177.3178.20110A39 W40K37-A39 PolarHBondContact O-N 3.44Å; K37-A39 VanDerWaalsContact O-N 3.09Å; K37-W40 VanDerWaalsContact CB-CD1 3.45Å; K37-W40 HydrophobicContact CB-CG 4.45Å; K37-W40 WeakPolarHBondContact O-CB 3.42Å; K37-W40 PolarHBondContact O-N 3.17Å
38V75.2Confident79.1Confident50 Ų5071.5 Ų71.530%0.30336%0.356SS..G310 helixtrans-50.6-38.2178.1178.40000112.3A31 W40 F41 V42 I63 F122A31-V38 HydrophobicContact CB-CG2 3.86Å; V38-W40 PolarHBondContact O-N 3.07Å; V38-F41 PolarHBondContact O-N 3.5Å; V38-V42 HydrophobicContact CG1-CG2 4.15Å; V38-V42 PolarHBondContact O-N 3.32Å; V38-I63 HydrophobicContact CB-CD1 4.27Å; V38-I63 HydrophobicContact CG1-CD1 3.94Å; V38-I63 HydrophobicContact CG2-CD1 4.33Å; V38-F122 HydrophobicContact CG1-CE1 4.48Å
39A73.9Confident78.5Confident72 Ų7274 Ų7460%0.59537%0.371SS*.G310 helixtrans-58.6-20.3179.900000114.8K37 F41 R56K37-A39 PolarHBondContact O-N 3.44Å; K37-A39 VanDerWaalsContact O-N 3.09Å; A39-F41 VanDerWaalsContact C-N 3.31Å; A39-R56 PolarHBondContact O-NH1 3Å
40W74.7Confident78Confident156 Ų15676 Ų7659%0.59138%0.379SS*.G310 helixtrans-79.5-17.2179.3-71.961.8000113.1K37 V38 R56K37-W40 VanDerWaalsContact CB-CD1 3.45Å; K37-W40 HydrophobicContact CB-CG 4.45Å; K37-W40 WeakPolarHBondContact O-CB 3.42Å; K37-W40 PolarHBondContact O-N 3.17Å; V38-W40 PolarHBondContact O-N 3.07Å; W40-R56 VanDerWaalsContact C-NH1 3.31Å; W40-R56 PolarHBondContact O-NH1 3.38Å; W40-R56 VanDerWaalsContact O-NH1 3.07Å
41F76.1Confident77.7Confident32 Ų3278.5 Ų78.514%0.1439%0.388CS..THydrogen-bonded Turntrans-114.2-4.6-175.3-60.9-58.5000113.6L27 V36 V38 A39 T59 A60 I63L27-F41 HydrophobicContact CD2-CE2 4.43Å; L27-F41 HydrophobicContact CD2-CZ 4.17Å; V36-F41 HydrophobicContact CB-CE2 3.67Å; V36-F41 HydrophobicContact CB-CZ 4.25Å; V36-F41 HydrophobicContact CG1-CD2 4Å; V36-F41 HydrophobicContact CG1-CE2 3.07Å; V36-F41 HydrophobicContact CG1-CZ 3.45Å; V36-F41 VanDerWaalsContact CG1-CZ 3.45Å; V36-F41 HydrophobicContact CG2-CE2 4.31Å; V36-F41 HydrophobicContact CG2-CZ 4.5Å; V38-F41 PolarHBondContact O-N 3.5Å; A39-F41 VanDerWaalsContact C-N 3.31Å; F41-T59 HydrophobicContact CD1-CG2 3.59Å; F41-T59 HydrophobicContact CE1-CG2 3.82Å; F41-A60 WeakPolarHBondContact O-CA 3.38Å; F41-A60 PolarHBondContact O-N 2.76Å; F41-I63 HydrophobicContact CB-CB 4.22Å; F41-I63 HydrophobicContact CB-CD1 3.65Å; F41-I63 HydrophobicContact CB-CG2 3.86Å; F41-I63 HydrophobicContact CD2-CD1 3.57Å; F41-I63 HydrophobicContact CG-CD1 4.04Å
42V79.4Confident77.5Confident21 Ų2185.7 Ų85.713%0.12742%0.418CS..SBendtrans-70.9139.6173.6167.10000109.4V38 D44 R56 Y121 F122V38-V42 HydrophobicContact CG1-CG2 4.15Å; V38-V42 PolarHBondContact O-N 3.32Å; V42-D44 PolarHBondContact O-N 3.42Å; V42-R56 WeakPolarHBondContact O-CD 3.35Å; V42-R56 PolarHBondContact O-NH1 3.01Å; V42-Y121 HydrophobicContact CG1-CD1 3.23Å; V42-Y121 HydrophobicContact CG1-CE1 4.22Å; V42-Y121 HydrophobicContact CG1-CG 3.76Å; V42-F122 HydrophobicContact CG2-CE1 3.76Å; V42-F122 HydrophobicContact CG2-CZ 4.05Å
43L75.1Confident77.5Confident1 Ų180.5 Ų80.51%0.00540%0.4CS..  trans-73.8110.6170.8-173.3122.4000108.7V48 P57 A60 L116 M120 Y121 L123L43-V48 HydrophobicContact CG-CG2 4.49Å; L43-P57 HydrophobicContact CD1-CB 3.78Å; L43-P57 HydrophobicContact CD1-CG 3.81Å; L43-A60 HydrophobicContact CB-CB 3.94Å; L43-L116 HydrophobicContact CD1-CD2 4.4Å; L43-L116 HydrophobicContact CD2-CD2 3.93Å; L43-L116 HydrophobicContact CD2-CG 4.31Å; L43-L116 HydrophobicContact CG-CD2 4.29Å; L43-M120 WeakPolarHBondContact CD2-O 3.39Å; L43-Y121 PolarHBondContact N-O 2.88Å; L43-Y121 WeakPolarHBondContact O-CD1 3.39Å; L43-L123 HydrophobicContact CD1-CD1 4.09Å
44D78.5Confident77.4Confident59 Ų5979.4 Ų79.432%0.31640%0.4SS..  trans-114.8128.3173.3-171.6-43.6000107.7V42 D46 L47 V48V42-D44 PolarHBondContact O-N 3.42Å; D44-D46 VanDerWaalsContact C-N 3.3Å; D44-D46 PolarHBondContact O-N 3.19Å; D44-D46 WeakPolarHBondContact OD1-CB 3.41Å; D44-D46 PolarHBondContact OD1-N 3.04Å; D44-L47 HydrophobicContact CB-CB 4.07Å; D44-L47 HydrophobicContact CB-CD1 3.77Å; D44-L47 HydrophobicContact CB-CG 4.01Å; D44-L47 PolarHBondContact O-N 3.48Å; D44-V48 WeakPolarHBondContact O-CB 3.36Å; D44-V48 VanDerWaalsContact O-CG2 3.25Å; D44-V48 WeakPolarHBondContact O-CG2 3.23Å; D44-V48 PolarHBondContact O-N 2.85Å
45Y72.5Confident77.7Confident101 Ų10179.4 Ų79.440%0.39639%0.39SS..Hα-helixtrans-58.2-44.3-178.3179.1-95.1000111.6L47 V48 V49 L116Y45-L47 PolarHBondContact O-N 3.05Å; Y45-V48 PolarHBondContact O-N 3.07Å; Y45-V49 HydrophobicContact CD2-CG2 3.97Å; Y45-V49 HydrophobicContact CE1-CB 4.49Å; Y45-V49 HydrophobicContact CE1-CG2 4.39Å; Y45-V49 HydrophobicContact CE2-CG2 3.71Å; Y45-V49 HydrophobicContact CG-CG2 4.44Å; Y45-V49 WeakPolarHBondContact O-CB 3.37Å; Y45-V49 WeakPolarHBondContact O-CG2 3.49Å; Y45-V49 PolarHBondContact O-N 3.14Å; Y45-L116 HydrophobicContact CD2-CB 4.15Å; Y45-L116 HydrophobicContact CD2-CD2 4.18Å; Y45-L116 WeakPolarHBondContact CD2-O 3.39Å
46D73.1Confident78Confident77 Ų7775.2 Ų75.241%0.41236%0.363SS..Hα-helixtrans-67.6-38.9-175.7-167.944.8000111.3D44 H50 H51D44-D46 VanDerWaalsContact C-N 3.3Å; D44-D46 PolarHBondContact O-N 3.19Å; D44-D46 WeakPolarHBondContact OD1-CB 3.41Å; D44-D46 PolarHBondContact OD1-N 3.04Å; D46-H50 VanDerWaalsContact O-CB 3.28Å; D46-H50 WeakPolarHBondContact O-CB 3.48Å; D46-H50 PolarHBondContact O-N 3.01Å; D46-H50 IonicContact OD1-CE1 2.76Å; D46-H50 PolarHBondContact OD1-CE1 3.13Å; D46-H50 IonicContact OD1-CG 2.67Å; D46-H50 IonicContact OD1-ND1 3.45Å; D46-H50 PolarHBondContact OD1-ND1 3.16Å; D46-H51 PolarHBondContact O-N 3.29Å; D46-H51 PolarHBondContact O-ND1 2.72Å
47L75.5Confident78.5Confident43 Ų4373.6 Ų73.623%0.22535%0.353CS..Hα-helixtrans-75.5-31178.8-61.6171.8000112.7D44 Y45 H51 Q53 R56D44-L47 HydrophobicContact CB-CB 4.07Å; D44-L47 HydrophobicContact CB-CD1 3.77Å; D44-L47 HydrophobicContact CB-CG 4.01Å; D44-L47 PolarHBondContact O-N 3.48Å; Y45-L47 PolarHBondContact O-N 3.05Å; L47-H51 CarbonylContact O-C 3.43Å; L47-H51 WeakPolarHBondContact O-CB 3.41Å; L47-Q53 WeakPolarHBondContact O-CB 3.49Å; L47-Q53 WeakPolarHBondContact O-CG 3.42Å; L47-Q53 PolarHBondContact O-N 3.33Å; L47-R56 VanDerWaalsContact CD1-CZ 3.47Å
48V77.2Confident79Confident19 Ų1969.9 Ų69.912%0.11534%0.342CS..Hα-helixtrans-78.7-46.9178.6174.60000110.9L43 D44 Y45 F52 R56 P57 L116L43-V48 HydrophobicContact CG-CG2 4.49Å; D44-V48 WeakPolarHBondContact O-CB 3.36Å; D44-V48 VanDerWaalsContact O-CG2 3.25Å; D44-V48 WeakPolarHBondContact O-CG2 3.23Å; D44-V48 PolarHBondContact O-N 2.85Å; Y45-V48 PolarHBondContact O-N 3.07Å; V48-F52 VanDerWaalsContact O-CA 3.26Å; V48-F52 WeakPolarHBondContact O-CA 3.43Å; V48-F52 PolarHBondContact O-N 3.24Å; V48-R56 HydrophobicContact CG2-CB 3.83Å; V48-P57 HydrophobicContact CG1-CG 4.13Å; V48-P57 HydrophobicContact CG2-CG 4.16Å; V48-L116 HydrophobicContact CB-CD2 3.9Å; V48-L116 HydrophobicContact CG1-CD1 4.29Å; V48-L116 HydrophobicContact CG1-CD2 3.85Å; V48-L116 HydrophobicContact CG2-CD2 4.35Å
49V77.2Confident79.6Confident55 Ų5568.7 Ų68.733%0.33334%0.335SS..Hα-helixtrans-84.3-51-173-1800000111.6Y45Y45-V49 HydrophobicContact CD2-CG2 3.97Å; Y45-V49 HydrophobicContact CE1-CB 4.49Å; Y45-V49 HydrophobicContact CE1-CG2 4.39Å; Y45-V49 HydrophobicContact CE2-CG2 3.71Å; Y45-V49 HydrophobicContact CG-CG2 4.44Å; Y45-V49 WeakPolarHBondContact O-CB 3.37Å; Y45-V49 WeakPolarHBondContact O-CG2 3.49Å; Y45-V49 PolarHBondContact O-N 3.14Å
50H79Confident80.2Confident118 Ų11865.3 Ų65.355%0.54631%0.307SS..THydrogen-bonded Turntrans-81.2-31.5-175.8-59.5102.7000112.9D46D46-H50 VanDerWaalsContact O-CB 3.28Å; D46-H50 WeakPolarHBondContact O-CB 3.48Å; D46-H50 PolarHBondContact O-N 3.01Å; D46-H50 IonicContact OD1-CE1 2.76Å; D46-H50 PolarHBondContact OD1-CE1 3.13Å; D46-H50 IonicContact OD1-CG 2.67Å; D46-H50 IonicContact OD1-ND1 3.45Å; D46-H50 PolarHBondContact OD1-ND1 3.16Å
51H82.4Confident80.9Confident110 Ų11058.8 Ų58.851%0.50928%0.284SS..SBendtrans-104.85.3-179.4-61.280.7000114.2D46 L47 Q53D46-H51 PolarHBondContact O-N 3.29Å; D46-H51 PolarHBondContact O-ND1 2.72Å; L47-H51 CarbonylContact O-C 3.43Å; L47-H51 WeakPolarHBondContact O-CB 3.41Å; H51-Q53 HydrophobicContact CB-CG 4.11Å; H51-Q53 PolarHBondContact O-N 3.24Å; H51-Q53 VanDerWaalsContact O-N 3.13Å
52F80.8Confident81.6Confident158 Ų15859.7 Ų59.769%0.69329%0.288SS*.  trans4938.9177.7-68.2-82.2000114.4V48 I54V48-F52 VanDerWaalsContact O-CA 3.26Å; V48-F52 WeakPolarHBondContact O-CA 3.43Å; V48-F52 PolarHBondContact O-N 3.24Å; F52-I54 VanDerWaalsContact C-N 3.29Å; F52-I54 PolarHBondContact O-N 2.9Å
53Q83.3Confident81.9Confident34 Ų3458.8 Ų58.816%0.15928%0.282CS..  trans-80.974.2178.7-59.9-1703.800111.3L47 H51 W55 R56L47-Q53 WeakPolarHBondContact O-CB 3.49Å; L47-Q53 WeakPolarHBondContact O-CG 3.42Å; L47-Q53 PolarHBondContact O-N 3.33Å; H51-Q53 HydrophobicContact CB-CG 4.11Å; H51-Q53 PolarHBondContact O-N 3.24Å; H51-Q53 VanDerWaalsContact O-N 3.13Å; Q53-W55 HydrophobicContact CB-CD2 4.29Å; Q53-W55 HydrophobicContact CB-CE3 4.41Å; Q53-W55 HydrophobicContact CB-CH2 3.88Å; Q53-W55 HydrophobicContact CB-CZ2 3.71Å; Q53-W55 HydrophobicContact CB-CZ3 4.22Å; Q53-W55 HydrophobicContact CG-CH2 3.6Å; Q53-W55 HydrophobicContact CG-CZ2 3.59Å; Q53-W55 HydrophobicContact CG-CZ3 4.31Å; Q53-W55 PolarHBondContact O-N 3.06Å; Q53-W55 VanDerWaalsContact O-N 3.08Å; Q53-R56 HydrophobicContact CB-CG 4.05Å; Q53-R56 WeakPolarHBondContact O-CB 3.36Å; Q53-R56 PolarHBondContact O-N 3.49Å
54I82.4Confident82.4Confident133 Ų13359.2 Ų59.268%0.68228%0.284SS*.THydrogen-bonded Turntrans-60.3-21.2-174.1-53.4170.1000112.8F52 R56 P57F52-I54 VanDerWaalsContact C-N 3.29Å; F52-I54 PolarHBondContact O-N 2.9Å; I54-R56 VanDerWaalsContact C-N 3.34Å; I54-P57 WeakPolarHBondContact O-CD 3.33Å
55W84.8Confident82.4Confident141 Ų14157.7 Ų57.753%0.53428%0.277SS..Hα-helixtrans-75.9-17.6176.763.686.2000113.7Q53 V58 T59Q53-W55 HydrophobicContact CB-CD2 4.29Å; Q53-W55 HydrophobicContact CB-CE3 4.41Å; Q53-W55 HydrophobicContact CB-CH2 3.88Å; Q53-W55 HydrophobicContact CB-CZ2 3.71Å; Q53-W55 HydrophobicContact CB-CZ3 4.22Å; Q53-W55 HydrophobicContact CG-CH2 3.6Å; Q53-W55 HydrophobicContact CG-CZ2 3.59Å; Q53-W55 HydrophobicContact CG-CZ3 4.31Å; Q53-W55 PolarHBondContact O-N 3.06Å; Q53-W55 VanDerWaalsContact O-N 3.08Å; W55-V58 PolarHBondContact O-N 3.45Å; W55-T59 WeakPolarHBondContact O-CG2 3.25Å; W55-T59 PolarHBondContact O-N 2.82Å; W55-T59 PolarHBondContact O-OG1 3.48Å
56R85.7Confident82.7Confident14 Ų1455 Ų555%0.05327%0.269CS..Hα-helixtrans-64.9-48.2-178.8-74.5-169.2-177.5-88.2-11.6113.4A39 W40 V42 L47 V48 Q53 I54 V58 T59 A60A39-R56 PolarHBondContact O-NH1 3Å; W40-R56 VanDerWaalsContact C-NH1 3.31Å; W40-R56 PolarHBondContact O-NH1 3.38Å; W40-R56 VanDerWaalsContact O-NH1 3.07Å; V42-R56 WeakPolarHBondContact O-CD 3.35Å; V42-R56 PolarHBondContact O-NH1 3.01Å; L47-R56 VanDerWaalsContact CD1-CZ 3.47Å; V48-R56 HydrophobicContact CG2-CB 3.83Å; Q53-R56 HydrophobicContact CB-CG 4.05Å; Q53-R56 WeakPolarHBondContact O-CB 3.36Å; Q53-R56 PolarHBondContact O-N 3.49Å; I54-R56 VanDerWaalsContact C-N 3.34Å; R56-V58 PolarHBondContact O-N 3.17Å; R56-T59 WeakPolarHBondContact CA-OG1 3.36Å; R56-T59 PolarHBondContact O-N 3.5Å; R56-T59 PolarHBondContact O-OG1 3.24Å; R56-T59 VanDerWaalsContact O-OG1 3.09Å; R56-A60 WeakPolarHBondContact O-CB 3.39Å; R56-A60 PolarHBondContact O-N 3.46Å
57P85.6Confident82.8Confident10 Ų1054.1 Ų54.17%0.06527%0.266CS..Hα-helixtrans-62.5-30177.1-20.531.8000113.6L43 V48 I54 W108 V112L43-P57 HydrophobicContact CD1-CB 3.78Å; L43-P57 HydrophobicContact CD1-CG 3.81Å; V48-P57 HydrophobicContact CG1-CG 4.13Å; V48-P57 HydrophobicContact CG2-CG 4.16Å; I54-P57 WeakPolarHBondContact O-CD 3.33Å; P57-W108 HydrophobicContact CB-CZ2 4.07Å; P57-W108 PolarHBondContact O-NE1 3.02Å; P57-V112 HydrophobicContact CB-CG1 3.98Å; P57-V112 HydrophobicContact CB-CG2 3.66Å; P57-V112 HydrophobicContact CG-CG1 4.26Å
58V87.3Confident82.8Confident64 Ų6457.9 Ų57.939%0.38829%0.293SS..Hα-helixtrans-71.4-47.1175-179.50000110.6W55 R56 L61 F62 W108W55-V58 PolarHBondContact O-N 3.45Å; R56-V58 PolarHBondContact O-N 3.17Å; V58-L61 WeakPolarHBondContact O-CB 3.42Å; V58-L61 PolarHBondContact O-N 3.3Å; V58-F62 HydrophobicContact CG1-CE2 4.28Å; V58-F62 VanDerWaalsContact O-CD2 3.26Å; V58-F62 WeakPolarHBondContact O-CD2 3.48Å; V58-W108 HydrophobicContact CB-CZ2 4.43Å; V58-W108 HydrophobicContact CG2-CH2 3.94Å; V58-W108 HydrophobicContact CG2-CZ2 3.56Å
59T86.3Confident82.8Confident25 Ų2565.6 Ų65.615%0.15333%0.328CS..Hα-helixtrans-71.2-30.9-179.751.40000112.9F41 W55 R56 L61 F62 I63F41-T59 HydrophobicContact CD1-CG2 3.59Å; F41-T59 HydrophobicContact CE1-CG2 3.82Å; W55-T59 WeakPolarHBondContact O-CG2 3.25Å; W55-T59 PolarHBondContact O-N 2.82Å; W55-T59 PolarHBondContact O-OG1 3.48Å; R56-T59 WeakPolarHBondContact CA-OG1 3.36Å; R56-T59 PolarHBondContact O-N 3.5Å; R56-T59 PolarHBondContact O-OG1 3.24Å; R56-T59 VanDerWaalsContact O-OG1 3.09Å; T59-L61 PolarHBondContact O-N 3.22Å; T59-F62 PolarHBondContact O-N 2.94Å; T59-I63 PolarHBondContact O-N 3.09Å; T59-I63 VanDerWaalsContact O-N 3.16Å
60A87.8Confident83.1Confident0 Ų064.1 Ų64.10%032%0.319CS..Hα-helixtrans-62.8-20.317400000113.7F41 L43 R56 L123F41-A60 WeakPolarHBondContact O-CA 3.38Å; F41-A60 PolarHBondContact O-N 2.76Å; L43-A60 HydrophobicContact CB-CB 3.94Å; R56-A60 WeakPolarHBondContact O-CB 3.39Å; R56-A60 PolarHBondContact O-N 3.46Å; A60-L123 HydrophobicContact CB-CD1 4.16Å; A60-L123 HydrophobicContact CB-CG 4.2Å; A60-L123 PolarHBondContact O-N 2.94Å; A60-L123 VanDerWaalsContact O-N 3.07Å
61L89.8Confident83.4Confident20 Ų2059.3 Ų59.311%0.10530%0.302CS..Hα-helixtrans-72.7-32.2173.2176.3151.9000112W20 V58 T59 W108 L124 M127W20-L61 VanDerWaalsContact NE1-CD2 3.35Å; V58-L61 WeakPolarHBondContact O-CB 3.42Å; V58-L61 PolarHBondContact O-N 3.3Å; T59-L61 PolarHBondContact O-N 3.22Å; L61-W108 HydrophobicContact CD1-CB 4.27Å; L61-W108 HydrophobicContact CD1-CG 4.01Å; L61-L124 WeakPolarHBondContact O-CB 3.4Å; L61-L124 VanDerWaalsContact O-CD1 3.31Å; L61-L124 WeakPolarHBondContact O-CD1 3.42Å; L61-M127 HydrophobicContact CD1-CE 4.04Å; L61-M127 HydrophobicContact CD1-CG 4.27Å
62F89.6Confident83.6Confident51 Ų5160.1 Ų60.122%0.22430%0.304CS..Hα-helixtrans-98.4-20-174.9-60.5-82.2000113.7W20 T24 L27 V58 T59W20-F62 AromaticContact CD1-CE1 3.93Å; T24-F62 WeakPolarHBondContact CA-O 3.3Å; T24-F62 HydrophobicContact CG2-CD1 4.22Å; L27-F62 HydrophobicContact CD1-CB 3.37Å; L27-F62 HydrophobicContact CD1-CD2 4.4Å; L27-F62 HydrophobicContact CD1-CG 4.03Å; V58-F62 HydrophobicContact CG1-CE2 4.28Å; V58-F62 VanDerWaalsContact O-CD2 3.26Å; V58-F62 WeakPolarHBondContact O-CD2 3.48Å; T59-F62 PolarHBondContact O-N 2.94Å
63I86.5Confident83.9Confident1 Ų153.3 Ų53.31%0.00527%0.274CS..  trans-92140.7-177.7-160.4164.6000112.5A31 V38 F41 T59 F122A31-I63 HydrophobicContact CB-CD1 4.46Å; V38-I63 HydrophobicContact CB-CD1 4.27Å; V38-I63 HydrophobicContact CG1-CD1 3.94Å; V38-I63 HydrophobicContact CG2-CD1 4.33Å; F41-I63 HydrophobicContact CB-CB 4.22Å; F41-I63 HydrophobicContact CB-CD1 3.65Å; F41-I63 HydrophobicContact CB-CG2 3.86Å; F41-I63 HydrophobicContact CD2-CD1 3.57Å; F41-I63 HydrophobicContact CG-CD1 4.04Å; T59-I63 PolarHBondContact O-N 3.09Å; T59-I63 VanDerWaalsContact O-N 3.16Å; I63-F122 HydrophobicContact CG2-CD1 4.31Å
64Y85.3Confident84.3Confident11 Ų1152.4 Ų52.44%0.04327%0.27CS..  trans-137.7138.4168.4-169.1-89.4000109.4I66 Q73 Y74 L124Y64-I66 PolarHBondContact O-N 3.01Å; Y64-Q73 PolarHBondContact OH-NE2 3.36Å; Y64-Q73 PolarHBondContact OH-OE1 2.95Å; Y64-Y74 AromaticContact CD1-CD2 3.7Å; Y64-Y74 HydrophobicContact CD1-CD2 3.7Å; Y64-Y74 HydrophobicContact CD1-CG 4.02Å; Y64-Y74 AromaticContact CG-CD2 3.95Å; Y64-Y74 HydrophobicContact CG-CD2 3.95Å; Y64-L124 HydrophobicContact CD2-CD2 4.37Å; Y64-L124 HydrophobicContact CG-CD2 4.42Å
65P79.2Confident84.7Confident26 Ų2651 Ų5117%0.16926%0.263CS..  trans-72117.1-175.530.2-33.8000110.2T67 T70 F122P65-T67 PolarHBondContact O-N 3.27Å; P65-T70 PolarHBondContact O-OG1 3.33Å; P65-F122 HydrophobicContact CB-CE1 4.29Å; P65-F122 HydrophobicContact CB-CE2 4.45Å; P65-F122 HydrophobicContact CB-CZ 3.88Å; P65-F122 HydrophobicContact CG-CD2 4.24Å; P65-F122 HydrophobicContact CG-CE1 3.99Å; P65-F122 HydrophobicContact CG-CE2 3.65Å; P65-F122 HydrophobicContact CG-CZ 3.52Å
66I77.3Confident85Confident46 Ų4644.8 Ų44.824%0.23624%0.24CC..  trans-90.187.9173.4-55.3178.8000108.9P28 R32 Y64 Y74P28-I66 HydrophobicContact CB-CD1 3.41Å; P28-I66 VanDerWaalsContact CB-CD1 3.41Å; P28-I66 HydrophobicContact CB-CG1 3.9Å; R32-I66 PolarHBondContact NH1-O 3.07Å; Y64-I66 PolarHBondContact O-N 3.01Å; I66-Y74 HydrophobicContact CD1-CD1 4.32Å; I66-Y74 HydrophobicContact CD1-CE1 4.09Å; I66-Y74 HydrophobicContact CG1-CD1 4.33Å; I66-Y74 HydrophobicContact CG1-CG 4.47Å
67T76.8Confident85.3Confident57 Ų5744.1 Ų44.135%0.3524%0.238SC..  trans-100.6157.2165.672.50000109.4P65 Q69 T70 G71P65-T67 PolarHBondContact O-N 3.27Å; T67-Q69 PolarHBondContact O-N 3.13Å; T67-T70 PolarHBondContact N-OG1 3.15Å; T67-T70 PolarHBondContact O-N 3.01Å; T67-T70 PolarHBondContact O-OG1 2.88Å; T67-T70 WeakPolarHBondContact OG1-CB 3.43Å; T67-T70 WeakPolarHBondContact OG1-CG2 3.17Å; T67-T70 PolarHBondContact OG1-N 3.14Å; T67-T70 PolarHBondContact OG1-OG1 3.21Å; T67-G71 PolarHBondContact O-N 3.2Å
68P75Confident85.7Confident122 Ų12245.3 Ų45.379%0.79224%0.243SC*.THydrogen-bonded Turntrans-53.8-29.3177.3-26.535.4000113.7
69Q77.6Confident86Confident182 Ų18247.1 Ų47.185%0.8524%0.244SC*.THydrogen-bonded Turntrans-83-31.7178.4-63.8179-11.300113.1T67T67-Q69 PolarHBondContact O-N 3.13Å
70T82.5Confident86.3Confident23 Ų2346 Ų4614%0.14124%0.237CC..THydrogen-bonded Turntrans-98.1-8.8-176.758.70000113.8P65 T67 F72 Q73 Y74P65-T70 PolarHBondContact O-OG1 3.33Å; T67-T70 PolarHBondContact N-OG1 3.15Å; T67-T70 PolarHBondContact O-N 3.01Å; T67-T70 PolarHBondContact O-OG1 2.88Å; T67-T70 WeakPolarHBondContact OG1-CB 3.43Å; T67-T70 WeakPolarHBondContact OG1-CG2 3.17Å; T67-T70 PolarHBondContact OG1-N 3.14Å; T67-T70 PolarHBondContact OG1-OG1 3.21Å; T70-F72 VanDerWaalsContact C-N 3.32Å; T70-F72 PolarHBondContact O-N 3.32Å; T70-Q73 WeakPolarHBondContact O-CB 3.44Å; T70-Q73 PolarHBondContact O-N 2.95Å; T70-Y74 PolarHBondContact O-N 2.86Å
71G85Confident86.7Confident18 Ų1846.2 Ų46.219%0.18624%0.238CC..Hα-helixtrans-59.6-38.4-176.900000113.4T67 Y74 L75T67-G71 PolarHBondContact O-N 3.2Å; G71-Y74 WeakPolarHBondContact O-CB 3.5Å; G71-Y74 PolarHBondContact O-N 3.25Å; G71-L75 WeakPolarHBondContact O-CG 3.4Å; G71-L75 PolarHBondContact O-N 2.82Å; G71-L75 VanDerWaalsContact O-N 3.11Å
72F87.5Confident87Confident126 Ų12647.9 Ų47.955%0.55324%0.243SC*.Hα-helixtrans-66.6-43.7176-175.1-110000112.2T70 Y74 L75 I76 L168T70-F72 VanDerWaalsContact C-N 3.32Å; T70-F72 PolarHBondContact O-N 3.32Å; F72-Y74 VanDerWaalsContact C-N 3.29Å; F72-Y74 PolarHBondContact O-N 3.18Å; F72-L75 PolarHBondContact O-N 3.34Å; F72-I76 HydrophobicContact CD1-CD1 3.73Å; F72-I76 HydrophobicContact CE1-CD1 3.21Å; F72-I76 HydrophobicContact CE1-CG1 4.25Å; F72-I76 HydrophobicContact CE2-CD1 4.38Å; F72-I76 HydrophobicContact CZ-CD1 3.59Å; F72-I76 HydrophobicContact CZ-CG1 4.29Å; F72-I76 PolarHBondContact O-N 3.03Å; F72-I76 VanDerWaalsContact O-N 3.08Å; F72-L168 HydrophobicContact CD1-CD1 4.22Å; F72-L168 HydrophobicContact CD1-CD2 3.92Å; F72-L168 HydrophobicContact CE1-CD1 3.88Å; F72-L168 HydrophobicContact CE1-CD2 3.51Å; F72-L168 HydrophobicContact CE1-CG 4.3Å
73Q87.1Confident87.1Confident16 Ų1646.8 Ų46.88%0.07524%0.239CC..Hα-helixtrans-60.7-40.3175.5-171.7-175.4-500111.2Y64 T70 I76 M77 N165Y64-Q73 PolarHBondContact OH-NE2 3.36Å; Y64-Q73 PolarHBondContact OH-OE1 2.95Å; T70-Q73 WeakPolarHBondContact O-CB 3.44Å; T70-Q73 PolarHBondContact O-N 2.95Å; Q73-I76 PolarHBondContact O-N 2.71Å; Q73-M77 HydrophobicContact CG-CE 4.48Å; Q73-M77 VanDerWaalsContact O-CG 3.29Å; Q73-M77 WeakPolarHBondContact O-CG 3.35Å; Q73-M77 PolarHBondContact O-N 2.81Å; Q73-N165 PolarHBondContact NE2-OD1 2.99Å
74Y90.5Very high87.4Confident15 Ų1547 Ų476%0.05924%0.24CC..Hα-helixtrans-58.6-47.2174.4167.3-107.8000112.6T24 V25 P28 Y64 I66 T70 G71 F72 I76 M77 L78T24-Y74 PolarHBondContact O-OH 3.45Å; V25-Y74 WeakPolarHBondContact CA-OH 3.41Å; P28-Y74 HydrophobicContact CB-CE2 4.36Å; P28-Y74 HydrophobicContact CG-CE2 4.13Å; Y64-Y74 AromaticContact CD1-CD2 3.7Å; Y64-Y74 HydrophobicContact CD1-CD2 3.7Å; Y64-Y74 HydrophobicContact CD1-CG 4.02Å; Y64-Y74 AromaticContact CG-CD2 3.95Å; Y64-Y74 HydrophobicContact CG-CD2 3.95Å; I66-Y74 HydrophobicContact CD1-CD1 4.32Å; I66-Y74 HydrophobicContact CD1-CE1 4.09Å; I66-Y74 HydrophobicContact CG1-CD1 4.33Å; I66-Y74 HydrophobicContact CG1-CG 4.47Å; T70-Y74 PolarHBondContact O-N 2.86Å; G71-Y74 WeakPolarHBondContact O-CB 3.5Å; G71-Y74 PolarHBondContact O-N 3.25Å; F72-Y74 VanDerWaalsContact C-N 3.29Å; F72-Y74 PolarHBondContact O-N 3.18Å; Y74-I76 VanDerWaalsContact C-N 3.29Å; Y74-I76 PolarHBondContact O-N 3.29Å; Y74-M77 PolarHBondContact O-N 3.35Å; Y74-M77 VanDerWaalsContact O-N 3.15Å; Y74-L78 HydrophobicContact CE1-CD1 4.31Å; Y74-L78 WeakPolarHBondContact O-CB 3.26Å; Y74-L78 PolarHBondContact O-N 3.1Å
75L91.8Very high87.9Confident102 Ų10246.5 Ų46.553%0.53424%0.239SC..Hα-helixtrans-61.9-38.8178.2-68.1177.3000111.9G71 F72 L78 Y79G71-L75 WeakPolarHBondContact O-CG 3.4Å; G71-L75 PolarHBondContact O-N 2.82Å; G71-L75 VanDerWaalsContact O-N 3.11Å; F72-L75 PolarHBondContact O-N 3.34Å; L75-L78 PolarHBondContact O-N 3.26Å; L75-Y79 PolarHBondContact O-N 3.43Å
76I91.2Very high88.6Confident11 Ų1146.5 Ų46.56%0.05624%0.238CC..Hα-helixtrans-64.1-43.9174-74.2173.9000111.2F72 Q73 Y74 L78 Y79 F80 Y147 L168F72-I76 HydrophobicContact CD1-CD1 3.73Å; F72-I76 HydrophobicContact CE1-CD1 3.21Å; F72-I76 HydrophobicContact CE1-CG1 4.25Å; F72-I76 HydrophobicContact CE2-CD1 4.38Å; F72-I76 HydrophobicContact CZ-CD1 3.59Å; F72-I76 HydrophobicContact CZ-CG1 4.29Å; F72-I76 PolarHBondContact O-N 3.03Å; F72-I76 VanDerWaalsContact O-N 3.08Å; Q73-I76 PolarHBondContact O-N 2.71Å; Y74-I76 VanDerWaalsContact C-N 3.29Å; Y74-I76 PolarHBondContact O-N 3.29Å; I76-L78 VanDerWaalsContact C-N 3.3Å; I76-L78 PolarHBondContact O-N 2.85Å; I76-Y79 WeakPolarHBondContact O-CB 3.34Å; I76-Y79 PolarHBondContact O-N 2.97Å; I76-Y79 VanDerWaalsContact O-N 3.17Å; I76-F80 HydrophobicContact CG2-CD2 3.77Å; I76-F80 HydrophobicContact CG2-CE2 3.21Å; I76-F80 HydrophobicContact CG2-CZ 3.65Å; I76-F80 WeakPolarHBondContact O-CG 3.28Å; I76-F80 PolarHBondContact O-N 2.69Å; I76-Y147 HydrophobicContact CD1-CE2 4.44Å; I76-Y147 WeakPolarHBondContact CG2-OH 3.41Å; I76-L168 HydrophobicContact CD1-CD1 3.37Å
77M91.5Very high89.4Confident1 Ų148.2 Ų48.21%0.00524%0.241CC..Hα-helixtrans-62.1-40.7177.2-71.8-62.8147.400111.7Q73 Y74 Y79 F80 L81 E125 N165Q73-M77 HydrophobicContact CG-CE 4.48Å; Q73-M77 VanDerWaalsContact O-CG 3.29Å; Q73-M77 WeakPolarHBondContact O-CG 3.35Å; Q73-M77 PolarHBondContact O-N 2.81Å; Y74-M77 PolarHBondContact O-N 3.35Å; Y74-M77 VanDerWaalsContact O-N 3.15Å; M77-Y79 VanDerWaalsContact C-N 3.34Å; M77-F80 PolarHBondContact O-N 3.45Å; M77-L81 VanDerWaalsContact O-CB 3.31Å; M77-L81 WeakPolarHBondContact O-CB 3.38Å; M77-L81 PolarHBondContact O-N 3.47Å; M77-E125 HydrophobicContact SD-CG 4.46Å; M77-N165 VanDerWaalsContact CE-OD1 3.32Å; M77-N165 WeakPolarHBondContact CE-OD1 3.47Å
78L94Very high90.1Very high35 Ų3545.5 Ų45.518%0.18323%0.225CC..Hα-helixtrans-63-40.1174.2178.5158.1000111.8F21 V25 Y74 L75 I76 Y82F21-L78 HydrophobicContact CD2-CG 4.33Å; F21-L78 HydrophobicContact CE2-CD1 4.31Å; F21-L78 HydrophobicContact CE2-CD2 3.39Å; F21-L78 HydrophobicContact CE2-CG 3.51Å; F21-L78 HydrophobicContact CZ-CD1 4.38Å; F21-L78 HydrophobicContact CZ-CD2 3.66Å; F21-L78 HydrophobicContact CZ-CG 3.99Å; V25-L78 HydrophobicContact CG2-CD1 3.48Å; V25-L78 VanDerWaalsContact CG2-CD1 3.48Å; V25-L78 HydrophobicContact CG2-CG 4.37Å; Y74-L78 HydrophobicContact CE1-CD1 4.31Å; Y74-L78 WeakPolarHBondContact O-CB 3.26Å; Y74-L78 PolarHBondContact O-N 3.1Å; L75-L78 PolarHBondContact O-N 3.26Å; I76-L78 VanDerWaalsContact C-N 3.3Å; I76-L78 PolarHBondContact O-N 2.85Å; L78-Y82 WeakPolarHBondContact O-CB 3.31Å; L78-Y82 PolarHBondContact O-N 3.46Å
79Y93.7Very high90.9Very high101 Ų10140.4 Ų40.440%0.39619%0.19SC..Hα-helixtrans-62.8-44.7173.6171.7-92.8000111.9L75 I76 M77 Y82 N83L75-Y79 PolarHBondContact O-N 3.43Å; I76-Y79 WeakPolarHBondContact O-CB 3.34Å; I76-Y79 PolarHBondContact O-N 2.97Å; I76-Y79 VanDerWaalsContact O-N 3.17Å; M77-Y79 VanDerWaalsContact C-N 3.34Å; Y79-Y82 PolarHBondContact O-N 3.02Å; Y79-N83 WeakPolarHBondContact CD2-ND2 3.29Å; Y79-N83 WeakPolarHBondContact CE2-ND2 3.5Å; Y79-N83 VanDerWaalsContact CZ-ND2 3.3Å; Y79-N83 WeakPolarHBondContact O-CB 3.32Å; Y79-N83 PolarHBondContact O-N 3.39Å; Y79-N83 PolarHBondContact O-ND2 3.14Å
80F93.8Very high91.6Very high2 Ų234.7 Ų34.71%0.00917%0.168CC..Hα-helixtrans-67.8-41.7178.4-67.8-28.3000112.8I76 M77 Y84 V128 L132 F146 Y147 L161I76-F80 HydrophobicContact CG2-CD2 3.77Å; I76-F80 HydrophobicContact CG2-CE2 3.21Å; I76-F80 HydrophobicContact CG2-CZ 3.65Å; I76-F80 WeakPolarHBondContact O-CG 3.28Å; I76-F80 PolarHBondContact O-N 2.69Å; M77-F80 PolarHBondContact O-N 3.45Å; F80-Y84 HydrophobicContact CB-CD2 3.98Å; F80-Y84 HydrophobicContact CB-CE2 4.26Å; F80-Y84 HydrophobicContact CD1-CD2 4.11Å; F80-Y84 AromaticContact CD1-CE2 3.53Å; F80-Y84 HydrophobicContact CD1-CE2 3.53Å; F80-Y84 HydrophobicContact CE1-CE2 4.21Å; F80-Y84 HydrophobicContact CG-CD2 4.35Å; F80-Y84 HydrophobicContact CG-CE2 4.12Å; F80-Y84 WeakPolarHBondContact O-CB 3.44Å; F80-Y84 VanDerWaalsContact O-CD2 3.3Å; F80-Y84 WeakPolarHBondContact O-CD2 3.32Å; F80-Y84 PolarHBondContact O-N 3.49Å; F80-V128 HydrophobicContact CB-CG1 3.84Å; F80-L132 HydrophobicContact CB-CD1 4.42Å; F80-L132 HydrophobicContact CG-CD1 4.39Å; F80-F146 HydrophobicContact CE1-CE2 4.45Å; F80-F146 HydrophobicContact CZ-CE2 4.18Å; F80-Y147 HydrophobicContact CE1-CE2 4.39Å; F80-Y147 AromaticContact CZ-CE2 3.86Å; F80-Y147 HydrophobicContact CZ-CE2 3.86Å; F80-Y147 AromaticContact CZ-CZ 3.99Å; F80-Y147 WeakPolarHBondContact CZ-OH 3.3Å; F80-L161 HydrophobicContact CD2-CD1 4.12Å; F80-L161 HydrophobicContact CD2-CD2 4.37Å; F80-L161 HydrophobicContact CE1-CD2 4.08Å; F80-L161 HydrophobicContact CE2-CD1 3.87Å; F80-L161 HydrophobicContact CE2-CD2 3.35Å; F80-L161 HydrophobicContact CE2-CG 4.24Å; F80-L161 HydrophobicContact CZ-CD1 4.24Å; F80-L161 HydrophobicContact CZ-CD2 3.19Å; F80-L161 HydrophobicContact CZ-CG 4.35Å
81L95Very high91.9Very high4 Ų437.2 Ų37.22%0.02118%0.181CC..Iπ-helixtrans-51.4-61.2170.8174.665.2000109W20 F21 T24 M77 N83 S85 V128W20-L81 HydrophobicContact CD2-CD1 3.39Å; W20-L81 VanDerWaalsContact CE2-CD1 3.47Å; W20-L81 HydrophobicContact CE3-CD1 3.35Å; W20-L81 HydrophobicContact CG-CD1 4.13Å; W20-L81 HydrophobicContact CH2-CD1 3.47Å; W20-L81 VanDerWaalsContact CH2-CD1 3.47Å; W20-L81 HydrophobicContact CZ2-CD1 3.52Å; W20-L81 HydrophobicContact CZ3-CD1 3.37Å; F21-L81 HydrophobicContact CB-CD2 4.43Å; F21-L81 HydrophobicContact CD2-CD2 4.25Å; T24-L81 HydrophobicContact CG2-CD2 3.99Å; T24-L81 VanDerWaalsContact OG1-CD2 3.29Å; T24-L81 WeakPolarHBondContact OG1-CD2 3.37Å; M77-L81 VanDerWaalsContact O-CB 3.31Å; M77-L81 WeakPolarHBondContact O-CB 3.38Å; M77-L81 PolarHBondContact O-N 3.47Å; L81-N83 PolarHBondContact O-N 3.25Å; L81-S85 WeakPolarHBondContact O-CA 3.27Å; L81-S85 WeakPolarHBondContact O-CB 3.27Å; L81-S85 PolarHBondContact O-N 2.84Å; L81-S85 PolarHBondContact O-OG 3.34Å; L81-V128 HydrophobicContact CB-CG1 4.39Å; L81-V128 HydrophobicContact CB-CG2 3.89Å; L81-V128 HydrophobicContact CD1-CG2 3.96Å; L81-V128 HydrophobicContact CG-CG2 4.42Å
82Y95.4Very high92Very high56 Ų5637.8 Ų37.822%0.2218%0.181CC..Iπ-helixtrans-55-50.9-177.5180-99.4000113.3W9 V13 F21 L78 Y79 T86W9-Y82 AromaticContact CE2-CE2 3.98Å; W9-Y82 AromaticContact CE2-CZ 3.98Å; W9-Y82 HydrophobicContact CH2-CD2 4.39Å; W9-Y82 HydrophobicContact CH2-CE2 4.03Å; W9-Y82 AromaticContact CZ2-CD2 3.96Å; W9-Y82 HydrophobicContact CZ2-CD2 3.96Å; W9-Y82 HydrophobicContact CZ2-CE1 4.49Å; W9-Y82 AromaticContact CZ2-CE2 3.31Å; W9-Y82 HydrophobicContact CZ2-CE2 3.31Å; W9-Y82 AromaticContact CZ2-CZ 3.64Å; W9-Y82 AromaticContact NE1-CZ 3.82Å; W9-Y82 PolarHBondContact NE1-OH 2.76Å; W9-Y82 VanDerWaalsContact NE1-OH 3.07Å; V13-Y82 HydrophobicContact CG1-CE2 4.3Å; V13-Y82 HydrophobicContact CG2-CE2 3.61Å; F21-Y82 HydrophobicContact CD2-CD2 4.19Å; F21-Y82 HydrophobicContact CE2-CD2 4.17Å; F21-Y82 HydrophobicContact CE2-CG 4.36Å; L78-Y82 WeakPolarHBondContact O-CB 3.31Å; L78-Y82 PolarHBondContact O-N 3.46Å; Y79-Y82 PolarHBondContact O-N 3.02Å; Y82-T86 WeakPolarHBondContact O-CB 3.3Å; Y82-T86 PolarHBondContact O-N 3.21Å; Y82-T86 PolarHBondContact O-OG1 2.73Å
83N92.8Very high92Very high27 Ų2732.1 Ų32.114%0.14416%0.156CC..Iπ-helixtrans-72.9-46.7-172.4-79.3-91.1000112.9Y79 L81 R87Y79-N83 WeakPolarHBondContact CD2-ND2 3.29Å; Y79-N83 WeakPolarHBondContact CE2-ND2 3.5Å; Y79-N83 VanDerWaalsContact CZ-ND2 3.3Å; Y79-N83 WeakPolarHBondContact O-CB 3.32Å; Y79-N83 PolarHBondContact O-N 3.39Å; Y79-N83 PolarHBondContact O-ND2 3.14Å; L81-N83 PolarHBondContact O-N 3.25Å; N83-R87 WeakPolarHBondContact O-CB 3.26Å; N83-R87 WeakPolarHBondContact O-CG 3.36Å; N83-R87 PolarHBondContact O-N 3.46Å
84Y93.4Very high91.9Very high6 Ų635 Ų352%0.02418%0.175CC..Iπ-helixtrans-83.7-34.1-174.5-64.1-68.2000112.1F80 L88 L132 W135 L157F80-Y84 HydrophobicContact CB-CD2 3.98Å; F80-Y84 HydrophobicContact CB-CE2 4.26Å; F80-Y84 HydrophobicContact CD1-CD2 4.11Å; F80-Y84 AromaticContact CD1-CE2 3.53Å; F80-Y84 HydrophobicContact CD1-CE2 3.53Å; F80-Y84 HydrophobicContact CE1-CE2 4.21Å; F80-Y84 HydrophobicContact CG-CD2 4.35Å; F80-Y84 HydrophobicContact CG-CE2 4.12Å; F80-Y84 WeakPolarHBondContact O-CB 3.44Å; F80-Y84 VanDerWaalsContact O-CD2 3.3Å; F80-Y84 WeakPolarHBondContact O-CD2 3.32Å; F80-Y84 PolarHBondContact O-N 3.49Å; Y84-L88 VanDerWaalsContact O-CB 3.25Å; Y84-L88 WeakPolarHBondContact O-CB 3.21Å; Y84-L88 PolarHBondContact O-N 3.26Å; Y84-L132 HydrophobicContact CD2-CB 4.31Å; Y84-L132 HydrophobicContact CD2-CD1 3.41Å; Y84-L132 VanDerWaalsContact CD2-CD1 3.41Å; Y84-L132 HydrophobicContact CD2-CG 3.88Å; Y84-L132 HydrophobicContact CE2-CD1 3.45Å; Y84-L132 VanDerWaalsContact CE2-CD1 3.45Å; Y84-L132 HydrophobicContact CE2-CG 4.13Å; Y84-L132 HydrophobicContact CG-CB 4.34Å; Y84-L132 HydrophobicContact CG-CD1 4.13Å; Y84-L132 HydrophobicContact CG-CG 4.08Å; Y84-W135 AromaticContact CD1-CD2 3.85Å; Y84-W135 HydrophobicContact CD1-CD2 3.85Å; Y84-W135 AromaticContact CD1-CE3 3.53Å; Y84-W135 HydrophobicContact CD1-CE3 3.53Å; Y84-W135 HydrophobicContact CD1-CG 4.4Å; Y84-W135 AromaticContact CD1-CZ3 3.93Å; Y84-W135 HydrophobicContact CD1-CZ3 3.93Å; Y84-W135 HydrophobicContact CE1-CD2 4.41Å; Y84-W135 AromaticContact CE1-CE3 3.7Å; Y84-W135 HydrophobicContact CE1-CE3 3.7Å; Y84-W135 HydrophobicContact CE1-CH2 4.26Å; Y84-W135 AromaticContact CE1-CZ3 3.63Å; Y84-W135 HydrophobicContact CE1-CZ3 3.63Å; Y84-L157 HydrophobicContact CE1-CD1 4.25Å; Y84-L157 HydrophobicContact CE2-CD2 4.42Å; Y84-L157 WeakPolarHBondContact OH-CD1 3.25Å
85S94.3Very high91.6Very high1 Ų135.7 Ų35.71%0.00719%0.188CC..Iπ-helixtrans-71-40.5177.692.70000110.9T17 L81 L88 E89 Y100T17-S85 WeakPolarHBondContact CB-OG 3.27Å; T17-S85 WeakPolarHBondContact CG2-OG 3.27Å; T17-S85 PolarHBondContact OG1-O 3.43Å; T17-S85 PolarHBondContact OG1-OG 3.45Å; L81-S85 WeakPolarHBondContact O-CA 3.27Å; L81-S85 WeakPolarHBondContact O-CB 3.27Å; L81-S85 PolarHBondContact O-N 2.84Å; L81-S85 PolarHBondContact O-OG 3.34Å; S85-L88 PolarHBondContact O-N 2.83Å; S85-E89 WeakPolarHBondContact O-CB 3.29Å; S85-E89 PolarHBondContact O-N 3.44Å; S85-Y100 VanDerWaalsContact CB-OH 3.25Å; S85-Y100 WeakPolarHBondContact CB-OH 3.17Å
86T94.5Very high91.3Very high25 Ų2534 Ų3415%0.15317%0.174CC..Hα-helixtrans-58.9-50.9172.1-62.40000110.7P14 T17 Y82 L88 E89 T90P14-T86 HydrophobicContact CG-CG2 3.96Å; T17-T86 WeakPolarHBondContact CG2-OG1 3.27Å; Y82-T86 WeakPolarHBondContact O-CB 3.3Å; Y82-T86 PolarHBondContact O-N 3.21Å; Y82-T86 PolarHBondContact O-OG1 2.73Å; T86-L88 VanDerWaalsContact C-N 3.3Å; T86-L88 PolarHBondContact O-N 3.48Å; T86-E89 PolarHBondContact O-N 3.41Å; T86-T90 HydrophobicContact CG2-CG2 4.3Å; T86-T90 WeakPolarHBondContact O-CG2 3.41Å; T86-T90 PolarHBondContact O-N 3.12Å; T86-T90 PolarHBondContact O-OG1 3.07Å
87R93.2Very high91.2Very high83 Ų8334.5 Ų34.531%0.31318%0.178SC..Hα-helixtrans-62.4-35.9178.4-74.8177.9-167.8134.46.6112.7N83 T90 D91N83-R87 WeakPolarHBondContact O-CB 3.26Å; N83-R87 WeakPolarHBondContact O-CG 3.36Å; N83-R87 PolarHBondContact O-N 3.46Å; R87-T90 WeakPolarHBondContact CA-OG1 3.44Å; R87-T90 PolarHBondContact O-OG1 3.13Å; R87-D91 WeakPolarHBondContact CB-OD2 3.27Å; R87-D91 WeakPolarHBondContact O-CA 3.17Å; R87-D91 WeakPolarHBondContact O-CB 3.38Å; R87-D91 PolarHBondContact O-N 2.99Å
88L92.1Very high91Very high0 Ų034.5 Ų34.50%018%0.178CC..Iπ-helixtrans-68.3-41.7177-165.670.4000111.1Y84 S85 T86 V92 F93 Y100 M103 V131 V134 W135Y84-L88 VanDerWaalsContact O-CB 3.25Å; Y84-L88 WeakPolarHBondContact O-CB 3.21Å; Y84-L88 PolarHBondContact O-N 3.26Å; S85-L88 PolarHBondContact O-N 2.83Å; T86-L88 VanDerWaalsContact C-N 3.3Å; T86-L88 PolarHBondContact O-N 3.48Å; L88-V92 HydrophobicContact CD1-CB 3.8Å; L88-V92 HydrophobicContact CD1-CG1 4.27Å; L88-V92 HydrophobicContact CD1-CG2 3.54Å; L88-V92 HydrophobicContact CG-CB 4.43Å; L88-V92 WeakPolarHBondContact O-CB 3.19Å; L88-V92 PolarHBondContact O-N 2.79Å; L88-F93 HydrophobicContact CG-CD2 4.31Å; L88-F93 HydrophobicContact CG-CE2 4.18Å; L88-F93 WeakPolarHBondContact O-CD2 3.43Å; L88-F93 PolarHBondContact O-N 3.11Å; L88-F93 VanDerWaalsContact O-N 3.14Å; L88-Y100 HydrophobicContact CB-CE2 4.33Å; L88-Y100 HydrophobicContact CD2-CD2 4.41Å; L88-Y100 HydrophobicContact CD2-CE2 4.04Å; L88-Y100 HydrophobicContact CG-CD2 4.5Å; L88-Y100 HydrophobicContact CG-CE2 4.33Å; L88-M103 HydrophobicContact CD2-CE 3.33Å; L88-M103 HydrophobicContact CD2-SD 4.5Å; L88-M103 HydrophobicContact CG-CE 4.45Å; L88-V131 HydrophobicContact CD2-CG1 3.78Å; L88-V134 HydrophobicContact CD1-CG1 4Å; L88-V134 HydrophobicContact CD2-CB 4.35Å; L88-V134 HydrophobicContact CD2-CG1 4.12Å; L88-W135 HydrophobicContact CB-CB 4.48Å; L88-W135 HydrophobicContact CD1-CB 3.83Å; L88-W135 HydrophobicContact CD1-CG 4.4Å
89E93Very high90.7Very high14 Ų1432.8 Ų32.87%0.06517%0.169CC..Iπ-helixtrans-67.4-35.7176.5-166.4169.7171.900112.4P14 I16 T17 S85 T86 F93 Y100P14-E89 HydrophobicContact CB-CB 4.22Å; P14-E89 HydrophobicContact CB-CG 3.75Å; P14-E89 VanDerWaalsContact CB-OE1 3.3Å; P14-E89 WeakPolarHBondContact CB-OE1 3.44Å; P14-E89 VanDerWaalsContact CB-OE2 3.31Å; P14-E89 WeakPolarHBondContact CB-OE2 3.35Å; P14-E89 HydrophobicContact CG-CB 4.47Å; P14-E89 HydrophobicContact CG-CG 4.45Å; I16-E89 WeakPolarHBondContact CB-OE1 3.34Å; I16-E89 PolarHBondContact N-OE1 2.95Å; I16-E89 VanDerWaalsContact N-OE1 3.16Å; T17-E89 VanDerWaalsContact CB-OE2 3.22Å; T17-E89 WeakPolarHBondContact CB-OE2 3.46Å; T17-E89 PolarHBondContact N-OE2 3.41Å; T17-E89 PolarHBondContact OG1-OE2 3.45Å; S85-E89 WeakPolarHBondContact O-CB 3.29Å; S85-E89 PolarHBondContact O-N 3.44Å; T86-E89 PolarHBondContact O-N 3.41Å; E89-F93 CarbonylContact O-C 3.22Å; E89-F93 VanDerWaalsContact O-O 3.05Å; E89-Y100 HydrophobicContact CB-CD1 3.93Å; E89-Y100 HydrophobicContact CB-CD2 4.41Å; E89-Y100 HydrophobicContact CB-CE1 3.92Å; E89-Y100 HydrophobicContact CB-CE2 4.43Å; E89-Y100 HydrophobicContact CB-CG 4.17Å; E89-Y100 HydrophobicContact CG-CD1 3.61Å; E89-Y100 HydrophobicContact CG-CE1 3.94Å; E89-Y100 HydrophobicContact CG-CG 4.08Å; E89-Y100 WeakPolarHBondContact OE2-CE1 3.43Å
90T91.3Very high90.6Very high62 Ų6228 Ų2838%0.3815%0.15SC..Iπ-helixtrans-86.5-42.1180580000114.2P14 T86 R87 P94P14-T90 HydrophobicContact CG-CG2 3.73Å; T86-T90 HydrophobicContact CG2-CG2 4.3Å; T86-T90 WeakPolarHBondContact O-CG2 3.41Å; T86-T90 PolarHBondContact O-N 3.12Å; T86-T90 PolarHBondContact O-OG1 3.07Å; R87-T90 WeakPolarHBondContact CA-OG1 3.44Å; R87-T90 PolarHBondContact O-OG1 3.13Å; T90-P94 WeakPolarHBondContact O-CB 3.49Å
91D89.3Confident90.5Very high77 Ų7729.1 Ų29.141%0.41216%0.156SC..Iπ-helixtrans-91.8-42-167.9-50.2-16.4000110.9R87R87-D91 WeakPolarHBondContact CB-OD2 3.27Å; R87-D91 WeakPolarHBondContact O-CA 3.17Å; R87-D91 WeakPolarHBondContact O-CB 3.38Å; R87-D91 PolarHBondContact O-N 2.99Å
92V87.5Confident90.3Very high30 Ų3030.3 Ų30.318%0.18216%0.161CC..Iπ-helixtrans-91.6-37.4-177.6-178.80000111.7L88 P94 H138L88-V92 HydrophobicContact CD1-CB 3.8Å; L88-V92 HydrophobicContact CD1-CG1 4.27Å; L88-V92 HydrophobicContact CD1-CG2 3.54Å; L88-V92 HydrophobicContact CG-CB 4.43Å; L88-V92 WeakPolarHBondContact O-CB 3.19Å; L88-V92 PolarHBondContact O-N 2.79Å; V92-P94 VanDerWaalsContact O-CD 3.25Å; V92-P94 WeakPolarHBondContact O-CD 3.34Å; V92-H138 HydrophobicContact CG2-CB 3.84Å
93F86.7Confident90.1Very high7 Ų727.7 Ų27.73%0.03115%0.151CC..SBendtrans-116.649.2-178.2-60.2-76.4000114.3L88 E89 G95 R96 D99 Y100 F237L88-F93 HydrophobicContact CG-CD2 4.31Å; L88-F93 HydrophobicContact CG-CE2 4.18Å; L88-F93 WeakPolarHBondContact O-CD2 3.43Å; L88-F93 PolarHBondContact O-N 3.11Å; L88-F93 VanDerWaalsContact O-N 3.14Å; E89-F93 CarbonylContact O-C 3.22Å; E89-F93 VanDerWaalsContact O-O 3.05Å; F93-G95 PolarHBondContact O-N 2.83Å; F93-G95 VanDerWaalsContact O-N 3.12Å; F93-R96 HydrophobicContact CB-CB 4.49Å; F93-R96 PolarHBondContact O-N 3.28Å; F93-D99 HydrophobicContact CD1-CB 3.88Å; F93-D99 HydrophobicContact CE1-CB 4.15Å; F93-Y100 AromaticContact CD2-CD2 3.93Å; F93-Y100 HydrophobicContact CD2-CD2 3.93Å; F93-Y100 HydrophobicContact CD2-CG 4.38Å; F93-Y100 HydrophobicContact CE2-CD2 4.29Å; F93-F237 HydrophobicContact CE1-CE1 4.46Å
94P85.8Confident90.1Very high75 Ų7527.2 Ų27.249%0.48715%0.148SC..THydrogen-bonded Turntrans-60.5119.8-174.825.9-34.3000111.7T90 V92 R96T90-P94 WeakPolarHBondContact O-CB 3.49Å; V92-P94 VanDerWaalsContact O-CD 3.25Å; V92-P94 WeakPolarHBondContact O-CD 3.34Å; P94-R96 PolarHBondContact O-N 3.21Å
95G84.2Confident90Very high31 Ų3130.3 Ų30.332%0.3217%0.165SC..THydrogen-bonded Turntrans66.513.8179.400000114.7F93 P97 T230F93-G95 PolarHBondContact O-N 2.83Å; F93-G95 VanDerWaalsContact O-N 3.12Å; G95-P97 WeakPolarHBondContact O-CD 3.13Å; G95-T230 PolarHBondContact O-N 2.91Å
96R85.4Confident89.9Confident67 Ų6731.8 Ų31.825%0.25317%0.171SC..  trans-121.658.7179.4-60.5177.570.1166.92.6111.3F93 P94 A98 D99 Y100F93-R96 HydrophobicContact CB-CB 4.49Å; F93-R96 PolarHBondContact O-N 3.28Å; P94-R96 PolarHBondContact O-N 3.21Å; R96-A98 PolarHBondContact O-N 2.99Å; R96-D99 HydrophobicContact CB-CB 4.28Å; R96-D99 IonicContact CZ-OD2 3.57Å; R96-D99 IonicContact NE-OD2 3.67Å; R96-D99 PolarHBondContact NE-OD2 2.87Å; R96-D99 IonicContact NH2-OD2 2.98Å; R96-D99 PolarHBondContact NH2-OD2 2.81Å; R96-D99 PolarHBondContact O-N 3.37Å; R96-D99 VanDerWaalsContact O-N 3.15Å; R96-Y100 PolarHBondContact O-N 3.23Å
97P88.2Confident89.8Confident21 Ų2130.6 Ų30.614%0.13616%0.164CC..Hα-helixtrans-59.7-31.9-178.123.3-34.5000113.6I16 G95 D99 Y100 L101 F227I16-P97 HydrophobicContact CG1-CB 4.27Å; G95-P97 WeakPolarHBondContact O-CD 3.13Å; P97-D99 VanDerWaalsContact C-N 3.3Å; P97-D99 PolarHBondContact O-N 3.09Å; P97-Y100 PolarHBondContact O-N 3.26Å; P97-L101 WeakPolarHBondContact O-CB 3.43Å; P97-L101 PolarHBondContact O-N 3.36Å; P97-F227 HydrophobicContact CB-CB 4.13Å; P97-F227 HydrophobicContact CB-CD1 4.4Å; P97-F227 HydrophobicContact CB-CG 4.43Å; P97-F227 HydrophobicContact CG-CB 3.87Å
98A87.7Confident89.7Confident0 Ų029.7 Ų29.70%016%0.16CC..Hα-helixtrans-61.9-37.1177.700000113R96 F102 T219 L223 Y224 F227R96-A98 PolarHBondContact O-N 2.99Å; A98-F102 WeakPolarHBondContact O-CB 3.44Å; A98-F102 PolarHBondContact O-N 3.05Å; A98-T219 HydrophobicContact CB-CG2 4.42Å; A98-L223 HydrophobicContact CB-CB 4.09Å; A98-Y224 HydrophobicContact CB-CD1 3.61Å; A98-Y224 HydrophobicContact CB-CE1 3.79Å; A98-Y224 HydrophobicContact CB-CG 4.33Å; A98-F227 HydrophobicContact CB-CB 4.34Å
99D88Confident89.7Confident0 Ų035.5 Ų35.50%019%0.186CC..Hα-helixtrans-76-39.5-177.7-64.6-24.1000111.1F93 R96 P97 F102 M103 T219 Y224 F237F93-D99 HydrophobicContact CD1-CB 3.88Å; F93-D99 HydrophobicContact CE1-CB 4.15Å; R96-D99 HydrophobicContact CB-CB 4.28Å; R96-D99 IonicContact CZ-OD2 3.57Å; R96-D99 IonicContact NE-OD2 3.67Å; R96-D99 PolarHBondContact NE-OD2 2.87Å; R96-D99 IonicContact NH2-OD2 2.98Å; R96-D99 PolarHBondContact NH2-OD2 2.81Å; R96-D99 PolarHBondContact O-N 3.37Å; R96-D99 VanDerWaalsContact O-N 3.15Å; P97-D99 VanDerWaalsContact C-N 3.3Å; P97-D99 PolarHBondContact O-N 3.09Å; D99-F102 PolarHBondContact O-N 3.06Å; D99-M103 PolarHBondContact O-N 3.4Å; D99-T219 VanDerWaalsContact OD1-CB 3.32Å; D99-T219 WeakPolarHBondContact OD1-CB 2.96Å; D99-T219 WeakPolarHBondContact OD1-CG2 3.38Å; D99-T219 PolarHBondContact OD1-OG1 3.04Å; D99-Y224 PolarHBondContact OD1-OH 3.19Å; D99-F237 HydrophobicContact CB-CE1 3.97Å; D99-F237 HydrophobicContact CB-CZ 3.52Å; D99-F237 WeakPolarHBondContact OD1-CZ 3.25Å; D99-F237 WeakPolarHBondContact OD2-CZ 3.48Å
100Y91.5Very high89.6Confident0 Ų035.5 Ų35.50%019%0.187CC..Hα-helixtrans-61.6-45.7170.7174-116000111.8I16 T17 S85 L88 E89 F93 R96 P97 F102 M103 L104I16-Y100 HydrophobicContact CB-CD1 3.73Å; I16-Y100 HydrophobicContact CB-CE1 3.68Å; I16-Y100 HydrophobicContact CG1-CD1 4.1Å; I16-Y100 HydrophobicContact CG2-CD1 3.74Å; I16-Y100 HydrophobicContact CG2-CE1 3.53Å; T17-Y100 PolarHBondContact OG1-OH 2.67Å; S85-Y100 VanDerWaalsContact CB-OH 3.25Å; S85-Y100 WeakPolarHBondContact CB-OH 3.17Å; L88-Y100 HydrophobicContact CB-CE2 4.33Å; L88-Y100 HydrophobicContact CD2-CD2 4.41Å; L88-Y100 HydrophobicContact CD2-CE2 4.04Å; L88-Y100 HydrophobicContact CG-CD2 4.5Å; L88-Y100 HydrophobicContact CG-CE2 4.33Å; E89-Y100 HydrophobicContact CB-CD1 3.93Å; E89-Y100 HydrophobicContact CB-CD2 4.41Å; E89-Y100 HydrophobicContact CB-CE1 3.92Å; E89-Y100 HydrophobicContact CB-CE2 4.43Å; E89-Y100 HydrophobicContact CB-CG 4.17Å; E89-Y100 HydrophobicContact CG-CD1 3.61Å; E89-Y100 HydrophobicContact CG-CE1 3.94Å; E89-Y100 HydrophobicContact CG-CG 4.08Å; E89-Y100 WeakPolarHBondContact OE2-CE1 3.43Å; F93-Y100 AromaticContact CD2-CD2 3.93Å; F93-Y100 HydrophobicContact CD2-CD2 3.93Å; F93-Y100 HydrophobicContact CD2-CG 4.38Å; F93-Y100 HydrophobicContact CE2-CD2 4.29Å; R96-Y100 PolarHBondContact O-N 3.23Å; P97-Y100 PolarHBondContact O-N 3.26Å; Y100-F102 VanDerWaalsContact C-N 3.32Å; Y100-F102 PolarHBondContact O-N 2.99Å; Y100-M103 HydrophobicContact CD2-CE 3.5Å; Y100-M103 HydrophobicContact CE2-CE 3.44Å; Y100-M103 VanDerWaalsContact CE2-CE 3.44Å; Y100-M103 WeakPolarHBondContact O-CB 3.2Å; Y100-M103 PolarHBondContact O-N 3.02Å; Y100-L104 HydrophobicContact CD1-CD1 4.3Å; Y100-L104 HydrophobicContact CE1-CD1 3.69Å; Y100-L104 HydrophobicContact CE1-CG 4.36Å; Y100-L104 HydrophobicContact CE2-CD1 4.34Å; Y100-L104 HydrophobicContact CE2-CD2 4.22Å; Y100-L104 HydrophobicContact CE2-CG 4.18Å; Y100-L104 WeakPolarHBondContact O-CG 3.31Å; Y100-L104 PolarHBondContact O-N 2.93Å
101L91.8Very high89.5Confident26 Ų2632.7 Ų32.714%0.13617%0.17CC..Hα-helixtrans-61.8-41.1175.8-179161.8000111.2I16 P97 M103 L104 I105 L223 F227I16-L101 HydrophobicContact CD1-CB 4.4Å; I16-L101 HydrophobicContact CD1-CD1 3.89Å; I16-L101 HydrophobicContact CG1-CB 4.41Å; P97-L101 WeakPolarHBondContact O-CB 3.43Å; P97-L101 PolarHBondContact O-N 3.36Å; L101-M103 VanDerWaalsContact C-N 3.33Å; L101-M103 PolarHBondContact O-N 3.08Å; L101-L104 WeakPolarHBondContact O-CB 3.45Å; L101-L104 PolarHBondContact O-N 2.82Å; L101-L104 VanDerWaalsContact O-N 3.15Å; L101-I105 HydrophobicContact CD2-CD1 3.3Å; L101-I105 HydrophobicContact CD2-CG1 3.84Å; L101-I105 HydrophobicContact CG-CD1 4.48Å; L101-I105 WeakPolarHBondContact O-CG1 3.41Å; L101-I105 PolarHBondContact O-N 3.49Å; L101-L223 HydrophobicContact CD2-CD1 3.79Å; L101-L223 HydrophobicContact CD2-CD2 3.34Å; L101-L223 HydrophobicContact CD2-CG 4.18Å; L101-F227 HydrophobicContact CD1-CD2 3.69Å; L101-F227 HydrophobicContact CD1-CE2 3.32Å; L101-F227 HydrophobicContact CD1-CZ 4.25Å
102F90.4Very high89.5Confident29 Ų2929.8 Ų29.813%0.12716%0.155CC..Hα-helixtrans-60.9-42.4175.9179.3-100.9000112.2A98 D99 Y100 L104 I105 F106 L217 T219 P220 L223A98-F102 WeakPolarHBondContact O-CB 3.44Å; A98-F102 PolarHBondContact O-N 3.05Å; D99-F102 PolarHBondContact O-N 3.06Å; Y100-F102 VanDerWaalsContact C-N 3.32Å; Y100-F102 PolarHBondContact O-N 2.99Å; F102-L104 VanDerWaalsContact C-N 3.32Å; F102-L104 PolarHBondContact O-N 3.25Å; F102-I105 PolarHBondContact O-N 3.31Å; F102-F106 WeakPolarHBondContact O-CB 3.43Å; F102-F106 PolarHBondContact O-N 2.71Å; F102-L217 HydrophobicContact CE1-CB 3.94Å; F102-L217 HydrophobicContact CE1-CD2 4.33Å; F102-L217 HydrophobicContact CZ-CB 4.42Å; F102-L217 HydrophobicContact CZ-CD2 4.16Å; F102-T219 HydrophobicContact CB-CG2 4.11Å; F102-T219 HydrophobicContact CG-CG2 4.47Å; F102-P220 HydrophobicContact CD2-CG 4.1Å; F102-P220 VanDerWaalsContact CE2-CD 3.5Å; F102-P220 HydrophobicContact CE2-CG 4.28Å; F102-L223 HydrophobicContact CB-CD1 3.67Å; F102-L223 HydrophobicContact CD2-CD1 3.94Å; F102-L223 HydrophobicContact CG-CD1 4.28Å
103M90.8Very high89.6Confident0 Ų032.6 Ų32.60%017%0.168CC..Hα-helixtrans-57.3-45.1172.3-178.4-84.1-61.200111.8L88 D99 Y100 L101 F106 N107 V131 Y200L88-M103 HydrophobicContact CD2-CE 3.33Å; L88-M103 HydrophobicContact CD2-SD 4.5Å; L88-M103 HydrophobicContact CG-CE 4.45Å; D99-M103 PolarHBondContact O-N 3.4Å; Y100-M103 HydrophobicContact CD2-CE 3.5Å; Y100-M103 HydrophobicContact CE2-CE 3.44Å; Y100-M103 VanDerWaalsContact CE2-CE 3.44Å; Y100-M103 WeakPolarHBondContact O-CB 3.2Å; Y100-M103 PolarHBondContact O-N 3.02Å; L101-M103 VanDerWaalsContact C-N 3.33Å; L101-M103 PolarHBondContact O-N 3.08Å; M103-F106 PolarHBondContact O-N 3.11Å; M103-N107 WeakPolarHBondContact O-CB 3.46Å; M103-N107 PolarHBondContact O-N 3.41Å; M103-N107 PolarHBondContact SD-ND2 3.06Å; M103-V131 HydrophobicContact CE-CG2 4.2Å; M103-V131 HydrophobicContact SD-CG2 4.35Å; M103-Y200 HydrophobicContact CB-CD2 4.4Å; M103-Y200 HydrophobicContact CB-CE1 3.94Å; M103-Y200 HydrophobicContact CB-CE2 3.68Å; M103-Y200 VanDerWaalsContact CB-CZ 3.41Å; M103-Y200 WeakPolarHBondContact CB-OH 3.2Å; M103-Y200 HydrophobicContact CG-CD1 3.55Å; M103-Y200 HydrophobicContact CG-CD2 3.94Å; M103-Y200 HydrophobicContact CG-CE1 3.18Å; M103-Y200 HydrophobicContact CG-CE2 3.59Å; M103-Y200 HydrophobicContact CG-CG 3.92Å
104L92.9Very high89.6Confident17 Ų1734.3 Ų34.39%0.08918%0.177CC..Hα-helixtrans-62.8-43.6176.1-67-178.5000112.1I16 W20 Y100 L101 F102 N107 W108 M127 V131I16-L104 HydrophobicContact CG2-CD1 3.62Å; W20-L104 HydrophobicContact CE3-CD1 4.07Å; W20-L104 HydrophobicContact CE3-CD2 4.18Å; W20-L104 HydrophobicContact CH2-CD2 4.23Å; W20-L104 HydrophobicContact CZ3-CD1 4.34Å; W20-L104 HydrophobicContact CZ3-CD2 3.62Å; Y100-L104 HydrophobicContact CD1-CD1 4.3Å; Y100-L104 HydrophobicContact CE1-CD1 3.69Å; Y100-L104 HydrophobicContact CE1-CG 4.36Å; Y100-L104 HydrophobicContact CE2-CD1 4.34Å; Y100-L104 HydrophobicContact CE2-CD2 4.22Å; Y100-L104 HydrophobicContact CE2-CG 4.18Å; Y100-L104 WeakPolarHBondContact O-CG 3.31Å; Y100-L104 PolarHBondContact O-N 2.93Å; L101-L104 WeakPolarHBondContact O-CB 3.45Å; L101-L104 PolarHBondContact O-N 2.82Å; L101-L104 VanDerWaalsContact O-N 3.15Å; F102-L104 VanDerWaalsContact C-N 3.32Å; F102-L104 PolarHBondContact O-N 3.25Å; L104-N107 PolarHBondContact O-N 3.1Å; L104-W108 WeakPolarHBondContact O-CB 3.46Å; L104-W108 PolarHBondContact O-N 3.2Å; L104-M127 HydrophobicContact CB-CE 4.47Å; L104-M127 HydrophobicContact CD2-CE 4.22Å; L104-M127 WeakPolarHBondContact O-CE 3.4Å; L104-V131 HydrophobicContact CD2-CG2 3.43Å; L104-V131 VanDerWaalsContact CD2-CG2 3.43Å
105I92.3Very high89.6Confident72 Ų7230.8 Ų30.837%0.36915%0.154SC..Hα-helixtrans-62.5-44.1177.2-72.1-178.5000110.8L101 F102 W108 F109 L223L101-I105 HydrophobicContact CD2-CD1 3.3Å; L101-I105 HydrophobicContact CD2-CG1 3.84Å; L101-I105 HydrophobicContact CG-CD1 4.48Å; L101-I105 WeakPolarHBondContact O-CG1 3.41Å; L101-I105 PolarHBondContact O-N 3.49Å; F102-I105 PolarHBondContact O-N 3.31Å; I105-W108 PolarHBondContact O-N 3.01Å; I105-F109 WeakPolarHBondContact O-CB 3.33Å; I105-F109 PolarHBondContact O-N 2.83Å; I105-L223 HydrophobicContact CD1-CD2 4.48Å
106F91.2Very high89.6Confident31 Ų3130.9 Ų30.914%0.13615%0.147CC..Hα-helixtrans-62.8-49.3178.4179.8-91.2000111.1F102 M103 W108 F109 C110 L199 Y200 L203 L217F102-F106 WeakPolarHBondContact O-CB 3.43Å; F102-F106 PolarHBondContact O-N 2.71Å; M103-F106 PolarHBondContact O-N 3.11Å; F106-W108 VanDerWaalsContact C-N 3.3Å; F106-W108 PolarHBondContact O-N 3.26Å; F106-F109 PolarHBondContact O-N 3.08Å; F106-C110 PolarHBondContact O-N 3.39Å; F106-C110 PolarHBondContact O-SG 3.37Å; F106-L199 HydrophobicContact CE1-CD2 4.49Å; F106-L199 HydrophobicContact CE1-CG 4.35Å; F106-L199 HydrophobicContact CZ-CD2 4.25Å; F106-L199 HydrophobicContact CZ-CG 4.26Å; F106-Y200 HydrophobicContact CB-CD2 4.29Å; F106-Y200 AromaticContact CD1-CD2 3.57Å; F106-Y200 HydrophobicContact CD1-CD2 3.57Å; F106-Y200 HydrophobicContact CD1-CG 4.17Å; F106-Y200 HydrophobicContact CE1-CD2 4.19Å; F106-Y200 HydrophobicContact CG-CD2 4.1Å; F106-L203 HydrophobicContact CE2-CD1 4.38Å; F106-L203 HydrophobicContact CZ-CD1 3.72Å; F106-L217 HydrophobicContact CD2-CD1 4.19Å; F106-L217 HydrophobicContact CD2-CD2 3.96Å; F106-L217 HydrophobicContact CE1-CD1 4.43Å; F106-L217 HydrophobicContact CE2-CD1 4.04Å; F106-L217 HydrophobicContact CE2-CD2 3.86Å; F106-L217 HydrophobicContact CG-CD1 4.45Å; F106-L217 HydrophobicContact CZ-CD1 4.17Å
107N91.7Very high89.6Confident0 Ų031.3 Ų31.30%017%0.165CC..Hα-helixtrans-59.7-42.6176.3-79.9-5.1000111.7M103 L104 C110 A111 M127 S130 I196 Y200M103-N107 WeakPolarHBondContact O-CB 3.46Å; M103-N107 PolarHBondContact O-N 3.41Å; M103-N107 PolarHBondContact SD-ND2 3.06Å; L104-N107 PolarHBondContact O-N 3.1Å; N107-C110 PolarHBondContact O-N 3.3Å; N107-A111 VanDerWaalsContact O-CB 3.27Å; N107-A111 WeakPolarHBondContact O-CB 3.28Å; N107-A111 PolarHBondContact O-N 3.24Å; N107-M127 HydrophobicContact CB-CE 4.25Å; N107-M127 HydrophobicContact CB-SD 3.98Å; N107-S130 PolarHBondContact ND2-OG 3.35Å; N107-S130 VanDerWaalsContact ND2-OG 3.09Å; N107-I196 HydrophobicContact CB-CG2 3.99Å; N107-Y200 WeakPolarHBondContact OD1-CB 3.32Å
108W92.3Very high89.3Confident65 Ų6534.9 Ų34.925%0.24618%0.183CC..Hα-helixtrans-61.6-47.2176.2170.468.6000110.8P57 V58 L61 L104 I105 F106 C110 A111 V112 M127P57-W108 HydrophobicContact CB-CZ2 4.07Å; P57-W108 PolarHBondContact O-NE1 3.02Å; V58-W108 HydrophobicContact CB-CZ2 4.43Å; V58-W108 HydrophobicContact CG2-CH2 3.94Å; V58-W108 HydrophobicContact CG2-CZ2 3.56Å; L61-W108 HydrophobicContact CD1-CB 4.27Å; L61-W108 HydrophobicContact CD1-CG 4.01Å; L104-W108 WeakPolarHBondContact O-CB 3.46Å; L104-W108 PolarHBondContact O-N 3.2Å; I105-W108 PolarHBondContact O-N 3.01Å; F106-W108 VanDerWaalsContact C-N 3.3Å; F106-W108 PolarHBondContact O-N 3.26Å; W108-C110 PolarHBondContact O-N 3.22Å; W108-A111 CarbonylContact O-C 3.6Å; W108-A111 WeakPolarHBondContact O-CB 3.32Å; W108-A111 PolarHBondContact O-N 2.97Å; W108-A111 VanDerWaalsContact O-N 3.11Å; W108-V112 HydrophobicContact CD2-CG2 4.23Å; W108-V112 HydrophobicContact CG-CG2 4.37Å; W108-V112 HydrophobicContact CZ2-CG2 4.16Å; W108-V112 VanDerWaalsContact O-CG2 3.26Å; W108-V112 WeakPolarHBondContact O-CG2 3.33Å; W108-V112 PolarHBondContact O-N 3.22Å; W108-M127 WeakPolarHBondContact CA-SD 3.35Å; W108-M127 HydrophobicContact CB-CE 3.93Å; W108-M127 HydrophobicContact CB-SD 3.85Å; W108-M127 PolarHBondContact N-SD 3.44Å
109F91.4Very high88.9Confident122 Ų12241 Ų4154%0.53521%0.211SC..Hα-helixtrans-59.2-45.6177.8-176.3-104.7000112.1I105 F106 A111 V112 I113I105-F109 WeakPolarHBondContact O-CB 3.33Å; I105-F109 PolarHBondContact O-N 2.83Å; F106-F109 PolarHBondContact O-N 3.08Å; F109-A111 VanDerWaalsContact C-N 3.35Å; F109-A111 PolarHBondContact O-N 3.02Å; F109-V112 PolarHBondContact O-N 2.91Å; F109-I113 HydrophobicContact CD1-CD1 3.79Å; F109-I113 HydrophobicContact CE1-CD1 3.35Å; F109-I113 HydrophobicContact CE1-CG1 4.38Å; F109-I113 HydrophobicContact CE2-CD1 4.49Å; F109-I113 HydrophobicContact CZ-CD1 3.75Å; F109-I113 HydrophobicContact CZ-CG1 4.45Å; F109-I113 WeakPolarHBondContact O-CG1 3.47Å; F109-I113 PolarHBondContact O-N 3.25Å
110C90.3Very high88.5Confident14 Ų1442 Ų4210%0.09522%0.216CC..Hα-helixtrans-62.5-40.7173.7-68.20000112.4F106 N107 W108 V112 I113 I114 I196F106-C110 PolarHBondContact O-N 3.39Å; F106-C110 PolarHBondContact O-SG 3.37Å; N107-C110 PolarHBondContact O-N 3.3Å; W108-C110 PolarHBondContact O-N 3.22Å; C110-V112 VanDerWaalsContact C-N 3.33Å; C110-V112 PolarHBondContact O-N 3.39Å; C110-I113 PolarHBondContact O-N 3.11Å; C110-I114 WeakPolarHBondContact O-CG1 3.27Å; C110-I114 PolarHBondContact O-N 3.38Å; C110-I196 HydrophobicContact CB-CG1 4.15Å; C110-I196 HydrophobicContact CB-CG2 3.87Å
111A89.9Confident88.1Confident2 Ų247.8 Ų47.82%0.01724%0.239CC..Hα-helixtrans-64.1-37.8176.300000111.8N107 W108 F109 G115 L123 M127 I196N107-A111 VanDerWaalsContact O-CB 3.27Å; N107-A111 WeakPolarHBondContact O-CB 3.28Å; N107-A111 PolarHBondContact O-N 3.24Å; W108-A111 CarbonylContact O-C 3.6Å; W108-A111 WeakPolarHBondContact O-CB 3.32Å; W108-A111 PolarHBondContact O-N 2.97Å; W108-A111 VanDerWaalsContact O-N 3.11Å; F109-A111 VanDerWaalsContact C-N 3.35Å; F109-A111 PolarHBondContact O-N 3.02Å; A111-G115 WeakPolarHBondContact O-CA 3.45Å; A111-G115 PolarHBondContact O-N 3.42Å; A111-L123 HydrophobicContact CB-CD2 4.11Å; A111-L123 WeakPolarHBondContact O-CD2 3.31Å; A111-M127 HydrophobicContact CB-SD 4.34Å; A111-I196 HydrophobicContact CB-CD1 3.85Å
112V89.3Confident87.9Confident17 Ų1748.9 Ų48.910%0.10324%0.243CC..Hα-helixtrans-65.5-46.8175172.80000110.8P57 W108 F109 C110 I114 G115 L116 L123P57-V112 HydrophobicContact CB-CG1 3.98Å; P57-V112 HydrophobicContact CB-CG2 3.66Å; P57-V112 HydrophobicContact CG-CG1 4.26Å; W108-V112 HydrophobicContact CD2-CG2 4.23Å; W108-V112 HydrophobicContact CG-CG2 4.37Å; W108-V112 HydrophobicContact CZ2-CG2 4.16Å; W108-V112 VanDerWaalsContact O-CG2 3.26Å; W108-V112 WeakPolarHBondContact O-CG2 3.33Å; W108-V112 PolarHBondContact O-N 3.22Å; F109-V112 PolarHBondContact O-N 2.91Å; C110-V112 VanDerWaalsContact C-N 3.33Å; C110-V112 PolarHBondContact O-N 3.39Å; V112-I114 PolarHBondContact O-N 3.43Å; V112-G115 PolarHBondContact O-N 2.89Å; V112-L116 HydrophobicContact CG1-CD1 3.81Å; V112-L116 HydrophobicContact CG1-CG 4.27Å; V112-L116 WeakPolarHBondContact O-CB 3.13Å; V112-L116 VanDerWaalsContact O-CG 3.3Å; V112-L116 WeakPolarHBondContact O-CG 3.39Å; V112-L116 PolarHBondContact O-N 2.83Å; V112-L123 HydrophobicContact CG2-CD1 3.63Å
113I88.9Confident87.8Confident89 Ų8947.5 Ų47.546%0.45624%0.237SC..Hα-helixtrans-58.8-49.5177.8-69168.9000110.7F109 C110 G115 L116 A117F109-I113 HydrophobicContact CD1-CD1 3.79Å; F109-I113 HydrophobicContact CE1-CD1 3.35Å; F109-I113 HydrophobicContact CE1-CG1 4.38Å; F109-I113 HydrophobicContact CE2-CD1 4.49Å; F109-I113 HydrophobicContact CZ-CD1 3.75Å; F109-I113 HydrophobicContact CZ-CG1 4.45Å; F109-I113 WeakPolarHBondContact O-CG1 3.47Å; F109-I113 PolarHBondContact O-N 3.25Å; C110-I113 PolarHBondContact O-N 3.11Å; I113-G115 VanDerWaalsContact C-N 3.31Å; I113-G115 PolarHBondContact O-N 3.3Å; I113-L116 PolarHBondContact O-N 2.89Å; I113-A117 WeakPolarHBondContact O-CB 3.35Å; I113-A117 PolarHBondContact O-N 3.15Å
114I86.7Confident87.9Confident43 Ų4347.7 Ų47.722%0.22124%0.238CC..Hα-helixtrans-66.8-37.1179.6-68.4172000110.9C110 V112 A117 L118 R192 I196C110-I114 WeakPolarHBondContact O-CG1 3.27Å; C110-I114 PolarHBondContact O-N 3.38Å; V112-I114 PolarHBondContact O-N 3.43Å; I114-A117 PolarHBondContact O-N 2.92Å; I114-L118 HydrophobicContact CG2-CD1 4.14Å; I114-L118 WeakPolarHBondContact O-CB 3.18Å; I114-L118 PolarHBondContact O-N 3.17Å; I114-L118 VanDerWaalsContact O-N 3.16Å; I114-R192 HydrophobicContact CG2-CB 4.13Å; I114-R192 HydrophobicContact CG2-CG 3.9Å; I114-I196 HydrophobicContact CD1-CD1 3.94Å; I114-I196 HydrophobicContact CD1-CG1 3.6Å
115G85.8Confident87.7Confident0 Ų048.4 Ų48.40%024%0.24CC..Hα-helixtrans-67.1-39.8178.800000112.6A111 V112 I113 E119 M120A111-G115 WeakPolarHBondContact O-CA 3.45Å; A111-G115 PolarHBondContact O-N 3.42Å; V112-G115 PolarHBondContact O-N 2.89Å; I113-G115 VanDerWaalsContact C-N 3.31Å; I113-G115 PolarHBondContact O-N 3.3Å; G115-E119 CarbonylContact O-C 3.55Å; G115-E119 WeakPolarHBondContact O-CA 3.38Å; G115-E119 PolarHBondContact O-N 3.33Å; G115-M120 PolarHBondContact O-N 3.38Å
116L85.7Confident87.6Confident34 Ų3445.1 Ų45.118%0.17822%0.224CC..Hα-helixtrans-69.4-41.5174-70.9171.6000111.5L43 Y45 V48 V112 I113 L118L43-L116 HydrophobicContact CD1-CD2 4.4Å; L43-L116 HydrophobicContact CD2-CD2 3.93Å; L43-L116 HydrophobicContact CD2-CG 4.31Å; L43-L116 HydrophobicContact CG-CD2 4.29Å; Y45-L116 HydrophobicContact CD2-CB 4.15Å; Y45-L116 HydrophobicContact CD2-CD2 4.18Å; Y45-L116 WeakPolarHBondContact CD2-O 3.39Å; V48-L116 HydrophobicContact CB-CD2 3.9Å; V48-L116 HydrophobicContact CG1-CD1 4.29Å; V48-L116 HydrophobicContact CG1-CD2 3.85Å; V48-L116 HydrophobicContact CG2-CD2 4.35Å; V112-L116 HydrophobicContact CG1-CD1 3.81Å; V112-L116 HydrophobicContact CG1-CG 4.27Å; V112-L116 WeakPolarHBondContact O-CB 3.13Å; V112-L116 VanDerWaalsContact O-CG 3.3Å; V112-L116 WeakPolarHBondContact O-CG 3.39Å; V112-L116 PolarHBondContact O-N 2.83Å; I113-L116 PolarHBondContact O-N 2.89Å; L116-L118 PolarHBondContact O-N 3.42Å
117A85.1Confident87.6Confident76 Ų7643.7 Ų43.763%0.62822%0.217SC*.Hα-helixtrans-66.6-23.2179.800000113.9I113 I114I113-A117 WeakPolarHBondContact O-CB 3.35Å; I113-A117 PolarHBondContact O-N 3.15Å; I114-A117 PolarHBondContact O-N 2.92Å
118L81.8Confident87.7Confident95 Ų9543.8 Ų43.850%0.49722%0.218SC..THydrogen-bonded Turntrans-129.420.4-172.6-59.8173.9000113.3I114 L116 M120 R192I114-L118 HydrophobicContact CG2-CD1 4.14Å; I114-L118 WeakPolarHBondContact O-CB 3.18Å; I114-L118 PolarHBondContact O-N 3.17Å; I114-L118 VanDerWaalsContact O-N 3.16Å; L116-L118 PolarHBondContact O-N 3.42Å; L118-M120 VanDerWaalsContact C-N 3.33Å; L118-M120 PolarHBondContact O-N 3.3Å; L118-R192 VanDerWaalsContact CD1-CD 3.45Å; L118-R192 HydrophobicContact CD1-CG 4.45Å
119E80.1Confident87.7Confident128 Ų12841 Ų4160%0.59821%0.208SC*.THydrogen-bonded Turntrans50.845.2175.9-60.1177.6-178.800114.2G115 Y121G115-E119 CarbonylContact O-C 3.55Å; G115-E119 WeakPolarHBondContact O-CA 3.38Å; G115-E119 PolarHBondContact O-N 3.33Å; E119-Y121 PolarHBondContact O-N 2.96Å
120M78.7Confident87.7Confident22 Ų2235.2 Ų35.211%0.10818%0.183CC..  trans-82.2117.8178.4-170.7-177.3-64.300111.5L43 G115 L118 F122 L123 P126L43-M120 WeakPolarHBondContact CD2-O 3.39Å; G115-M120 PolarHBondContact O-N 3.38Å; L118-M120 VanDerWaalsContact C-N 3.33Å; L118-M120 PolarHBondContact O-N 3.3Å; M120-F122 PolarHBondContact O-N 3.45Å; M120-L123 HydrophobicContact SD-CD2 4.49Å; M120-P126 HydrophobicContact SD-CG 3.76Å
121Y83.2Confident87.9Confident122 Ų12234.7 Ų34.748%0.47818%0.179SC..SBendtrans-71.1-29.6-178-62.8-57.7000115.7V42 L43 E119V42-Y121 HydrophobicContact CG1-CD1 3.23Å; V42-Y121 HydrophobicContact CG1-CE1 4.22Å; V42-Y121 HydrophobicContact CG1-CG 3.76Å; L43-Y121 PolarHBondContact N-O 2.88Å; L43-Y121 WeakPolarHBondContact O-CD1 3.39Å; E119-Y121 PolarHBondContact O-N 2.96Å
122F87Confident88.1Confident49 Ų4934.6 Ų34.622%0.21518%0.178CC..  trans-128.5125.1-171.6-54.3-70.6000111.8V38 V42 I63 P65 M120V38-F122 HydrophobicContact CG1-CE1 4.48Å; V42-F122 HydrophobicContact CG2-CE1 3.76Å; V42-F122 HydrophobicContact CG2-CZ 4.05Å; I63-F122 HydrophobicContact CG2-CD1 4.31Å; P65-F122 HydrophobicContact CB-CE1 4.29Å; P65-F122 HydrophobicContact CB-CE2 4.45Å; P65-F122 HydrophobicContact CB-CZ 3.88Å; P65-F122 HydrophobicContact CG-CD2 4.24Å; P65-F122 HydrophobicContact CG-CE1 3.99Å; P65-F122 HydrophobicContact CG-CE2 3.65Å; P65-F122 HydrophobicContact CG-CZ 3.52Å; M120-F122 PolarHBondContact O-N 3.45Å
123L89.2Confident88.2Confident0 Ų035 Ų350%018%0.178CC..SBendtrans-99.1-10.9-179.2-64.2177.7000113.4L43 A60 A111 V112 M120 E125 P126 M127L43-L123 HydrophobicContact CD1-CD1 4.09Å; A60-L123 HydrophobicContact CB-CD1 4.16Å; A60-L123 HydrophobicContact CB-CG 4.2Å; A60-L123 PolarHBondContact O-N 2.94Å; A60-L123 VanDerWaalsContact O-N 3.07Å; A111-L123 HydrophobicContact CB-CD2 4.11Å; A111-L123 WeakPolarHBondContact O-CD2 3.31Å; V112-L123 HydrophobicContact CG2-CD1 3.63Å; M120-L123 HydrophobicContact SD-CD2 4.49Å; L123-E125 PolarHBondContact O-N 3.07Å; L123-P126 HydrophobicContact CD2-CG 4.49Å; L123-P126 VanDerWaalsContact O-CD 3.27Å; L123-P126 WeakPolarHBondContact O-CD 3.43Å; L123-P126 VanDerWaalsContact O-CG 3.27Å; L123-P126 WeakPolarHBondContact O-CG 3.39Å; L123-M127 VanDerWaalsContact O-CB 3.29Å; L123-M127 WeakPolarHBondContact O-CB 3.36Å; L123-M127 WeakPolarHBondContact O-CG 3.45Å; L123-M127 PolarHBondContact O-N 3.31Å; L123-M127 VanDerWaalsContact O-N 3.12Å
124L91.6Very high88.4Confident4 Ų430.7 Ų30.72%0.02116%0.156CC..Hα-helixtrans-59.1-47.7179.1-178.461.3000112.2W20 T24 L61 Y64 M127 V128W20-L124 HydrophobicContact CZ2-CD1 4.28Å; T24-L124 HydrophobicContact CG2-CD1 3.47Å; T24-L124 VanDerWaalsContact CG2-CD1 3.47Å; T24-L124 HydrophobicContact CG2-CD2 4.18Å; T24-L124 HydrophobicContact CG2-CG 4.47Å; L61-L124 WeakPolarHBondContact O-CB 3.4Å; L61-L124 VanDerWaalsContact O-CD1 3.31Å; L61-L124 WeakPolarHBondContact O-CD1 3.42Å; Y64-L124 HydrophobicContact CD2-CD2 4.37Å; Y64-L124 HydrophobicContact CG-CD2 4.42Å; L124-M127 PolarHBondContact O-N 3.49Å; L124-V128 HydrophobicContact CD1-CG2 3.87Å; L124-V128 HydrophobicContact CG-CG2 4.3Å; L124-V128 WeakPolarHBondContact O-CG2 3.25Å; L124-V128 PolarHBondContact O-N 3.07Å
125E89.5Confident88.7Confident31 Ų3128.8 Ų28.815%0.14515%0.146CC..Hα-helixtrans-59.6-54.1-178.9-176.6177.5173.500112.7M77 L123 M127 V128 L129M77-E125 HydrophobicContact SD-CG 4.46Å; L123-E125 PolarHBondContact O-N 3.07Å; E125-M127 VanDerWaalsContact C-N 3.27Å; E125-M127 PolarHBondContact O-N 3.34Å; E125-V128 PolarHBondContact O-N 3.46Å; E125-L129 HydrophobicContact CG-CD1 3.96Å; E125-L129 WeakPolarHBondContact O-CB 3.43Å; E125-L129 VanDerWaalsContact O-CG 3.3Å; E125-L129 WeakPolarHBondContact O-CG 3.16Å; E125-L129 PolarHBondContact O-N 2.93Å
126P89.9Confident88.9Confident3 Ų328.8 Ų28.82%0.01915%0.146CC..Hα-helixtrans-64.5-31.4178.326-36000113.2M120 L123 S130 A193 I196M120-P126 HydrophobicContact SD-CG 3.76Å; L123-P126 HydrophobicContact CD2-CG 4.49Å; L123-P126 VanDerWaalsContact O-CD 3.27Å; L123-P126 WeakPolarHBondContact O-CD 3.43Å; L123-P126 VanDerWaalsContact O-CG 3.27Å; L123-P126 WeakPolarHBondContact O-CG 3.39Å; P126-S130 VanDerWaalsContact O-CB 3.3Å; P126-S130 WeakPolarHBondContact O-CB 3.4Å; P126-S130 PolarHBondContact O-N 3.01Å; P126-S130 PolarHBondContact O-OG 3.33Å; P126-A193 HydrophobicContact CB-CB 3.94Å; P126-I196 HydrophobicContact CB-CD1 4.48Å
127M92Very high89.1Confident1 Ų129.4 Ų29.41%0.00515%0.148CC..Hα-helixtrans-67.3-47.4176.3-78.2-64.1-65.700112.6W20 L61 L104 N107 W108 A111 L123 L124 E125 L129 S130 V131W20-M127 HydrophobicContact CH2-CB 4.13Å; W20-M127 HydrophobicContact CH2-CE 4.46Å; W20-M127 HydrophobicContact CZ2-CB 3.77Å; L61-M127 HydrophobicContact CD1-CE 4.04Å; L61-M127 HydrophobicContact CD1-CG 4.27Å; L104-M127 HydrophobicContact CB-CE 4.47Å; L104-M127 HydrophobicContact CD2-CE 4.22Å; L104-M127 WeakPolarHBondContact O-CE 3.4Å; N107-M127 HydrophobicContact CB-CE 4.25Å; N107-M127 HydrophobicContact CB-SD 3.98Å; W108-M127 WeakPolarHBondContact CA-SD 3.35Å; W108-M127 HydrophobicContact CB-CE 3.93Å; W108-M127 HydrophobicContact CB-SD 3.85Å; W108-M127 PolarHBondContact N-SD 3.44Å; A111-M127 HydrophobicContact CB-SD 4.34Å; L123-M127 VanDerWaalsContact O-CB 3.29Å; L123-M127 WeakPolarHBondContact O-CB 3.36Å; L123-M127 WeakPolarHBondContact O-CG 3.45Å; L123-M127 PolarHBondContact O-N 3.31Å; L123-M127 VanDerWaalsContact O-N 3.12Å; L124-M127 PolarHBondContact O-N 3.49Å; E125-M127 VanDerWaalsContact C-N 3.27Å; E125-M127 PolarHBondContact O-N 3.34Å; M127-L129 VanDerWaalsContact C-N 3.3Å; M127-L129 PolarHBondContact O-N 2.9Å; M127-S130 PolarHBondContact O-N 3.49Å; M127-S130 PolarHBondContact O-OG 3.38Å; M127-V131 VanDerWaalsContact O-CG2 3.32Å; M127-V131 WeakPolarHBondContact O-CG2 3.5Å; M127-V131 PolarHBondContact O-N 3.16Å; M127-V131 VanDerWaalsContact O-N 3.07Å
128V93.8Very high89.3Confident3 Ų328.7 Ų28.72%0.01813%0.132CC..Hα-helixtrans-62.8-42.9177.3172.50000110.2W20 F80 L81 L124 E125 V131 L132W20-V128 HydrophobicContact CH2-CG2 4.31Å; W20-V128 HydrophobicContact CZ2-CG2 4.06Å; F80-V128 HydrophobicContact CB-CG1 3.84Å; L81-V128 HydrophobicContact CB-CG1 4.39Å; L81-V128 HydrophobicContact CB-CG2 3.89Å; L81-V128 HydrophobicContact CD1-CG2 3.96Å; L81-V128 HydrophobicContact CG-CG2 4.42Å; L124-V128 HydrophobicContact CD1-CG2 3.87Å; L124-V128 HydrophobicContact CG-CG2 4.3Å; L124-V128 WeakPolarHBondContact O-CG2 3.25Å; L124-V128 PolarHBondContact O-N 3.07Å; E125-V128 PolarHBondContact O-N 3.46Å; V128-V131 PolarHBondContact O-N 3.36Å; V128-L132 WeakPolarHBondContact O-CB 3.26Å; V128-L132 PolarHBondContact O-N 3.4Å
129L92.1Very high89.7Confident6 Ų626.2 Ų26.23%0.03112%0.117CC..Hα-helixtrans-66.8-35.9178-72.5175.6000112.9E125 M127 Y133 L161 F190 A193E125-L129 HydrophobicContact CG-CD1 3.96Å; E125-L129 WeakPolarHBondContact O-CB 3.43Å; E125-L129 VanDerWaalsContact O-CG 3.3Å; E125-L129 WeakPolarHBondContact O-CG 3.16Å; E125-L129 PolarHBondContact O-N 2.93Å; M127-L129 VanDerWaalsContact C-N 3.3Å; M127-L129 PolarHBondContact O-N 2.9Å; L129-Y133 VanDerWaalsContact O-CB 3.28Å; L129-Y133 WeakPolarHBondContact O-CB 3.46Å; L129-Y133 PolarHBondContact O-N 3.33Å; L129-L161 HydrophobicContact CD2-CD1 4.25Å; L129-F190 HydrophobicContact CD1-CD1 3.77Å; L129-F190 HydrophobicContact CD1-CD2 4.48Å; L129-F190 HydrophobicContact CD1-CE1 3.59Å; L129-F190 HydrophobicContact CD1-CE2 4.32Å; L129-F190 HydrophobicContact CD1-CG 4.22Å; L129-F190 HydrophobicContact CD1-CZ 3.87Å; L129-F190 HydrophobicContact CD2-CD1 4.29Å; L129-F190 HydrophobicContact CD2-CE1 3.69Å; L129-F190 HydrophobicContact CD2-CZ 4.36Å; L129-F190 HydrophobicContact CG-CE1 4.31Å; L129-A193 HydrophobicContact CB-CB 3.55Å; L129-A193 HydrophobicContact CD1-CB 3.94Å; L129-A193 HydrophobicContact CG-CB 4.42Å
130S92Very high90.2Very high1 Ų121.2 Ų21.21%0.00710%0.098CC..Hα-helixtrans-69.2-41.7177.475.10000111.6N107 P126 M127 Y133 V134N107-S130 PolarHBondContact ND2-OG 3.35Å; N107-S130 VanDerWaalsContact ND2-OG 3.09Å; P126-S130 VanDerWaalsContact O-CB 3.3Å; P126-S130 WeakPolarHBondContact O-CB 3.4Å; P126-S130 PolarHBondContact O-N 3.01Å; P126-S130 PolarHBondContact O-OG 3.33Å; M127-S130 PolarHBondContact O-N 3.49Å; M127-S130 PolarHBondContact O-OG 3.38Å; S130-Y133 PolarHBondContact O-N 3.4Å; S130-V134 WeakPolarHBondContact O-CG2 3.37Å; S130-V134 PolarHBondContact O-N 3.29Å
131V93.6Very high90.8Very high2 Ų226.4 Ų26.41%0.01212%0.122CC..Hα-helixtrans-62.9-46.4175.2168.30000110.9W20 L88 M103 L104 M127 V128 Y133 V134 W135W20-V131 HydrophobicContact CH2-CG2 3.91Å; W20-V131 HydrophobicContact CZ3-CG2 3.92Å; L88-V131 HydrophobicContact CD2-CG1 3.78Å; M103-V131 HydrophobicContact CE-CG2 4.2Å; M103-V131 HydrophobicContact SD-CG2 4.35Å; L104-V131 HydrophobicContact CD2-CG2 3.43Å; L104-V131 VanDerWaalsContact CD2-CG2 3.43Å; M127-V131 VanDerWaalsContact O-CG2 3.32Å; M127-V131 WeakPolarHBondContact O-CG2 3.5Å; M127-V131 PolarHBondContact O-N 3.16Å; M127-V131 VanDerWaalsContact O-N 3.07Å; V128-V131 PolarHBondContact O-N 3.36Å; V131-Y133 VanDerWaalsContact C-N 3.32Å; V131-Y133 PolarHBondContact O-N 3.19Å; V131-V134 PolarHBondContact O-N 2.88Å; V131-W135 PolarHBondContact O-N 3.45Å
132L93.6Very high91.1Very high1 Ų124.6 Ų24.61%0.00512%0.119CC..Hα-helixtrans-58.5-45.3174.6177.6155.5000111.4F80 Y84 V128 W135 C136 L157 P158 L161F80-L132 HydrophobicContact CB-CD1 4.42Å; F80-L132 HydrophobicContact CG-CD1 4.39Å; Y84-L132 HydrophobicContact CD2-CB 4.31Å; Y84-L132 HydrophobicContact CD2-CD1 3.41Å; Y84-L132 VanDerWaalsContact CD2-CD1 3.41Å; Y84-L132 HydrophobicContact CD2-CG 3.88Å; Y84-L132 HydrophobicContact CE2-CD1 3.45Å; Y84-L132 VanDerWaalsContact CE2-CD1 3.45Å; Y84-L132 HydrophobicContact CE2-CG 4.13Å; Y84-L132 HydrophobicContact CG-CB 4.34Å; Y84-L132 HydrophobicContact CG-CD1 4.13Å; Y84-L132 HydrophobicContact CG-CG 4.08Å; V128-L132 WeakPolarHBondContact O-CB 3.26Å; V128-L132 PolarHBondContact O-N 3.4Å; L132-W135 PolarHBondContact O-N 3.23Å; L132-C136 PolarHBondContact O-N 3.07Å; L132-C136 PolarHBondContact O-SG 3.16Å; L132-L157 HydrophobicContact CD1-CD2 3.76Å; L132-L157 HydrophobicContact CD2-CD2 3.65Å; L132-L157 HydrophobicContact CG-CD2 3.99Å; L132-P158 HydrophobicContact CD2-CB 4.42Å; L132-P158 HydrophobicContact CD2-CG 3.96Å; L132-L161 HydrophobicContact CD1-CD1 3.2Å; L132-L161 HydrophobicContact CD2-CD1 4.05Å; L132-L161 HydrophobicContact CG-CD1 4.28Å
133Y92.3Very high91.4Very high24 Ų2427.3 Ų27.39%0.09414%0.135CC..Hα-helixtrans-60.5-47.3178178.1-90.4000112L129 S130 V131 W135 C136 Q137 P158 I194L129-Y133 VanDerWaalsContact O-CB 3.28Å; L129-Y133 WeakPolarHBondContact O-CB 3.46Å; L129-Y133 PolarHBondContact O-N 3.33Å; S130-Y133 PolarHBondContact O-N 3.4Å; V131-Y133 VanDerWaalsContact C-N 3.32Å; V131-Y133 PolarHBondContact O-N 3.19Å; Y133-W135 VanDerWaalsContact C-N 3.27Å; Y133-W135 PolarHBondContact O-N 3.38Å; Y133-C136 WeakPolarHBondContact O-CB 3.24Å; Y133-C136 PolarHBondContact O-N 3.09Å; Y133-C136 VanDerWaalsContact O-N 3.14Å; Y133-Q137 HydrophobicContact CD1-CG 4.06Å; Y133-Q137 HydrophobicContact CE1-CG 3.53Å; Y133-Q137 HydrophobicContact CE2-CG 4.39Å; Y133-Q137 WeakPolarHBondContact O-CG 3.14Å; Y133-Q137 PolarHBondContact O-N 3.05Å; Y133-Q137 PolarHBondContact OH-NE2 3.22Å; Y133-P158 HydrophobicContact CD2-CB 4.31Å; Y133-P158 HydrophobicContact CD2-CG 3.88Å; Y133-I194 HydrophobicContact CD2-CB 4.41Å; Y133-I194 HydrophobicContact CD2-CG1 4.24Å; Y133-I194 HydrophobicContact CD2-CG2 3.87Å; Y133-I194 HydrophobicContact CE2-CG2 3.61Å
134V91.9Very high91.5Very high0 Ų028 Ų280%014%0.139CC..Hα-helixtrans-58.5-43.1177.31720000110.2L88 S130 V131 C136 Q137 H138 Y200L88-V134 HydrophobicContact CD1-CG1 4Å; L88-V134 HydrophobicContact CD2-CB 4.35Å; L88-V134 HydrophobicContact CD2-CG1 4.12Å; S130-V134 WeakPolarHBondContact O-CG2 3.37Å; S130-V134 PolarHBondContact O-N 3.29Å; V131-V134 PolarHBondContact O-N 2.88Å; V134-C136 PolarHBondContact O-N 3.11Å; V134-Q137 PolarHBondContact O-N 3.38Å; V134-H138 PolarHBondContact O-CD2 3.42Å; V134-H138 PolarHBondContact O-N 3.07Å; V134-Y200 HydrophobicContact CG1-CD1 4.41Å; V134-Y200 HydrophobicContact CG1-CE1 4.47Å; V134-Y200 HydrophobicContact CG2-CD1 4.04Å
135W93Very high91.3Very high3 Ų334.6 Ų34.61%0.01117%0.169CC..Hα-helixtrans-61.7-43.9175.9-176.685.6000112.4Y84 L88 V131 L132 Y133 Q137 H138 H139 M142 V144 A154Y84-W135 AromaticContact CD1-CD2 3.85Å; Y84-W135 HydrophobicContact CD1-CD2 3.85Å; Y84-W135 AromaticContact CD1-CE3 3.53Å; Y84-W135 HydrophobicContact CD1-CE3 3.53Å; Y84-W135 HydrophobicContact CD1-CG 4.4Å; Y84-W135 AromaticContact CD1-CZ3 3.93Å; Y84-W135 HydrophobicContact CD1-CZ3 3.93Å; Y84-W135 HydrophobicContact CE1-CD2 4.41Å; Y84-W135 AromaticContact CE1-CE3 3.7Å; Y84-W135 HydrophobicContact CE1-CE3 3.7Å; Y84-W135 HydrophobicContact CE1-CH2 4.26Å; Y84-W135 AromaticContact CE1-CZ3 3.63Å; Y84-W135 HydrophobicContact CE1-CZ3 3.63Å; L88-W135 HydrophobicContact CB-CB 4.48Å; L88-W135 HydrophobicContact CD1-CB 3.83Å; L88-W135 HydrophobicContact CD1-CG 4.4Å; V131-W135 PolarHBondContact O-N 3.45Å; L132-W135 PolarHBondContact O-N 3.23Å; Y133-W135 VanDerWaalsContact C-N 3.27Å; Y133-W135 PolarHBondContact O-N 3.38Å; W135-Q137 VanDerWaalsContact C-N 3.28Å; W135-Q137 PolarHBondContact O-N 2.91Å; W135-H138 PolarHBondContact O-N 3.49Å; W135-H139 AromaticContact CD1-ND1 3.75Å; W135-H139 AromaticContact CE2-ND1 3.68Å; W135-H139 HydrophobicContact CH2-CB 4.48Å; W135-H139 HydrophobicContact CZ2-CB 4.32Å; W135-H139 AromaticContact NE1-CE1 3.72Å; W135-H139 AromaticContact NE1-ND1 3.38Å; W135-H139 PolarHBondContact NE1-ND1 3.4Å; W135-H139 PolarHBondContact O-N 3.4Å; W135-H139 VanDerWaalsContact O-N 3.08Å; W135-H139 PolarHBondContact O-ND1 2.99Å; W135-M142 HydrophobicContact CH2-SD 3.88Å; W135-M142 HydrophobicContact CZ2-SD 3.86Å; W135-V144 HydrophobicContact CH2-CG2 3.62Å; W135-V144 HydrophobicContact CZ3-CG2 3.75Å; W135-A154 HydrophobicContact CZ3-CB 4.01Å
136C91.7Very high91.3Very high0 Ų033.9 Ų33.90%017%0.166CC..Hα-helixtrans-61.5-34.1176.7-69.60000112.8L132 Y133 V134 H139 A140 A154 P158L132-C136 PolarHBondContact O-N 3.07Å; L132-C136 PolarHBondContact O-SG 3.16Å; Y133-C136 WeakPolarHBondContact O-CB 3.24Å; Y133-C136 PolarHBondContact O-N 3.09Å; Y133-C136 VanDerWaalsContact O-N 3.14Å; V134-C136 PolarHBondContact O-N 3.11Å; C136-H139 CarbonylContact O-C 3.6Å; C136-A140 WeakPolarHBondContact O-CA 3.42Å; C136-A140 PolarHBondContact O-N 3.35Å; C136-A154 HydrophobicContact CB-CB 4.42Å; C136-A154 WeakPolarHBondContact CB-O 3.15Å; C136-A154 PolarHBondContact SG-O 3.49Å; C136-P158 HydrophobicContact CB-CG 4.33Å
137Q90.3Very high90.9Very high47 Ų4737 Ų3722%0.2218%0.178CC..Hα-helixtrans-70.5-39.3176.8-70.3-60.9-26.400112.2Y133 V134 W135 H139 Y201Y133-Q137 HydrophobicContact CD1-CG 4.06Å; Y133-Q137 HydrophobicContact CE1-CG 3.53Å; Y133-Q137 HydrophobicContact CE2-CG 4.39Å; Y133-Q137 WeakPolarHBondContact O-CG 3.14Å; Y133-Q137 PolarHBondContact O-N 3.05Å; Y133-Q137 PolarHBondContact OH-NE2 3.22Å; V134-Q137 PolarHBondContact O-N 3.38Å; W135-Q137 VanDerWaalsContact C-N 3.28Å; W135-Q137 PolarHBondContact O-N 2.91Å; Q137-H139 VanDerWaalsContact C-N 3.31Å; Q137-H139 PolarHBondContact O-N 2.81Å; Q137-Y201 HydrophobicContact CB-CD2 3.81Å; Q137-Y201 HydrophobicContact CB-CE2 3.72Å; Q137-Y201 HydrophobicContact CB-CG 4.27Å; Q137-Y201 HydrophobicContact CG-CD2 4.46Å; Q137-Y201 HydrophobicContact CG-CG 4.46Å
138H88.2Confident90.5Very high60 Ų6046.1 Ų46.128%0.27822%0.218SC..Hα-helixtrans-68.5-31175.8-75.8-65.5000113.3V92 V134 W135 Y205V92-H138 HydrophobicContact CG2-CB 3.84Å; V134-H138 PolarHBondContact O-CD2 3.42Å; V134-H138 PolarHBondContact O-N 3.07Å; W135-H138 PolarHBondContact O-N 3.49Å; H138-Y205 AromaticContact CE1-CD1 3.96Å; H138-Y205 AromaticContact CE1-CD2 3.8Å; H138-Y205 AromaticContact CE1-CE1 3.51Å; H138-Y205 AromaticContact CE1-CE2 3.34Å; H138-Y205 WeakPolarHBondContact CE1-CE2 3.17Å; H138-Y205 AromaticContact CE1-CZ 3.17Å; H138-Y205 PolarHBondContact CE1-OH 3.04Å; H138-Y205 AromaticContact NE2-CD2 3.89Å; H138-Y205 AromaticContact NE2-CE2 3.15Å; H138-Y205 WeakPolarHBondContact NE2-CE2 3.01Å; H138-Y205 AromaticContact NE2-CZ 3.28Å; H138-Y205 VanDerWaalsContact NE2-CZ 3.28Å; H138-Y205 PolarHBondContact NE2-OH 3.08Å
139H90.9Very high90.1Very high43 Ų4348.6 Ų48.620%0.19924%0.244CC..THydrogen-bonded Turntrans-118.337.6-176.4-59.998.2000112.2W135 C136 Q137 E141 M142 A154W135-H139 AromaticContact CD1-ND1 3.75Å; W135-H139 AromaticContact CE2-ND1 3.68Å; W135-H139 HydrophobicContact CH2-CB 4.48Å; W135-H139 HydrophobicContact CZ2-CB 4.32Å; W135-H139 AromaticContact NE1-CE1 3.72Å; W135-H139 AromaticContact NE1-ND1 3.38Å; W135-H139 PolarHBondContact NE1-ND1 3.4Å; W135-H139 PolarHBondContact O-N 3.4Å; W135-H139 VanDerWaalsContact O-N 3.08Å; W135-H139 PolarHBondContact O-ND1 2.99Å; C136-H139 CarbonylContact O-C 3.6Å; Q137-H139 VanDerWaalsContact C-N 3.31Å; Q137-H139 PolarHBondContact O-N 2.81Å; H139-E141 PolarHBondContact O-N 2.8Å; H139-E141 VanDerWaalsContact O-N 3.1Å; H139-M142 HydrophobicContact CB-CB 3.95Å; H139-M142 HydrophobicContact CB-CE 4.14Å; H139-M142 HydrophobicContact CB-SD 4.42Å; H139-M142 VanDerWaalsContact O-CB 3.24Å; H139-M142 WeakPolarHBondContact O-CB 3.3Å; H139-M142 PolarHBondContact O-N 2.98Å; H139-A154 WeakPolarHBondContact O-CB 3.19Å
140A89Confident90Very high23 Ų2350.9 Ų50.919%0.1926%0.258CS..THydrogen-bonded Turntrans-54.2-36.2-170.600000114.3C136 M155C136-A140 WeakPolarHBondContact O-CA 3.42Å; C136-A140 PolarHBondContact O-N 3.35Å; A140-M155 HydrophobicContact CB-CB 4.31Å; A140-M155 PolarHBondContact O-N 3.3Å
141E91.3Very high90Very high131 Ų13156.5 Ų56.561%0.61228%0.284SS*.THydrogen-bonded Turntrans-84.8-10.5179.4-64.3-56146.600114.2H139 I143 K153H139-E141 PolarHBondContact O-N 2.8Å; H139-E141 VanDerWaalsContact O-N 3.1Å; E141-I143 PolarHBondContact O-N 3.44Å; E141-K153 IonicContact OE2-NZ 2.69Å; E141-K153 PolarHBondContact OE2-NZ 3.22Å
142M91.4Very high89.9Confident85 Ų8560.1 Ų60.142%0.41930%0.3SS..PPolyproline II helixtrans-69.6132178.3-172.2-176.5-70.600110.1W135 H139 A154W135-M142 HydrophobicContact CH2-SD 3.88Å; W135-M142 HydrophobicContact CZ2-SD 3.86Å; H139-M142 HydrophobicContact CB-CB 3.95Å; H139-M142 HydrophobicContact CB-CE 4.14Å; H139-M142 HydrophobicContact CB-SD 4.42Å; H139-M142 VanDerWaalsContact O-CB 3.24Å; H139-M142 WeakPolarHBondContact O-CB 3.3Å; H139-M142 PolarHBondContact O-N 2.98Å; M142-A154 PolarHBondContact O-N 2.94Å
143I93.1Very high89.8Confident106 Ų10664.3 Ų64.354%0.54432%0.318SS..EExtended strand (participates in β ladder)trans-83.7119.1173.7-59.5172.7000108.3E141 Q151 F152E141-I143 PolarHBondContact O-N 3.44Å; I143-Q151 HydrophobicContact CG2-CB 3.77Å; I143-Q151 HydrophobicContact CG2-CG 4.47Å; I143-F152 CarbonylContact C-O 3.54Å; I143-F152 WeakPolarHBondContact CA-O 3.43Å
144V90Very high89.8Confident14 Ų1463.1 Ų63.19%0.08531%0.314CS..EExtended strand (participates in β ladder)trans-103.2134.6178.5-175.70000109.3W135 F152 A154 L157W135-V144 HydrophobicContact CH2-CG2 3.62Å; W135-V144 HydrophobicContact CZ3-CG2 3.75Å; V144-F152 PolarHBondContact N-O 3.3Å; V144-F152 PolarHBondContact O-N 2.87Å; V144-F152 VanDerWaalsContact O-N 3.11Å; V144-A154 HydrophobicContact CG2-CB 3.93Å; V144-L157 HydrophobicContact CB-CD1 3.93Å; V144-L157 HydrophobicContact CG1-CD1 3.73Å; V144-L157 HydrophobicContact CG2-CD1 4.2Å
145Q88.8Confident89.7Confident142 Ų14267.8 Ų67.866%0.66434%0.337SS*.EExtended strand (participates in β ladder)trans-78.9125.2171.2-59.8-178.221.600109.2Q151Q145-Q151 HydrophobicContact CG-CG 4.21Å
146F87.8Confident89.6Confident16 Ų1673.9 Ų73.97%0.0736%0.361CS..  trans-107.2177178.9-163.3-105000111F80 G149 T150 F152 I160 L161 F164F80-F146 HydrophobicContact CE1-CE2 4.45Å; F80-F146 HydrophobicContact CZ-CE2 4.18Å; F146-G149 PolarHBondContact O-N 2.81Å; F146-T150 PolarHBondContact N-O 2.89Å; F146-F152 HydrophobicContact CB-CD2 4.04Å; F146-F152 HydrophobicContact CB-CE2 4.19Å; F146-I160 HydrophobicContact CD1-CG2 4.2Å; F146-I160 HydrophobicContact CE1-CG2 4.08Å; F146-I160 HydrophobicContact CZ-CG2 4.29Å; F146-L161 HydrophobicContact CE2-CD2 3.41Å; F146-L161 VanDerWaalsContact CE2-CD2 3.41Å; F146-L161 HydrophobicContact CZ-CD2 3.65Å; F146-F164 HydrophobicContact CD1-CD2 4.28Å; F146-F164 AromaticContact CD1-CE2 3.77Å; F146-F164 HydrophobicContact CD1-CE2 3.77Å; F146-F164 AromaticContact CD1-CZ 3.93Å; F146-F164 HydrophobicContact CD1-CZ 3.93Å; F146-F164 AromaticContact CE1-CD1 3.9Å; F146-F164 HydrophobicContact CE1-CD1 3.9Å; F146-F164 AromaticContact CE1-CD2 3.32Å; F146-F164 HydrophobicContact CE1-CD2 3.32Å; F146-F164 AromaticContact CE1-CE1 3.78Å; F146-F164 HydrophobicContact CE1-CE1 3.78Å; F146-F164 AromaticContact CE1-CE2 3.19Å; F146-F164 HydrophobicContact CE1-CE2 3.19Å; F146-F164 AromaticContact CE1-CG 3.69Å; F146-F164 HydrophobicContact CE1-CG 3.69Å; F146-F164 AromaticContact CE1-CZ 3.44Å; F146-F164 HydrophobicContact CE1-CZ 3.44Å; F146-F164 VanDerWaalsContact CE1-CZ 3.44Å; F146-F164 HydrophobicContact CZ-CB 4.46Å; F146-F164 HydrophobicContact CZ-CD1 4.42Å; F146-F164 AromaticContact CZ-CD2 3.77Å; F146-F164 HydrophobicContact CZ-CD2 3.77Å; F146-F164 HydrophobicContact CZ-CE2 4.11Å; F146-F164 AromaticContact CZ-CG 3.95Å; F146-F164 HydrophobicContact CZ-CG 3.95Å
147Y81.3Confident89.6Confident69 Ų6974.2 Ų74.227%0.27136%0.362SS..G310 helixtrans-49.5147.3176.3-60.6-53.5000111.6I76 F80 G149 T150I76-Y147 HydrophobicContact CD1-CE2 4.44Å; I76-Y147 WeakPolarHBondContact CG2-OH 3.41Å; F80-Y147 HydrophobicContact CE1-CE2 4.39Å; F80-Y147 AromaticContact CZ-CE2 3.86Å; F80-Y147 HydrophobicContact CZ-CE2 3.86Å; F80-Y147 AromaticContact CZ-CZ 3.99Å; F80-Y147 WeakPolarHBondContact CZ-OH 3.3Å; Y147-G149 PolarHBondContact O-N 3.4Å; Y147-T150 PolarHBondContact O-N 3.37Å; Y147-T150 PolarHBondContact O-OG1 3.38Å
148F84.8Confident89.6Confident192 Ų19272.1 Ų72.184%0.84235%0.353SS*.G310 helixtrans64.118.9-176.9-51.6-83.2000115.2T150 F164F148-T150 PolarHBondContact O-N 3.45Å; F148-F164 HydrophobicContact CE2-CE1 4.48Å
149G85.9Confident89.6Confident56 Ų5674.8 Ų74.858%0.57736%0.361SS*.G310 helixtrans73.27.7178.800000114F146 Y147F146-G149 PolarHBondContact O-N 2.81Å; Y147-G149 PolarHBondContact O-N 3.4Å
150T89.7Confident89.6Confident53 Ų5374 Ų7433%0.32536%0.358SS..  trans-67.3140.5175.256.70000110.2F146 Y147 F148 F152F146-T150 PolarHBondContact N-O 2.89Å; Y147-T150 PolarHBondContact O-N 3.37Å; Y147-T150 PolarHBondContact O-OG1 3.38Å; F148-T150 PolarHBondContact O-N 3.45Å; T150-F152 VanDerWaalsContact OG1-CE2 3.27Å; T150-F152 WeakPolarHBondContact OG1-CE2 3.46Å
151Q91.5Very high89.6Confident119 Ų11972.9 Ų72.956%0.55635%0.349SS*.EExtended strand (participates in β ladder)trans-119.9130.3-175.5-65.2-173.7-10.500109.9I143 Q145I143-Q151 HydrophobicContact CG2-CB 3.77Å; I143-Q151 HydrophobicContact CG2-CG 4.47Å; Q145-Q151 HydrophobicContact CG-CG 4.21Å
152F91.3Very high89.4Confident79 Ų7968 Ų6835%0.34633%0.326SS..EExtended strand (participates in β ladder)trans-139.7154.6179.9-54-77.8000110.6I143 V144 F146 T150 I160I143-F152 CarbonylContact C-O 3.54Å; I143-F152 WeakPolarHBondContact CA-O 3.43Å; V144-F152 PolarHBondContact N-O 3.3Å; V144-F152 PolarHBondContact O-N 2.87Å; V144-F152 VanDerWaalsContact O-N 3.11Å; F146-F152 HydrophobicContact CB-CD2 4.04Å; F146-F152 HydrophobicContact CB-CE2 4.19Å; T150-F152 VanDerWaalsContact OG1-CE2 3.27Å; T150-F152 WeakPolarHBondContact OG1-CE2 3.46Å; F152-I160 HydrophobicContact CB-CD1 3.68Å; F152-I160 HydrophobicContact CD1-CD1 3.79Å; F152-I160 HydrophobicContact CD2-CD1 3.52Å; F152-I160 HydrophobicContact CE1-CD1 4.28Å; F152-I160 HydrophobicContact CE2-CD1 4.01Å; F152-I160 HydrophobicContact CG-CD1 3.37Å; F152-I160 HydrophobicContact CZ-CD1 4.37Å
153K92.1Very high89.2Confident88 Ų8868.6 Ų68.638%0.38333%0.33SS..EExtended strand (participates in β ladder)trans-62.6140.9168-67.1-168.9174.6-164.10110.1E141 M155 Y156E141-K153 IonicContact OE2-NZ 2.69Å; E141-K153 PolarHBondContact OE2-NZ 3.22Å; K153-M155 PolarHBondContact O-N 3.28Å; K153-M155 VanDerWaalsContact O-N 3.1Å; K153-Y156 HydrophobicContact CB-CD2 3.97Å; K153-Y156 HydrophobicContact CB-CE2 4.23Å; K153-Y156 PolarHBondContact O-N 3.37Å
154A91.1Very high88.9Confident0 Ų065.8 Ų65.80%031%0.314CS..G310 helixtrans-55.8-31.3-17900000112.4W135 C136 H139 M142 V144 Y156 L157W135-A154 HydrophobicContact CZ3-CB 4.01Å; C136-A154 HydrophobicContact CB-CB 4.42Å; C136-A154 WeakPolarHBondContact CB-O 3.15Å; C136-A154 PolarHBondContact SG-O 3.49Å; H139-A154 WeakPolarHBondContact O-CB 3.19Å; M142-A154 PolarHBondContact O-N 2.94Å; V144-A154 HydrophobicContact CG2-CB 3.93Å; A154-Y156 PolarHBondContact O-N 2.75Å; A154-L157 WeakPolarHBondContact O-CB 3.34Å; A154-L157 PolarHBondContact O-N 2.81Å
155M91.2Very high88.6Confident97 Ų9765.4 Ų65.448%0.47831%0.312SS..G310 helixtrans-53.5-35.7175.5-173.1-177.8-177.800113.8A140 K153A140-M155 HydrophobicContact CB-CB 4.31Å; A140-M155 PolarHBondContact O-N 3.3Å; K153-M155 PolarHBondContact O-N 3.28Å; K153-M155 VanDerWaalsContact O-N 3.1Å
156Y91.3Very high88.3Confident131 Ų13160.8 Ų60.851%0.51429%0.291SS..G310 helixtrans-87.4-10.8-178.4-59.6-62000113.4K153 A154 W159 I160K153-Y156 HydrophobicContact CB-CD2 3.97Å; K153-Y156 HydrophobicContact CB-CE2 4.23Å; K153-Y156 PolarHBondContact O-N 3.37Å; A154-Y156 PolarHBondContact O-N 2.75Å; Y156-W159 WeakPolarHBondContact O-CB 2.98Å; Y156-W159 PolarHBondContact O-N 3.22Å; Y156-W159 VanDerWaalsContact O-N 3.14Å; Y156-I160 WeakPolarHBondContact O-CG1 3.25Å; Y156-I160 PolarHBondContact O-N 3.47Å
157L90.8Very high88.1Confident7 Ų764 Ų644%0.03731%0.308CS..Hα-helixtrans-58.8-45.1-171.5-162.1151.4000113.5Y84 L132 V144 A154 W159 I160 L161Y84-L157 HydrophobicContact CE1-CD1 4.25Å; Y84-L157 HydrophobicContact CE2-CD2 4.42Å; Y84-L157 WeakPolarHBondContact OH-CD1 3.25Å; L132-L157 HydrophobicContact CD1-CD2 3.76Å; L132-L157 HydrophobicContact CD2-CD2 3.65Å; L132-L157 HydrophobicContact CG-CD2 3.99Å; V144-L157 HydrophobicContact CB-CD1 3.93Å; V144-L157 HydrophobicContact CG1-CD1 3.73Å; V144-L157 HydrophobicContact CG2-CD1 4.2Å; A154-L157 WeakPolarHBondContact O-CB 3.34Å; A154-L157 PolarHBondContact O-N 2.81Å; L157-W159 VanDerWaalsContact C-N 3.25Å; L157-W159 PolarHBondContact O-N 2.89Å; L157-I160 PolarHBondContact O-N 3.48Å; L157-L161 HydrophobicContact CD2-CD1 3.55Å; L157-L161 HydrophobicContact CD2-CD2 4.44Å; L157-L161 HydrophobicContact CD2-CG 3.75Å; L157-L161 WeakPolarHBondContact O-CG 3.47Å; L157-L161 PolarHBondContact O-N 3.08Å
158P89.9Confident88Confident4 Ų463.7 Ų63.73%0.02631%0.311CS..Hα-helixtrans-58.4-37177.9-23.734.3000113.2L132 Y133 C136 M162 I194L132-P158 HydrophobicContact CD2-CB 4.42Å; L132-P158 HydrophobicContact CD2-CG 3.96Å; Y133-P158 HydrophobicContact CD2-CB 4.31Å; Y133-P158 HydrophobicContact CD2-CG 3.88Å; C136-P158 HydrophobicContact CB-CG 4.33Å; P158-M162 PolarHBondContact O-N 3.47Å; P158-M162 VanDerWaalsContact O-N 3.15Å; P158-I194 HydrophobicContact CB-CD1 4.22Å; P158-I194 HydrophobicContact CB-CG1 4.37Å
159W89.7Confident87.4Confident116 Ų11659.3 Ų59.344%0.43929%0.289SS..Hα-helixtrans-73.7-39.3179-59109.7000112.1Y156 L157 L161 M162 L163 I194Y156-W159 WeakPolarHBondContact O-CB 2.98Å; Y156-W159 PolarHBondContact O-N 3.22Å; Y156-W159 VanDerWaalsContact O-N 3.14Å; L157-W159 VanDerWaalsContact C-N 3.25Å; L157-W159 PolarHBondContact O-N 2.89Å; W159-L161 VanDerWaalsContact C-N 3.33Å; W159-M162 HydrophobicContact CE3-CE 3.91Å; W159-M162 HydrophobicContact CE3-SD 4.34Å; W159-M162 HydrophobicContact CZ3-CE 4.42Å; W159-M162 HydrophobicContact CZ3-SD 4.5Å; W159-M162 WeakPolarHBondContact O-CB 3.29Å; W159-M162 PolarHBondContact O-N 3.1Å; W159-L163 PolarHBondContact O-N 3.39Å; W159-I194 HydrophobicContact CH2-CD1 4.34Å; W159-I194 HydrophobicContact CZ3-CD1 4.34Å
160I90.7Very high86.4Confident26 Ų2659.2 Ų59.213%0.13329%0.288CS..Hα-helixtrans-62.3-45.2174.2-67.5168000109.3F146 F152 Y156 L157 M162 L163 F164F146-I160 HydrophobicContact CD1-CG2 4.2Å; F146-I160 HydrophobicContact CE1-CG2 4.08Å; F146-I160 HydrophobicContact CZ-CG2 4.29Å; F152-I160 HydrophobicContact CB-CD1 3.68Å; F152-I160 HydrophobicContact CD1-CD1 3.79Å; F152-I160 HydrophobicContact CD2-CD1 3.52Å; F152-I160 HydrophobicContact CE1-CD1 4.28Å; F152-I160 HydrophobicContact CE2-CD1 4.01Å; F152-I160 HydrophobicContact CG-CD1 3.37Å; F152-I160 HydrophobicContact CZ-CD1 4.37Å; Y156-I160 WeakPolarHBondContact O-CG1 3.25Å; Y156-I160 PolarHBondContact O-N 3.47Å; L157-I160 PolarHBondContact O-N 3.48Å; I160-M162 VanDerWaalsContact C-N 3.3Å; I160-M162 PolarHBondContact O-N 3.14Å; I160-L163 WeakPolarHBondContact O-CB 3.5Å; I160-L163 PolarHBondContact O-N 3.27Å; I160-F164 HydrophobicContact CG2-CD2 3.53Å; I160-F164 HydrophobicContact CG2-CE2 3.56Å; I160-F164 VanDerWaalsContact O-CD2 3.31Å; I160-F164 WeakPolarHBondContact O-CD2 3.36Å; I160-F164 PolarHBondContact O-N 2.98Å
161L89Confident85Confident0 Ų060.6 Ų60.60%029%0.287CS..Hα-helixtrans-59.8-38.8176.8-71.4-172000113.7F80 L129 L132 F146 L157 W159 L163 F164 N165 F190F80-L161 HydrophobicContact CD2-CD1 4.12Å; F80-L161 HydrophobicContact CD2-CD2 4.37Å; F80-L161 HydrophobicContact CE1-CD2 4.08Å; F80-L161 HydrophobicContact CE2-CD1 3.87Å; F80-L161 HydrophobicContact CE2-CD2 3.35Å; F80-L161 HydrophobicContact CE2-CG 4.24Å; F80-L161 HydrophobicContact CZ-CD1 4.24Å; F80-L161 HydrophobicContact CZ-CD2 3.19Å; F80-L161 HydrophobicContact CZ-CG 4.35Å; L129-L161 HydrophobicContact CD2-CD1 4.25Å; L132-L161 HydrophobicContact CD1-CD1 3.2Å; L132-L161 HydrophobicContact CD2-CD1 4.05Å; L132-L161 HydrophobicContact CG-CD1 4.28Å; F146-L161 HydrophobicContact CE2-CD2 3.41Å; F146-L161 VanDerWaalsContact CE2-CD2 3.41Å; F146-L161 HydrophobicContact CZ-CD2 3.65Å; L157-L161 HydrophobicContact CD2-CD1 3.55Å; L157-L161 HydrophobicContact CD2-CD2 4.44Å; L157-L161 HydrophobicContact CD2-CG 3.75Å; L157-L161 WeakPolarHBondContact O-CG 3.47Å; L157-L161 PolarHBondContact O-N 3.08Å; W159-L161 VanDerWaalsContact C-N 3.33Å; L161-L163 VanDerWaalsContact C-N 3.32Å; L161-L163 PolarHBondContact O-N 2.95Å; L161-F164 PolarHBondContact O-N 2.95Å; L161-N165 WeakPolarHBondContact O-CB 3.18Å; L161-N165 PolarHBondContact O-N 3.45Å; L161-N165 PolarHBondContact O-ND2 3.18Å; L161-F190 HydrophobicContact CB-CE1 4.23Å
162M86.5Confident83.4Confident28 Ų2859.8 Ų59.814%0.13829%0.286CS..Hα-helixtrans-58.7-46.4173.9-179.3-17368.800111P158 W159 I160 N165 L166 Y187 F190P158-M162 PolarHBondContact O-N 3.47Å; P158-M162 VanDerWaalsContact O-N 3.15Å; W159-M162 HydrophobicContact CE3-CE 3.91Å; W159-M162 HydrophobicContact CE3-SD 4.34Å; W159-M162 HydrophobicContact CZ3-CE 4.42Å; W159-M162 HydrophobicContact CZ3-SD 4.5Å; W159-M162 WeakPolarHBondContact O-CB 3.29Å; W159-M162 PolarHBondContact O-N 3.1Å; I160-M162 VanDerWaalsContact C-N 3.3Å; I160-M162 PolarHBondContact O-N 3.14Å; M162-N165 PolarHBondContact O-N 3.16Å; M162-L166 PolarHBondContact O-N 2.85Å; M162-Y187 HydrophobicContact CE-CD2 3.87Å; M162-Y187 HydrophobicContact CE-CE2 3.43Å; M162-Y187 VanDerWaalsContact CE-CE2 3.43Å; M162-Y187 HydrophobicContact SD-CD2 3.41Å; M162-Y187 WeakPolarHBondContact SD-CD2 3.48Å; M162-Y187 HydrophobicContact SD-CE2 3.46Å; M162-Y187 WeakPolarHBondContact SD-CE2 2.91Å; M162-Y187 HydrophobicContact SD-CG 4.08Å; M162-F190 VanDerWaalsContact CA-CE1 3.45Å; M162-F190 HydrophobicContact CB-CB 4.32Å; M162-F190 HydrophobicContact CB-CD1 3.52Å; M162-F190 HydrophobicContact CB-CD2 4.41Å; M162-F190 HydrophobicContact CB-CE1 3.9Å; M162-F190 HydrophobicContact CB-CG 3.81Å; M162-F190 HydrophobicContact CG-CB 3.98Å; M162-F190 HydrophobicContact CG-CD1 4.02Å; M162-F190 HydrophobicContact CG-CD2 4.13Å; M162-F190 HydrophobicContact CG-CG 3.75Å; M162-F190 HydrophobicContact SD-CB 4.17Å
163L86.9Confident82.2Confident97 Ų9765.2 Ų65.251%0.50831%0.313SS..Hα-helixtrans-62.9-45.1177.1-177.664.4000111.7W159 I160 L161 L166 I167W159-L163 PolarHBondContact O-N 3.39Å; I160-L163 WeakPolarHBondContact O-CB 3.5Å; I160-L163 PolarHBondContact O-N 3.27Å; L161-L163 VanDerWaalsContact C-N 3.32Å; L161-L163 PolarHBondContact O-N 2.95Å; L163-L166 WeakPolarHBondContact O-CB 3.33Å; L163-L166 PolarHBondContact O-N 2.96Å; L163-I167 HydrophobicContact CD1-CD1 4.48Å; L163-I167 HydrophobicContact CG-CD1 4.19Å; L163-I167 WeakPolarHBondContact O-CG1 3.49Å; L163-I167 PolarHBondContact O-N 3.45Å; L163-I167 VanDerWaalsContact O-N 3.12Å
164F86.8Confident80.9Confident48 Ų4864.8 Ų64.821%0.21131%0.311CS..Hα-helixtrans-64.1-41.5177.6-86.9-88000112.3F146 F148 I160 L161 L166 I167 L168F146-F164 HydrophobicContact CD1-CD2 4.28Å; F146-F164 AromaticContact CD1-CE2 3.77Å; F146-F164 HydrophobicContact CD1-CE2 3.77Å; F146-F164 AromaticContact CD1-CZ 3.93Å; F146-F164 HydrophobicContact CD1-CZ 3.93Å; F146-F164 AromaticContact CE1-CD1 3.9Å; F146-F164 HydrophobicContact CE1-CD1 3.9Å; F146-F164 AromaticContact CE1-CD2 3.32Å; F146-F164 HydrophobicContact CE1-CD2 3.32Å; F146-F164 AromaticContact CE1-CE1 3.78Å; F146-F164 HydrophobicContact CE1-CE1 3.78Å; F146-F164 AromaticContact CE1-CE2 3.19Å; F146-F164 HydrophobicContact CE1-CE2 3.19Å; F146-F164 AromaticContact CE1-CG 3.69Å; F146-F164 HydrophobicContact CE1-CG 3.69Å; F146-F164 AromaticContact CE1-CZ 3.44Å; F146-F164 HydrophobicContact CE1-CZ 3.44Å; F146-F164 VanDerWaalsContact CE1-CZ 3.44Å; F146-F164 HydrophobicContact CZ-CB 4.46Å; F146-F164 HydrophobicContact CZ-CD1 4.42Å; F146-F164 AromaticContact CZ-CD2 3.77Å; F146-F164 HydrophobicContact CZ-CD2 3.77Å; F146-F164 HydrophobicContact CZ-CE2 4.11Å; F146-F164 AromaticContact CZ-CG 3.95Å; F146-F164 HydrophobicContact CZ-CG 3.95Å; F148-F164 HydrophobicContact CE2-CE1 4.48Å; I160-F164 HydrophobicContact CG2-CD2 3.53Å; I160-F164 HydrophobicContact CG2-CE2 3.56Å; I160-F164 VanDerWaalsContact O-CD2 3.31Å; I160-F164 WeakPolarHBondContact O-CD2 3.36Å; I160-F164 PolarHBondContact O-N 2.98Å; L161-F164 PolarHBondContact O-N 2.95Å; F164-L166 VanDerWaalsContact C-N 3.31Å; F164-L166 PolarHBondContact O-N 3.31Å; F164-I167 PolarHBondContact O-N 2.91Å; F164-L168 WeakPolarHBondContact O-CB 3.44Å; F164-L168 VanDerWaalsContact O-CG 3.23Å; F164-L168 WeakPolarHBondContact O-CG 3.02Å; F164-L168 PolarHBondContact O-N 2.97Å
165N83.7Confident80.3Confident6 Ų674.1 Ų74.13%0.03235%0.346CS..Hα-helixtrans-66.1-34.2176.4-81.9-86.6000112.1Q73 M77 L161 M162 I167 R169 F190Q73-N165 PolarHBondContact NE2-OD1 2.99Å; M77-N165 VanDerWaalsContact CE-OD1 3.32Å; M77-N165 WeakPolarHBondContact CE-OD1 3.47Å; L161-N165 WeakPolarHBondContact O-CB 3.18Å; L161-N165 PolarHBondContact O-N 3.45Å; L161-N165 PolarHBondContact O-ND2 3.18Å; M162-N165 PolarHBondContact O-N 3.16Å; N165-I167 VanDerWaalsContact C-N 3.34Å; N165-R169 WeakPolarHBondContact O-CB 3.28Å; N165-R169 PolarHBondContact O-N 3.37Å; N165-F190 HydrophobicContact CB-CE2 3.89Å; N165-F190 HydrophobicContact CB-CZ 3.66Å
166L82.9Confident79.8Confident44 Ų4476.4 Ų76.423%0.2336%0.359CS..Hα-helixtrans-60.1-45.4172.6-170.983.3000111.3M162 L163 F164 T183 V186M162-L166 PolarHBondContact O-N 2.85Å; L163-L166 WeakPolarHBondContact O-CB 3.33Å; L163-L166 PolarHBondContact O-N 2.96Å; F164-L166 VanDerWaalsContact C-N 3.31Å; F164-L166 PolarHBondContact O-N 3.31Å; L166-T183 HydrophobicContact CD1-CG2 3.96Å; L166-V186 HydrophobicContact CD1-CB 4.3Å; L166-V186 HydrophobicContact CD1-CG1 4.34Å
167I82.8Confident79.4Confident84 Ų8474.4 Ų74.443%0.43136%0.36SS..Hα-helixtrans-68-49.2179.4-64.2164.5000110.6L163 F164 N165 R169 G170L163-I167 HydrophobicContact CD1-CD1 4.48Å; L163-I167 HydrophobicContact CG-CD1 4.19Å; L163-I167 WeakPolarHBondContact O-CG1 3.49Å; L163-I167 PolarHBondContact O-N 3.45Å; L163-I167 VanDerWaalsContact O-N 3.12Å; F164-I167 PolarHBondContact O-N 2.91Å; N165-I167 VanDerWaalsContact C-N 3.34Å; I167-R169 VanDerWaalsContact C-N 3.27Å; I167-R169 PolarHBondContact O-N 2.82Å; I167-G170 PolarHBondContact O-N 2.92Å
168L80.1Confident78.9Confident62 Ų6278.1 Ų78.133%0.32538%0.378SS..Hα-helixtrans-65.5-27.5-176.4-71.3178.2000113.8F72 I76 F164 G170F72-L168 HydrophobicContact CD1-CD1 4.22Å; F72-L168 HydrophobicContact CD1-CD2 3.92Å; F72-L168 HydrophobicContact CE1-CD1 3.88Å; F72-L168 HydrophobicContact CE1-CD2 3.51Å; F72-L168 HydrophobicContact CE1-CG 4.3Å; I76-L168 HydrophobicContact CD1-CD1 3.37Å; F164-L168 WeakPolarHBondContact O-CB 3.44Å; F164-L168 VanDerWaalsContact O-CG 3.23Å; F164-L168 WeakPolarHBondContact O-CG 3.02Å; F164-L168 PolarHBondContact O-N 2.97Å; L168-G170 PolarHBondContact O-N 3.21Å
169R72.6Confident78.5Confident101 Ų10180.1 Ų80.138%0.38139%0.388SS..THydrogen-bonded Turntrans-64.1-6.5174.2-152.4168.4-152.2-138.12112.5N165 I167 R171N165-R169 WeakPolarHBondContact O-CB 3.28Å; N165-R169 PolarHBondContact O-N 3.37Å; I167-R169 VanDerWaalsContact C-N 3.27Å; I167-R169 PolarHBondContact O-N 2.82Å; R169-R171 HydrophobicContact CG-CG 4.4Å; R169-R171 VanDerWaalsContact NH1-NH1 3.12Å; R169-R171 WeakPolarHBondContact O-CG 3.27Å; R169-R171 PolarHBondContact O-N 2.74Å
170G64.6Low78.2Confident54 Ų5479 Ų7956%0.55739%0.393SS*.THydrogen-bonded Turntrans64.219.1166.500000113.5I167 L168 L172I167-G170 PolarHBondContact O-N 2.92Å; L168-G170 PolarHBondContact O-N 3.21Å; G170-L172 VanDerWaalsContact C-N 3.3Å; G170-L172 PolarHBondContact O-N 3.24Å
171R59.9Low77.8Confident81 Ų8182.8 Ų82.831%0.30641%0.413SS..G310 helixtrans-90.49.6-174.4-79.3-171.9178.3-174-0.9113.5R169 E173 K174 S182R169-R171 HydrophobicContact CG-CG 4.4Å; R169-R171 VanDerWaalsContact NH1-NH1 3.12Å; R169-R171 WeakPolarHBondContact O-CG 3.27Å; R169-R171 PolarHBondContact O-N 2.74Å; R171-E173 VanDerWaalsContact C-N 3.26Å; R171-E173 PolarHBondContact O-N 3.37Å; R171-K174 HydrophobicContact CB-CD 3.77Å; R171-K174 HydrophobicContact CB-CG 4.47Å; R171-K174 HydrophobicContact CG-CD 3.69Å; R171-K174 VanDerWaalsContact O-CB 3.31Å; R171-K174 WeakPolarHBondContact O-CB 3.45Å; R171-K174 WeakPolarHBondContact O-CG 3.22Å; R171-K174 PolarHBondContact O-N 2.91Å; R171-S182 WeakPolarHBondContact CD-OG 3.39Å; R171-S182 PolarHBondContact NH1-OG 2.99Å
172L58.2Low77.2Confident102 Ų10283.1 Ų83.153%0.53442%0.416SS..G310 helixtrans-72.4-19.1-178.1-59.7-179.8000112.9G170 K174G170-L172 VanDerWaalsContact C-N 3.3Å; G170-L172 PolarHBondContact O-N 3.24Å; L172-K174 PolarHBondContact O-N 3.15Å
173E65.9Low77Confident193 Ų19384 Ų8490%0.90242%0.423SS*.G310 helixtrans-74.8-4.5173.3-62.6-175-17600113.3R171R171-E173 VanDerWaalsContact C-N 3.26Å; R171-E173 PolarHBondContact O-N 3.37Å
174K64Low76.9Confident79 Ų7983.7 Ų83.734%0.34343%0.425SS..SBendtrans-83.3154.7-174.6-62.5177.9153.7-124.30111.7R171 L172 E178 I179R171-K174 HydrophobicContact CB-CD 3.77Å; R171-K174 HydrophobicContact CB-CG 4.47Å; R171-K174 HydrophobicContact CG-CD 3.69Å; R171-K174 VanDerWaalsContact O-CB 3.31Å; R171-K174 WeakPolarHBondContact O-CB 3.45Å; R171-K174 WeakPolarHBondContact O-CG 3.22Å; R171-K174 PolarHBondContact O-N 2.91Å; L172-K174 PolarHBondContact O-N 3.15Å; K174-E178 HydrophobicContact CB-CB 3.68Å; K174-E178 HydrophobicContact CD-CB 4.17Å; K174-E178 WeakPolarHBondContact CD-OE2 3.48Å; K174-E178 WeakPolarHBondContact CE-OE2 3.45Å; K174-E178 HydrophobicContact CG-CB 4.49Å; K174-E178 IonicContact NZ-OE2 3.05Å; K174-E178 PolarHBondContact NZ-OE2 2.93Å; K174-I179 HydrophobicContact CB-CG1 4.36Å; K174-I179 WeakPolarHBondContact O-CD1 3.13Å; K174-I179 WeakPolarHBondContact O-CG1 3.37Å
175R79.5Confident76.7Confident197 Ų19787 Ų8774%0.74344%0.444SS*.  trans-50.9146.6173.6-170175.4-179.2-177-0.2110.5V177 E178 I179R175-V177 PolarHBondContact O-N 3.29Å; R175-E178 WeakPolarHBondContact O-CA 3.26Å; R175-E178 WeakPolarHBondContact O-CB 3.42Å; R175-E178 PolarHBondContact O-N 3.45Å; R175-I179 PolarHBondContact O-N 3.11Å; R175-I179 VanDerWaalsContact O-N 3.08Å
176L81.4Confident76.5Confident144 Ų14487.5 Ų87.575%0.75445%0.447SS*.Hα-helixtrans-45.2-39.8-178.7-66.7175.9000113.9I179 V180L176-I179 PolarHBondContact O-N 2.95Å; L176-V180 WeakPolarHBondContact O-CG2 3.39Å; L176-V180 PolarHBondContact O-N 2.86Å
177V81.8Confident76.6Confident89 Ų8990.8 Ų90.854%0.53946%0.458SS..Hα-helixtrans-62.1-45177.1179.50000112.1R175 I179 V180 L181R175-V177 PolarHBondContact O-N 3.29Å; V177-I179 VanDerWaalsContact C-N 3.35Å; V177-V180 PolarHBondContact O-N 3.44Å; V177-L181 HydrophobicContact CG1-CD1 4.2Å; V177-L181 WeakPolarHBondContact O-CG 3.36Å; V177-L181 PolarHBondContact O-N 3.45Å
178E81Confident76.7Confident85 Ų8587.8 Ų87.840%0.39745%0.447SS..Hα-helixtrans-69.8-33178.2-74.5-176.7-134.200112.4K174 R175 S182K174-E178 HydrophobicContact CB-CB 3.68Å; K174-E178 HydrophobicContact CD-CB 4.17Å; K174-E178 WeakPolarHBondContact CD-OE2 3.48Å; K174-E178 WeakPolarHBondContact CE-OE2 3.45Å; K174-E178 HydrophobicContact CG-CB 4.49Å; K174-E178 IonicContact NZ-OE2 3.05Å; K174-E178 PolarHBondContact NZ-OE2 2.93Å; R175-E178 WeakPolarHBondContact O-CA 3.26Å; R175-E178 WeakPolarHBondContact O-CB 3.42Å; R175-E178 PolarHBondContact O-N 3.45Å; E178-S182 WeakPolarHBondContact O-CB 3.19Å; E178-S182 PolarHBondContact O-N 2.83Å
179I80.9Confident76.8Confident46 Ų4685.7 Ų85.724%0.23644%0.438CS..Hα-helixtrans-62.4-48.7172.2-66.9174.4000109.7K174 R175 L176 V177 L181 S182 T183K174-I179 HydrophobicContact CB-CG1 4.36Å; K174-I179 WeakPolarHBondContact O-CD1 3.13Å; K174-I179 WeakPolarHBondContact O-CG1 3.37Å; R175-I179 PolarHBondContact O-N 3.11Å; R175-I179 VanDerWaalsContact O-N 3.08Å; L176-I179 PolarHBondContact O-N 2.95Å; V177-I179 VanDerWaalsContact C-N 3.35Å; I179-L181 PolarHBondContact O-N 3.23Å; I179-S182 PolarHBondContact O-N 3.24Å; I179-T183 VanDerWaalsContact O-CB 3.31Å; I179-T183 WeakPolarHBondContact O-CB 3.45Å; I179-T183 PolarHBondContact O-N 3.43Å; I179-T183 PolarHBondContact O-OG1 2.84Å
180V83.3Confident77.3Confident92 Ų9281 Ų8156%0.55842%0.42SS*.Hα-helixtrans-61.3-46.1178.9171.60000111.2L176 V177 T183 T184L176-V180 WeakPolarHBondContact O-CG2 3.39Å; L176-V180 PolarHBondContact O-N 2.86Å; V177-V180 PolarHBondContact O-N 3.44Å; V180-T183 PolarHBondContact O-N 2.93Å; V180-T184 WeakPolarHBondContact O-CB 3.42Å; V180-T184 PolarHBondContact O-N 3.15Å; V180-T184 PolarHBondContact O-OG1 3.01Å
181L82.1Confident78.3Confident106 Ų10682.2 Ų82.256%0.55541%0.412SS*.Hα-helixtrans-63.1-44.7177.4-70.6175.6000111.9V177 I179 T183 T184 L185V177-L181 HydrophobicContact CG1-CD1 4.2Å; V177-L181 WeakPolarHBondContact O-CG 3.36Å; V177-L181 PolarHBondContact O-N 3.45Å; I179-L181 PolarHBondContact O-N 3.23Å; L181-T183 VanDerWaalsContact C-N 3.35Å; L181-T183 PolarHBondContact O-N 3.33Å; L181-T184 PolarHBondContact O-N 3.38Å; L181-L185 WeakPolarHBondContact O-CG 3.03Å; L181-L185 PolarHBondContact O-N 3.34Å
182S77Confident79.4Confident7 Ų780.5 Ų80.55%0.04941%0.405CS..Hα-helixtrans-66.5-38.5178.8-168.50000111.9R171 E178 I179 L185 V186R171-S182 WeakPolarHBondContact CD-OG 3.39Å; R171-S182 PolarHBondContact NH1-OG 2.99Å; E178-S182 WeakPolarHBondContact O-CB 3.19Å; E178-S182 PolarHBondContact O-N 2.83Å; I179-S182 PolarHBondContact O-N 3.24Å; S182-L185 PolarHBondContact O-N 2.67Å; S182-V186 WeakPolarHBondContact O-CB 3.07Å; S182-V186 WeakPolarHBondContact O-CG2 3.38Å; S182-V186 PolarHBondContact O-N 3.21Å
183T82Confident80.7Confident47 Ų4775.7 Ų75.729%0.28838%0.38SS..Hα-helixtrans-64.6-44.3177-53.70000110.1L166 I179 V180 L181 L185 V186 Y187L166-T183 HydrophobicContact CD1-CG2 3.96Å; I179-T183 VanDerWaalsContact O-CB 3.31Å; I179-T183 WeakPolarHBondContact O-CB 3.45Å; I179-T183 PolarHBondContact O-N 3.43Å; I179-T183 PolarHBondContact O-OG1 2.84Å; V180-T183 PolarHBondContact O-N 2.93Å; L181-T183 VanDerWaalsContact C-N 3.35Å; L181-T183 PolarHBondContact O-N 3.33Å; T183-L185 PolarHBondContact O-N 3.23Å; T183-V186 PolarHBondContact O-N 3.14Å; T183-Y187 VanDerWaalsContact O-CB 3.22Å; T183-Y187 WeakPolarHBondContact O-CB 3.39Å; T183-Y187 PolarHBondContact O-N 3.3Å
184T85Confident81.7Confident91 Ų9167.4 Ų67.456%0.55834%0.342SS*.Hα-helixtrans-61-44.6177.7-54.50000111.9V180 L181 G188V180-T184 WeakPolarHBondContact O-CB 3.42Å; V180-T184 PolarHBondContact O-N 3.15Å; V180-T184 PolarHBondContact O-OG1 3.01Å; L181-T184 PolarHBondContact O-N 3.38Å; T184-G188 PolarHBondContact O-N 3.23Å
185L81.7Confident82.8Confident117 Ų11769.3 Ų69.361%0.61335%0.347SS*.Hα-helixtrans-66.3-42.7178.1-69.9178000112.7L181 S182 T183 S189L181-L185 WeakPolarHBondContact O-CG 3.03Å; L181-L185 PolarHBondContact O-N 3.34Å; S182-L185 PolarHBondContact O-N 2.67Å; T183-L185 PolarHBondContact O-N 3.23Å; L185-S189 PolarHBondContact O-N 2.95Å
186V80.4Confident83.1Confident16 Ų1660.1 Ų60.110%0.09731%0.312CS..Hα-helixtrans-63.6-49.6176.5171.30000109.6L166 S182 T183 G188 S189 F190L166-V186 HydrophobicContact CD1-CB 4.3Å; L166-V186 HydrophobicContact CD1-CG1 4.34Å; S182-V186 WeakPolarHBondContact O-CB 3.07Å; S182-V186 WeakPolarHBondContact O-CG2 3.38Å; S182-V186 PolarHBondContact O-N 3.21Å; T183-V186 PolarHBondContact O-N 3.14Å; V186-G188 VanDerWaalsContact C-N 3.32Å; V186-G188 PolarHBondContact O-N 3.23Å; V186-S189 WeakPolarHBondContact O-CB 3.41Å; V186-S189 PolarHBondContact O-N 2.95Å; V186-F190 HydrophobicContact CG1-CD2 3.87Å; V186-F190 HydrophobicContact CG1-CE2 3.99Å; V186-F190 WeakPolarHBondContact O-CD2 3.46Å; V186-F190 PolarHBondContact O-N 3.38Å
187Y85Confident83.1Confident113 Ų11353.2 Ų53.244%0.44328%0.276SS..Hα-helixtrans-58.6-43.7179.5-153.9-81.9000111.6M162 T183 S189 F190 Q191M162-Y187 HydrophobicContact CE-CD2 3.87Å; M162-Y187 HydrophobicContact CE-CE2 3.43Å; M162-Y187 VanDerWaalsContact CE-CE2 3.43Å; M162-Y187 HydrophobicContact SD-CD2 3.41Å; M162-Y187 WeakPolarHBondContact SD-CD2 3.48Å; M162-Y187 HydrophobicContact SD-CE2 3.46Å; M162-Y187 WeakPolarHBondContact SD-CE2 2.91Å; M162-Y187 HydrophobicContact SD-CG 4.08Å; T183-Y187 VanDerWaalsContact O-CB 3.22Å; T183-Y187 WeakPolarHBondContact O-CB 3.39Å; T183-Y187 PolarHBondContact O-N 3.3Å; Y187-S189 VanDerWaalsContact C-N 3.35Å; Y187-S189 PolarHBondContact O-N 3.47Å; Y187-F190 PolarHBondContact O-N 2.77Å; Y187-Q191 VanDerWaalsContact O-CB 3.31Å; Y187-Q191 WeakPolarHBondContact O-CB 3.41Å; Y187-Q191 PolarHBondContact O-N 3.03Å
188G85Confident83.3Confident21 Ų2154.5 Ų54.522%0.21627%0.272CS..Hα-helixtrans-59.6-42.5174.400000112.7T184 V186 R192T184-G188 PolarHBondContact O-N 3.23Å; V186-G188 VanDerWaalsContact C-N 3.32Å; V186-G188 PolarHBondContact O-N 3.23Å; G188-R192 WeakPolarHBondContact O-CB 3.47Å; G188-R192 WeakPolarHBondContact O-CG 3.22Å; G188-R192 PolarHBondContact O-N 2.87Å; G188-R192 PolarHBondContact O-NE 3.42Å; G188-R192 VanDerWaalsContact O-NE 3.11Å
189S81.3Confident83.4Confident18 Ų1853.9 Ų53.913%0.12627%0.271CS..Hα-helixtrans-61.4-47.9176.3-148.90000112.9L185 V186 Y187 R192 A193L185-S189 PolarHBondContact O-N 2.95Å; V186-S189 WeakPolarHBondContact O-CB 3.41Å; V186-S189 PolarHBondContact O-N 2.95Å; Y187-S189 VanDerWaalsContact C-N 3.35Å; Y187-S189 PolarHBondContact O-N 3.47Å; S189-R192 WeakPolarHBondContact O-CB 3.15Å; S189-R192 PolarHBondContact O-N 3.38Å; S189-R192 PolarHBondContact OG-NH2 3.47Å; S189-A193 PolarHBondContact O-N 2.79Å; S189-A193 VanDerWaalsContact O-N 3.13Å
190F84.5Confident83.4Confident2 Ų251.8 Ų51.81%0.00926%0.26CS..Hα-helixtrans-65.5-46.3178.9-86.8-98.4000112.2L129 L161 M162 N165 V186 Y187 R192 A193 I194L129-F190 HydrophobicContact CD1-CD1 3.77Å; L129-F190 HydrophobicContact CD1-CD2 4.48Å; L129-F190 HydrophobicContact CD1-CE1 3.59Å; L129-F190 HydrophobicContact CD1-CE2 4.32Å; L129-F190 HydrophobicContact CD1-CG 4.22Å; L129-F190 HydrophobicContact CD1-CZ 3.87Å; L129-F190 HydrophobicContact CD2-CD1 4.29Å; L129-F190 HydrophobicContact CD2-CE1 3.69Å; L129-F190 HydrophobicContact CD2-CZ 4.36Å; L129-F190 HydrophobicContact CG-CE1 4.31Å; L161-F190 HydrophobicContact CB-CE1 4.23Å; M162-F190 VanDerWaalsContact CA-CE1 3.45Å; M162-F190 HydrophobicContact CB-CB 4.32Å; M162-F190 HydrophobicContact CB-CD1 3.52Å; M162-F190 HydrophobicContact CB-CD2 4.41Å; M162-F190 HydrophobicContact CB-CE1 3.9Å; M162-F190 HydrophobicContact CB-CG 3.81Å; M162-F190 HydrophobicContact CG-CB 3.98Å; M162-F190 HydrophobicContact CG-CD1 4.02Å; M162-F190 HydrophobicContact CG-CD2 4.13Å; M162-F190 HydrophobicContact CG-CG 3.75Å; M162-F190 HydrophobicContact SD-CB 4.17Å; N165-F190 HydrophobicContact CB-CE2 3.89Å; N165-F190 HydrophobicContact CB-CZ 3.66Å; V186-F190 HydrophobicContact CG1-CD2 3.87Å; V186-F190 HydrophobicContact CG1-CE2 3.99Å; V186-F190 WeakPolarHBondContact O-CD2 3.46Å; V186-F190 PolarHBondContact O-N 3.38Å; Y187-F190 PolarHBondContact O-N 2.77Å; F190-R192 PolarHBondContact O-N 2.92Å; F190-A193 PolarHBondContact O-N 3.47Å; F190-A193 VanDerWaalsContact O-N 3.16Å; F190-I194 WeakPolarHBondContact O-CB 3.35Å; F190-I194 WeakPolarHBondContact O-CG1 3.25Å; F190-I194 PolarHBondContact O-N 2.67Å
191Q85.2Confident83.2Confident81 Ų8149.5 Ų49.538%0.37924%0.242SC..Hα-helixtrans-61.3-34.3177.8-168.2-140.50.100111.7Y187 R195Y187-Q191 VanDerWaalsContact O-CB 3.31Å; Y187-Q191 WeakPolarHBondContact O-CB 3.41Å; Y187-Q191 PolarHBondContact O-N 3.03Å; Q191-R195 WeakPolarHBondContact O-CB 3.17Å; Q191-R195 VanDerWaalsContact O-CG 3.25Å; Q191-R195 WeakPolarHBondContact O-CG 3.31Å; Q191-R195 PolarHBondContact O-N 3.37Å; Q191-R195 PolarHBondContact O-NE 3.34Å
192R83.2Confident83.1Confident45 Ų4547.3 Ų47.317%0.1723%0.228CC..Hα-helixtrans-64.1-49.5173.3-73.5174.1-56.6-150.15111.4I114 L118 G188 S189 F190 I194 R195 I196I114-R192 HydrophobicContact CG2-CB 4.13Å; I114-R192 HydrophobicContact CG2-CG 3.9Å; L118-R192 VanDerWaalsContact CD1-CD 3.45Å; L118-R192 HydrophobicContact CD1-CG 4.45Å; G188-R192 WeakPolarHBondContact O-CB 3.47Å; G188-R192 WeakPolarHBondContact O-CG 3.22Å; G188-R192 PolarHBondContact O-N 2.87Å; G188-R192 PolarHBondContact O-NE 3.42Å; G188-R192 VanDerWaalsContact O-NE 3.11Å; S189-R192 WeakPolarHBondContact O-CB 3.15Å; S189-R192 PolarHBondContact O-N 3.38Å; S189-R192 PolarHBondContact OG-NH2 3.47Å; F190-R192 PolarHBondContact O-N 2.92Å; R192-I194 PolarHBondContact O-N 3.29Å; R192-R195 PolarHBondContact O-N 2.81Å; R192-I196 WeakPolarHBondContact O-CG1 3.22Å; R192-I196 PolarHBondContact O-N 3.46Å
193A85.4Confident83Confident0 Ų048.7 Ų48.70%024%0.235CC..Hα-helixtrans-60.6-44.3178.600000112.8P126 L129 S189 F190 R195 I196 G197P126-A193 HydrophobicContact CB-CB 3.94Å; L129-A193 HydrophobicContact CB-CB 3.55Å; L129-A193 HydrophobicContact CD1-CB 3.94Å; L129-A193 HydrophobicContact CG-CB 4.42Å; S189-A193 PolarHBondContact O-N 2.79Å; S189-A193 VanDerWaalsContact O-N 3.13Å; F190-A193 PolarHBondContact O-N 3.47Å; F190-A193 VanDerWaalsContact O-N 3.16Å; A193-R195 VanDerWaalsContact C-N 3.35Å; A193-R195 PolarHBondContact O-N 3.38Å; A193-I196 PolarHBondContact O-N 3.36Å; A193-G197 PolarHBondContact O-N 3.06Å; A193-G197 VanDerWaalsContact O-N 3.1Å
194I87Confident82.4Confident20 Ų2046.5 Ų46.510%0.10322%0.221CC..Hα-helixtrans-62.1-42.7176.7-69.5167.4000110.7Y133 P158 W159 F190 R192 I196 G197 Y198Y133-I194 HydrophobicContact CD2-CB 4.41Å; Y133-I194 HydrophobicContact CD2-CG1 4.24Å; Y133-I194 HydrophobicContact CD2-CG2 3.87Å; Y133-I194 HydrophobicContact CE2-CG2 3.61Å; P158-I194 HydrophobicContact CB-CD1 4.22Å; P158-I194 HydrophobicContact CB-CG1 4.37Å; W159-I194 HydrophobicContact CH2-CD1 4.34Å; W159-I194 HydrophobicContact CZ3-CD1 4.34Å; F190-I194 WeakPolarHBondContact O-CB 3.35Å; F190-I194 WeakPolarHBondContact O-CG1 3.25Å; F190-I194 PolarHBondContact O-N 2.67Å; R192-I194 PolarHBondContact O-N 3.29Å; I194-I196 VanDerWaalsContact C-N 3.34Å; I194-I196 PolarHBondContact O-N 3.16Å; I194-G197 PolarHBondContact O-N 2.9Å; I194-Y198 VanDerWaalsContact O-CB 3.28Å; I194-Y198 WeakPolarHBondContact O-CB 3.17Å; I194-Y198 PolarHBondContact O-N 3.32Å
195R86.7Confident81.8Confident119 Ų11944.1 Ų44.145%0.44920%0.202SC..Hα-helixtrans-62.8-37.8176.7-79.8-177.1-68.7-175.7-3.2112.8Q191 R192 A193 Y198 L199Q191-R195 WeakPolarHBondContact O-CB 3.17Å; Q191-R195 VanDerWaalsContact O-CG 3.25Å; Q191-R195 WeakPolarHBondContact O-CG 3.31Å; Q191-R195 PolarHBondContact O-N 3.37Å; Q191-R195 PolarHBondContact O-NE 3.34Å; R192-R195 PolarHBondContact O-N 2.81Å; A193-R195 VanDerWaalsContact C-N 3.35Å; A193-R195 PolarHBondContact O-N 3.38Å; R195-Y198 PolarHBondContact O-N 3.41Å; R195-L199 VanDerWaalsContact O-CB 3.32Å; R195-L199 WeakPolarHBondContact O-CB 3.14Å; R195-L199 PolarHBondContact O-N 3.4Å
196I84.8Confident81.1Confident3 Ų343.5 Ų43.52%0.01519%0.192CC..Hα-helixtrans-62.5-50.9175.7-66.1159.8000110N107 C110 A111 I114 P126 R192 A193 I194 Y198 L199 Y200N107-I196 HydrophobicContact CB-CG2 3.99Å; C110-I196 HydrophobicContact CB-CG1 4.15Å; C110-I196 HydrophobicContact CB-CG2 3.87Å; A111-I196 HydrophobicContact CB-CD1 3.85Å; I114-I196 HydrophobicContact CD1-CD1 3.94Å; I114-I196 HydrophobicContact CD1-CG1 3.6Å; P126-I196 HydrophobicContact CB-CD1 4.48Å; R192-I196 WeakPolarHBondContact O-CG1 3.22Å; R192-I196 PolarHBondContact O-N 3.46Å; A193-I196 PolarHBondContact O-N 3.36Å; I194-I196 VanDerWaalsContact C-N 3.34Å; I194-I196 PolarHBondContact O-N 3.16Å; I196-Y198 VanDerWaalsContact C-N 3.33Å; I196-Y198 PolarHBondContact O-N 3.29Å; I196-L199 PolarHBondContact O-N 2.91Å; I196-Y200 PolarHBondContact O-N 3.38Å; I196-Y200 VanDerWaalsContact O-N 3.14Å
197G82.5Confident80.3Confident0 Ų046.5 Ų46.50%020%0.202CC..Hα-helixtrans-62-40.4177.500000112.6A193 I194 Y200 Y201A193-G197 PolarHBondContact O-N 3.06Å; A193-G197 VanDerWaalsContact O-N 3.1Å; I194-G197 PolarHBondContact O-N 2.9Å; G197-Y200 PolarHBondContact O-N 2.64Å; G197-Y201 WeakPolarHBondContact O-CB 3.4Å; G197-Y201 PolarHBondContact O-N 2.67Å
198Y85.9Confident79.2Confident116 Ų11641.5 Ų41.546%0.45518%0.183SC..Hα-helixtrans-63.7-43.1175.2179-98.3000112.3I194 R195 I196 Y200 Y201 F202I194-Y198 VanDerWaalsContact O-CB 3.28Å; I194-Y198 WeakPolarHBondContact O-CB 3.17Å; I194-Y198 PolarHBondContact O-N 3.32Å; R195-Y198 PolarHBondContact O-N 3.41Å; I196-Y198 VanDerWaalsContact C-N 3.33Å; I196-Y198 PolarHBondContact O-N 3.29Å; Y198-Y200 VanDerWaalsContact C-N 3.35Å; Y198-Y200 PolarHBondContact O-N 2.72Å; Y198-Y201 PolarHBondContact O-N 2.66Å; Y198-F202 HydrophobicContact CE1-CB 4.21Å; Y198-F202 WeakPolarHBondContact O-CB 3.32Å; Y198-F202 PolarHBondContact O-N 3.15Å
199L82.7Confident78.5Confident72 Ų7246.1 Ų46.138%0.37720%0.199SC..Hα-helixtrans-60.6-45.5178.8-179.363000111.1F106 R195 I196 F202 L203F106-L199 HydrophobicContact CE1-CD2 4.49Å; F106-L199 HydrophobicContact CE1-CG 4.35Å; F106-L199 HydrophobicContact CZ-CD2 4.25Å; F106-L199 HydrophobicContact CZ-CG 4.26Å; R195-L199 VanDerWaalsContact O-CB 3.32Å; R195-L199 WeakPolarHBondContact O-CB 3.14Å; R195-L199 PolarHBondContact O-N 3.4Å; I196-L199 PolarHBondContact O-N 2.91Å; L199-F202 PolarHBondContact O-N 3.01Å; L199-L203 HydrophobicContact CD1-CD1 3.82Å; L199-L203 HydrophobicContact CD1-CG 4.11Å; L199-L203 HydrophobicContact CG-CD1 3.95Å; L199-L203 WeakPolarHBondContact O-CB 3.49Å; L199-L203 VanDerWaalsContact O-CG 3.27Å; L199-L203 WeakPolarHBondContact O-CG 3.35Å; L199-L203 PolarHBondContact O-N 3.45Å
200Y80.5Confident77.9Confident1 Ų150.6 Ų50.60%0.00422%0.218CC..Hα-helixtrans-61-48.3174.6176.3-95.7000111.8M103 F106 N107 V134 I196 G197 Y198 F202 L203 T204 Y205 L217M103-Y200 HydrophobicContact CB-CD2 4.4Å; M103-Y200 HydrophobicContact CB-CE1 3.94Å; M103-Y200 HydrophobicContact CB-CE2 3.68Å; M103-Y200 VanDerWaalsContact CB-CZ 3.41Å; M103-Y200 WeakPolarHBondContact CB-OH 3.2Å; M103-Y200 HydrophobicContact CG-CD1 3.55Å; M103-Y200 HydrophobicContact CG-CD2 3.94Å; M103-Y200 HydrophobicContact CG-CE1 3.18Å; M103-Y200 HydrophobicContact CG-CE2 3.59Å; M103-Y200 HydrophobicContact CG-CG 3.92Å; F106-Y200 HydrophobicContact CB-CD2 4.29Å; F106-Y200 AromaticContact CD1-CD2 3.57Å; F106-Y200 HydrophobicContact CD1-CD2 3.57Å; F106-Y200 HydrophobicContact CD1-CG 4.17Å; F106-Y200 HydrophobicContact CE1-CD2 4.19Å; F106-Y200 HydrophobicContact CG-CD2 4.1Å; N107-Y200 WeakPolarHBondContact OD1-CB 3.32Å; V134-Y200 HydrophobicContact CG1-CD1 4.41Å; V134-Y200 HydrophobicContact CG1-CE1 4.47Å; V134-Y200 HydrophobicContact CG2-CD1 4.04Å; I196-Y200 PolarHBondContact O-N 3.38Å; I196-Y200 VanDerWaalsContact O-N 3.14Å; G197-Y200 PolarHBondContact O-N 2.64Å; Y198-Y200 VanDerWaalsContact C-N 3.35Å; Y198-Y200 PolarHBondContact O-N 2.72Å; Y200-F202 VanDerWaalsContact C-N 3.34Å; Y200-F202 PolarHBondContact O-N 3.01Å; Y200-L203 PolarHBondContact O-N 3.11Å; Y200-T204 WeakPolarHBondContact CE2-OG1 3.49Å; Y200-T204 VanDerWaalsContact O-CB 3.25Å; Y200-T204 WeakPolarHBondContact O-CB 3.36Å; Y200-T204 PolarHBondContact O-N 3.22Å; Y200-T204 PolarHBondContact O-OG1 3.07Å; Y200-Y205 HydrophobicContact CE1-CE2 4.17Å; Y200-L217 HydrophobicContact CD2-CD1 4.13Å; Y200-L217 HydrophobicContact CE2-CD1 4.34Å
201Y79Confident77.3Confident45 Ų4554.9 Ų54.918%0.17625%0.245CC..Hα-helixtrans-61.6-43.3-179.5178.7-94.3000111.8Q137 G197 Y198 Y205 R206Q137-Y201 HydrophobicContact CB-CD2 3.81Å; Q137-Y201 HydrophobicContact CB-CE2 3.72Å; Q137-Y201 HydrophobicContact CB-CG 4.27Å; Q137-Y201 HydrophobicContact CG-CD2 4.46Å; Q137-Y201 HydrophobicContact CG-CG 4.46Å; G197-Y201 WeakPolarHBondContact O-CB 3.4Å; G197-Y201 PolarHBondContact O-N 2.67Å; Y198-Y201 PolarHBondContact O-N 2.66Å; Y201-Y205 AromaticContact CD2-CD2 3.48Å; Y201-Y205 HydrophobicContact CD2-CD2 3.48Å; Y201-Y205 VanDerWaalsContact CD2-CD2 3.48Å; Y201-Y205 HydrophobicContact CD2-CE2 4.13Å; Y201-Y205 HydrophobicContact CD2-CG 4.24Å; Y201-Y205 AromaticContact CE2-CD2 3.84Å; Y201-Y205 HydrophobicContact CE2-CD2 3.84Å; Y201-Y205 HydrophobicContact CE2-CG 4.17Å; Y201-Y205 HydrophobicContact CG-CD2 4.15Å; Y201-Y205 WeakPolarHBondContact O-CB 3.46Å; Y201-Y205 PolarHBondContact O-N 3.35Å; Y201-R206 PolarHBondContact O-N 2.96Å
202F81Confident76.1Confident59 Ų5954.5 Ų54.526%0.25926%0.262SS..Iπ-helixtrans-62.9-50.5178.4177.6-98.3000111.5Y198 L199 Y200 T204 R206 Y207Y198-F202 HydrophobicContact CE1-CB 4.21Å; Y198-F202 WeakPolarHBondContact O-CB 3.32Å; Y198-F202 PolarHBondContact O-N 3.15Å; L199-F202 PolarHBondContact O-N 3.01Å; Y200-F202 VanDerWaalsContact C-N 3.34Å; Y200-F202 PolarHBondContact O-N 3.01Å; F202-T204 VanDerWaalsContact C-N 3.31Å; F202-T204 PolarHBondContact O-N 3.44Å; F202-R206 HydrophobicContact CD2-CB 3.73Å; F202-R206 HydrophobicContact CD2-CG 3.84Å; F202-R206 HydrophobicContact CE2-CB 4.24Å; F202-R206 HydrophobicContact CE2-CG 3.98Å; F202-R206 HydrophobicContact CG-CB 4.42Å; F202-R206 PolarHBondContact O-N 3.12Å; F202-Y207 HydrophobicContact CE1-CD2 4.39Å; F202-Y207 WeakPolarHBondContact O-CB 3.18Å; F202-Y207 PolarHBondContact O-N 3.35Å
203L74.4Confident75Confident36 Ų3654.2 Ų54.219%0.18827%0.273CS..Iπ-helixtrans-67.9-30.5-178.3-69172.9000113.3F106 L199 Y200 L216 L217F106-L203 HydrophobicContact CE2-CD1 4.38Å; F106-L203 HydrophobicContact CZ-CD1 3.72Å; L199-L203 HydrophobicContact CD1-CD1 3.82Å; L199-L203 HydrophobicContact CD1-CG 4.11Å; L199-L203 HydrophobicContact CG-CD1 3.95Å; L199-L203 WeakPolarHBondContact O-CB 3.49Å; L199-L203 VanDerWaalsContact O-CG 3.27Å; L199-L203 WeakPolarHBondContact O-CG 3.35Å; L199-L203 PolarHBondContact O-N 3.45Å; Y200-L203 PolarHBondContact O-N 3.11Å; L203-L216 HydrophobicContact CD2-CD1 4.22Å; L203-L217 HydrophobicContact CB-CD1 3.72Å; L203-L217 HydrophobicContact CB-CG 4.24Å; L203-L217 HydrophobicContact CD1-CD1 4.19Å
204T69.9Low74Confident1 Ų161.5 Ų61.51%0.00631%0.307CS..Iπ-helixtrans-91.9-35.8-174.6-50.50000113Y200 F202 P208 F237Y200-T204 WeakPolarHBondContact CE2-OG1 3.49Å; Y200-T204 VanDerWaalsContact O-CB 3.25Å; Y200-T204 WeakPolarHBondContact O-CB 3.36Å; Y200-T204 PolarHBondContact O-N 3.22Å; Y200-T204 PolarHBondContact O-OG1 3.07Å; F202-T204 VanDerWaalsContact C-N 3.31Å; F202-T204 PolarHBondContact O-N 3.44Å; T204-P208 WeakPolarHBondContact O-CG 3.3Å; T204-F237 HydrophobicContact CG2-CD1 4.25Å
205Y72.3Confident72.7Confident41 Ų4161.1 Ų61.116%0.16131%0.306CS..Iπ-helixtrans-115.3-54-173.1-58.5-75.1000111.9H138 Y200 Y201 P208 E209H138-Y205 AromaticContact CE1-CD1 3.96Å; H138-Y205 AromaticContact CE1-CD2 3.8Å; H138-Y205 AromaticContact CE1-CE1 3.51Å; H138-Y205 AromaticContact CE1-CE2 3.34Å; H138-Y205 WeakPolarHBondContact CE1-CE2 3.17Å; H138-Y205 AromaticContact CE1-CZ 3.17Å; H138-Y205 PolarHBondContact CE1-OH 3.04Å; H138-Y205 AromaticContact NE2-CD2 3.89Å; H138-Y205 AromaticContact NE2-CE2 3.15Å; H138-Y205 WeakPolarHBondContact NE2-CE2 3.01Å; H138-Y205 AromaticContact NE2-CZ 3.28Å; H138-Y205 VanDerWaalsContact NE2-CZ 3.28Å; H138-Y205 PolarHBondContact NE2-OH 3.08Å; Y200-Y205 HydrophobicContact CE1-CE2 4.17Å; Y201-Y205 AromaticContact CD2-CD2 3.48Å; Y201-Y205 HydrophobicContact CD2-CD2 3.48Å; Y201-Y205 VanDerWaalsContact CD2-CD2 3.48Å; Y201-Y205 HydrophobicContact CD2-CE2 4.13Å; Y201-Y205 HydrophobicContact CD2-CG 4.24Å; Y201-Y205 AromaticContact CE2-CD2 3.84Å; Y201-Y205 HydrophobicContact CE2-CD2 3.84Å; Y201-Y205 HydrophobicContact CE2-CG 4.17Å; Y201-Y205 HydrophobicContact CG-CD2 4.15Å; Y201-Y205 WeakPolarHBondContact O-CB 3.46Å; Y201-Y205 PolarHBondContact O-N 3.35Å; Y205-P208 WeakPolarHBondContact O-CD 3.46Å; Y205-P208 WeakPolarHBondContact O-CG 3.37Å; Y205-E209 WeakPolarHBondContact O-CB 3.48Å; Y205-E209 WeakPolarHBondContact O-CG 3.5Å; Y205-E209 PolarHBondContact O-N 3.45Å
206R67.6Low71.4Confident105 Ų10560.3 Ų60.340%0.39631%0.311SS..Iπ-helixtrans-69.9-41.6-173-168.466.7-170.2139.44.6113.5Y201 F202 E209 E210Y201-R206 PolarHBondContact O-N 2.96Å; F202-R206 HydrophobicContact CD2-CB 3.73Å; F202-R206 HydrophobicContact CD2-CG 3.84Å; F202-R206 HydrophobicContact CE2-CB 4.24Å; F202-R206 HydrophobicContact CE2-CG 3.98Å; F202-R206 HydrophobicContact CG-CB 4.42Å; F202-R206 PolarHBondContact O-N 3.12Å; R206-E209 IonicContact NH1-OE2 2.71Å; R206-E209 PolarHBondContact NH1-OE2 3.03Å; R206-E209 PolarHBondContact O-N 3.2Å; R206-E210 IonicContact CZ-OE1 2.73Å; R206-E210 IonicContact NE-OE1 2.66Å; R206-E210 PolarHBondContact NE-OE1 2.85Å; R206-E210 IonicContact NH2-OE1 3.44Å; R206-E210 PolarHBondContact NH2-OE1 3.16Å; R206-E210 WeakPolarHBondContact O-CG 3.15Å; R206-E210 PolarHBondContact O-N 2.77Å; R206-E210 VanDerWaalsContact O-N 3.07Å
207Y63.4Low70.5Confident78 Ų7861.4 Ų61.431%0.30632%0.316SS..Hα-helixtrans-63.8-50.3-179.2-173-89.2000113.4F202 E209 E210 V211 L216F202-Y207 HydrophobicContact CE1-CD2 4.39Å; F202-Y207 WeakPolarHBondContact O-CB 3.18Å; F202-Y207 PolarHBondContact O-N 3.35Å; Y207-E209 VanDerWaalsContact C-N 3.28Å; Y207-E209 PolarHBondContact O-N 3.23Å; Y207-E210 PolarHBondContact O-N 3.34Å; Y207-V211 HydrophobicContact CD2-CG2 4.42Å; Y207-V211 HydrophobicContact CE1-CG2 4.26Å; Y207-V211 HydrophobicContact CE2-CG2 4.07Å; Y207-V211 PolarHBondContact O-N 3.31Å; Y207-V211 VanDerWaalsContact O-N 3.08Å; Y207-L216 HydrophobicContact CD1-CD1 3.64Å; Y207-L216 HydrophobicContact CD1-CD2 4.45Å; Y207-L216 HydrophobicContact CD1-CG 3.68Å; Y207-L216 HydrophobicContact CD2-CD1 4.44Å; Y207-L216 HydrophobicContact CE1-CD1 3.48Å; Y207-L216 VanDerWaalsContact CE1-CD1 3.48Å; Y207-L216 HydrophobicContact CE1-CD2 3.85Å; Y207-L216 HydrophobicContact CE1-CG 3.55Å; Y207-L216 HydrophobicContact CE2-CD1 4.29Å; Y207-L216 HydrophobicContact CG-CD1 4.13Å
208P62.1Low69.9Low9 Ų969.4 Ų69.46%0.05835%0.346CS..Hα-helixtrans-65.6-30.117623.5-31.8000113T204 Y205 G212 G213T204-P208 WeakPolarHBondContact O-CG 3.3Å; Y205-P208 WeakPolarHBondContact O-CD 3.46Å; Y205-P208 WeakPolarHBondContact O-CG 3.37Å; P208-G212 WeakPolarHBondContact O-CA 3.42Å; P208-G212 PolarHBondContact O-N 3.43Å; P208-G213 VanDerWaalsContact CB-O 3.26Å; P208-G213 WeakPolarHBondContact CB-O 3.31Å
209E68.9Low69.4Low117 Ų11764.1 Ų64.155%0.54733%0.326SS..Hα-helixtrans-64.8-41.1173.7-76.9171.2-169.700113.3Y205 R206 Y207Y205-E209 WeakPolarHBondContact O-CB 3.48Å; Y205-E209 WeakPolarHBondContact O-CG 3.5Å; Y205-E209 PolarHBondContact O-N 3.45Å; R206-E209 IonicContact NH1-OE2 2.71Å; R206-E209 PolarHBondContact NH1-OE2 3.03Å; R206-E209 PolarHBondContact O-N 3.2Å; Y207-E209 VanDerWaalsContact C-N 3.28Å; Y207-E209 PolarHBondContact O-N 3.23Å
210E69.8Low69.1Low112 Ų11262.5 Ų62.552%0.52332%0.32SS..Hα-helixtrans-80.9-38.3-176.4-72179.9175.600113.3R206 Y207R206-E210 IonicContact CZ-OE1 2.73Å; R206-E210 IonicContact NE-OE1 2.66Å; R206-E210 PolarHBondContact NE-OE1 2.85Å; R206-E210 IonicContact NH2-OE1 3.44Å; R206-E210 PolarHBondContact NH2-OE1 3.16Å; R206-E210 WeakPolarHBondContact O-CG 3.15Å; R206-E210 PolarHBondContact O-N 2.77Å; R206-E210 VanDerWaalsContact O-N 3.07Å; Y207-E210 PolarHBondContact O-N 3.34Å
211V70.3Confident68.9Low93 Ų9365.8 Ų65.856%0.56435%0.348SS*.Hα-helixtrans-92.2-14.2-176.1-176.60000112Y207 G213Y207-V211 HydrophobicContact CD2-CG2 4.42Å; Y207-V211 HydrophobicContact CE1-CG2 4.26Å; Y207-V211 HydrophobicContact CE2-CG2 4.07Å; Y207-V211 PolarHBondContact O-N 3.31Å; Y207-V211 VanDerWaalsContact O-N 3.08Å; V211-G213 VanDerWaalsContact C-N 3.29Å; V211-G213 PolarHBondContact O-N 3.18Å
212G60.7Low69Low73 Ų7369 Ų6975%0.75336%0.363SS*.  trans69.325-176.900000113.7P208P208-G212 WeakPolarHBondContact O-CA 3.42Å; P208-G212 PolarHBondContact O-N 3.43Å
213G61Low69Low39 Ų3966.3 Ų66.340%0.40235%0.351SS..  trans-105173.2-176.600000114.4P208 V211P208-G213 VanDerWaalsContact CB-O 3.26Å; P208-G213 WeakPolarHBondContact CB-O 3.31Å; V211-G213 VanDerWaalsContact C-N 3.29Å; V211-G213 PolarHBondContact O-N 3.18Å
214E63.2Low69.2Low152 Ų15268.5 Ų68.571%0.7136%0.357SS*.  trans-62.3148.4165.3-63-168.6162.800110.1L216E214-L216 PolarHBondContact O-N 2.86Å
215S61.1Low69.6Low12 Ų1278.7 Ų78.78%0.08440%0.396CS..  trans-49.4130.5170.963.50000111.2L217 F237S215-L217 PolarHBondContact O-N 3.5Å; S215-F237 WeakPolarHBondContact OG-CB 3.47Å
216L58.6Low69.9Low103 Ų10382.3 Ų82.354%0.53942%0.417SS..SBendtrans-62.4-30.6173.7-67.7179.1000112L203 Y207 E214 R218L203-L216 HydrophobicContact CD2-CD1 4.22Å; Y207-L216 HydrophobicContact CD1-CD1 3.64Å; Y207-L216 HydrophobicContact CD1-CD2 4.45Å; Y207-L216 HydrophobicContact CD1-CG 3.68Å; Y207-L216 HydrophobicContact CD2-CD1 4.44Å; Y207-L216 HydrophobicContact CE1-CD1 3.48Å; Y207-L216 VanDerWaalsContact CE1-CD1 3.48Å; Y207-L216 HydrophobicContact CE1-CD2 3.85Å; Y207-L216 HydrophobicContact CE1-CG 3.55Å; Y207-L216 HydrophobicContact CE2-CD1 4.29Å; Y207-L216 HydrophobicContact CG-CD1 4.13Å; E214-L216 PolarHBondContact O-N 2.86Å; L216-R218 PolarHBondContact O-N 3.41Å
217L65.9Low70.4Confident26 Ų2679 Ų7914%0.13641%0.405CS..SBendtrans-95.179.8-178.4-72.9-179.7000110.3F102 F106 Y200 L203 S215F102-L217 HydrophobicContact CE1-CB 3.94Å; F102-L217 HydrophobicContact CE1-CD2 4.33Å; F102-L217 HydrophobicContact CZ-CB 4.42Å; F102-L217 HydrophobicContact CZ-CD2 4.16Å; F106-L217 HydrophobicContact CD2-CD1 4.19Å; F106-L217 HydrophobicContact CD2-CD2 3.96Å; F106-L217 HydrophobicContact CE1-CD1 4.43Å; F106-L217 HydrophobicContact CE2-CD1 4.04Å; F106-L217 HydrophobicContact CE2-CD2 3.86Å; F106-L217 HydrophobicContact CG-CD1 4.45Å; F106-L217 HydrophobicContact CZ-CD1 4.17Å; Y200-L217 HydrophobicContact CD2-CD1 4.13Å; Y200-L217 HydrophobicContact CE2-CD1 4.34Å; L203-L217 HydrophobicContact CB-CD1 3.72Å; L203-L217 HydrophobicContact CB-CG 4.24Å; L203-L217 HydrophobicContact CD1-CD1 4.19Å; S215-L217 PolarHBondContact O-N 3.5Å
218R69Low70.8Confident167 Ų16779.9 Ų79.963%0.6342%0.421SS*.PPolyproline II helixtrans-80.2123.1172.6-172.7172.8-179.5170.30.6109.9L216L216-R218 PolarHBondContact O-N 3.41Å
219T75.4Confident71.1Confident5 Ų580.9 Ų80.93%0.03143%0.428CS..PPolyproline II helixtrans-54.2123.6172.8-59.40000109.8A98 D99 F102 L223 Y224 F237A98-T219 HydrophobicContact CB-CG2 4.42Å; D99-T219 VanDerWaalsContact OD1-CB 3.32Å; D99-T219 WeakPolarHBondContact OD1-CB 2.96Å; D99-T219 WeakPolarHBondContact OD1-CG2 3.38Å; D99-T219 PolarHBondContact OD1-OG1 3.04Å; F102-T219 HydrophobicContact CB-CG2 4.11Å; F102-T219 HydrophobicContact CG-CG2 4.47Å; T219-L223 HydrophobicContact CG2-CB 4Å; T219-L223 HydrophobicContact CG2-CD1 4.01Å; T219-Y224 WeakPolarHBondContact CB-OH 3.44Å; T219-Y224 HydrophobicContact CG2-CD2 4.34Å; T219-Y224 HydrophobicContact CG2-CE1 4.39Å; T219-Y224 HydrophobicContact CG2-CE2 3.73Å; T219-F237 WeakPolarHBondContact OG1-CE2 3.23Å; T219-F237 WeakPolarHBondContact OG1-CZ 3.4Å
220P77.9Confident70.8Confident39 Ų3980.9 Ų80.925%0.25344%0.437SS..PPolyproline II helixtrans-66.9141.7-178.728-36.4000110.9F102 F222 L223F102-P220 HydrophobicContact CD2-CG 4.1Å; F102-P220 VanDerWaalsContact CE2-CD 3.5Å; F102-P220 HydrophobicContact CE2-CG 4.28Å; P220-F222 HydrophobicContact CB-CD1 3.59Å; P220-F222 HydrophobicContact CB-CE1 3.44Å; P220-F222 VanDerWaalsContact CB-CE1 3.44Å; P220-F222 HydrophobicContact CB-CZ 4.48Å; P220-F222 HydrophobicContact CG-CD1 3.86Å; P220-F222 HydrophobicContact CG-CE1 3.27Å; P220-F222 HydrophobicContact CG-CZ 3.87Å; P220-F222 PolarHBondContact O-N 3.28Å; P220-L223 HydrophobicContact CG-CD1 3.82Å; P220-L223 HydrophobicContact CG-CG 4.03Å; P220-L223 PolarHBondContact O-N 3.35Å
221A76Confident70.1Confident70 Ų7081.4 Ų81.458%0.57944%0.439SS*.Hα-helixtrans-58.2-24.7-17200000114.5L223 Y224A221-L223 VanDerWaalsContact C-N 3.29Å; A221-L223 PolarHBondContact O-N 2.74Å; A221-Y224 PolarHBondContact O-N 3.12Å
222F81.2Confident68.7Low112 Ų11281.1 Ų81.149%0.49146%0.455SS..Hα-helixtrans-68.4-27.6178.677.3-94.7000112.8P220 R225 L226P220-F222 HydrophobicContact CB-CD1 3.59Å; P220-F222 HydrophobicContact CB-CE1 3.44Å; P220-F222 VanDerWaalsContact CB-CE1 3.44Å; P220-F222 HydrophobicContact CB-CZ 4.48Å; P220-F222 HydrophobicContact CG-CD1 3.86Å; P220-F222 HydrophobicContact CG-CE1 3.27Å; P220-F222 HydrophobicContact CG-CZ 3.87Å; P220-F222 PolarHBondContact O-N 3.28Å; F222-R225 WeakPolarHBondContact O-CB 3.47Å; F222-R225 PolarHBondContact O-N 3.41Å; F222-R225 VanDerWaalsContact O-N 3.11Å; F222-L226 HydrophobicContact CD2-CD1 4.26Å; F222-L226 PolarHBondContact O-N 3.18Å
223L80Confident68.2Low3 Ų379.2 Ų79.22%0.01644%0.435CS..Hα-helixtrans-69.5-35.7178-70.8-179.9000111.9A98 L101 F102 I105 T219 P220 A221 R225 L226 F227A98-L223 HydrophobicContact CB-CB 4.09Å; L101-L223 HydrophobicContact CD2-CD1 3.79Å; L101-L223 HydrophobicContact CD2-CD2 3.34Å; L101-L223 HydrophobicContact CD2-CG 4.18Å; F102-L223 HydrophobicContact CB-CD1 3.67Å; F102-L223 HydrophobicContact CD2-CD1 3.94Å; F102-L223 HydrophobicContact CG-CD1 4.28Å; I105-L223 HydrophobicContact CD1-CD2 4.48Å; T219-L223 HydrophobicContact CG2-CB 4Å; T219-L223 HydrophobicContact CG2-CD1 4.01Å; P220-L223 HydrophobicContact CG-CD1 3.82Å; P220-L223 HydrophobicContact CG-CG 4.03Å; P220-L223 PolarHBondContact O-N 3.35Å; A221-L223 VanDerWaalsContact C-N 3.29Å; A221-L223 PolarHBondContact O-N 2.74Å; L223-R225 PolarHBondContact O-N 2.79Å; L223-L226 HydrophobicContact CD2-CD1 4.36Å; L223-L226 PolarHBondContact O-N 2.76Å; L223-F227 PolarHBondContact O-N 3.38Å
224Y79.3Confident67.4Low81 Ų8185.1 Ų85.132%0.31846%0.456SS..Hα-helixtrans-66.3-21.5171.7-64-63.7000113.1A98 D99 T219 A221 F227 P228 S229A98-Y224 HydrophobicContact CB-CD1 3.61Å; A98-Y224 HydrophobicContact CB-CE1 3.79Å; A98-Y224 HydrophobicContact CB-CG 4.33Å; D99-Y224 PolarHBondContact OD1-OH 3.19Å; T219-Y224 WeakPolarHBondContact CB-OH 3.44Å; T219-Y224 HydrophobicContact CG2-CD2 4.34Å; T219-Y224 HydrophobicContact CG2-CE1 4.39Å; T219-Y224 HydrophobicContact CG2-CE2 3.73Å; A221-Y224 PolarHBondContact O-N 3.12Å; Y224-F227 CarbonylContact O-C 3.5Å; Y224-P228 WeakPolarHBondContact O-CA 3.43Å; Y224-S229 WeakPolarHBondContact CD1-OG 3.36Å; Y224-S229 WeakPolarHBondContact CE1-OG 3.42Å
225R78.3Confident66.7Low216 Ų21683.2 Ų83.282%0.81545%0.447SS*.Hα-helixtrans-76.7-35.5172.7-60.6-179.9-178.7-179.1-1.2112F222 L223F222-R225 WeakPolarHBondContact O-CB 3.47Å; F222-R225 PolarHBondContact O-N 3.41Å; F222-R225 VanDerWaalsContact O-N 3.11Å; L223-R225 PolarHBondContact O-N 2.79Å
226L78.3Confident66Low116 Ų11684.9 Ų84.961%0.60747%0.466SS*.Hα-helixtrans-76.9-39.5177.1-70.4170.2000111.7F222 L223F222-L226 HydrophobicContact CD2-CD1 4.26Å; F222-L226 PolarHBondContact O-N 3.18Å; L223-L226 HydrophobicContact CD2-CD1 4.36Å; L223-L226 PolarHBondContact O-N 2.76Å
227F78.1Confident65.5Low35 Ų3581 Ų8115%0.15445%0.445CS..SBendtrans-130.791.7179.4-65.2-80.9000110I16 P97 A98 L101 L223 Y224 S229I16-F227 HydrophobicContact CD1-CD1 3.88Å; I16-F227 HydrophobicContact CD1-CD2 4.1Å; I16-F227 HydrophobicContact CD1-CE1 3.38Å; I16-F227 HydrophobicContact CD1-CE2 3.64Å; I16-F227 HydrophobicContact CD1-CG 4.21Å; I16-F227 HydrophobicContact CD1-CZ 3.25Å; P97-F227 HydrophobicContact CB-CB 4.13Å; P97-F227 HydrophobicContact CB-CD1 4.4Å; P97-F227 HydrophobicContact CB-CG 4.43Å; P97-F227 HydrophobicContact CG-CB 3.87Å; A98-F227 HydrophobicContact CB-CB 4.34Å; L101-F227 HydrophobicContact CD1-CD2 3.69Å; L101-F227 HydrophobicContact CD1-CE2 3.32Å; L101-F227 HydrophobicContact CD1-CZ 4.25Å; L223-F227 PolarHBondContact O-N 3.38Å; Y224-F227 CarbonylContact O-C 3.5Å; F227-S229 PolarHBondContact O-N 3.22Å
228P71.7Confident64.8Low98 Ų9882.6 Ų82.664%0.63647%0.467SS*.  trans-63.7129.7179.426-32.9000109.9Y224Y224-P228 WeakPolarHBondContact O-CA 3.43Å
229S68.9Low63.4Low29 Ų2983.3 Ų83.320%0.20347%0.469CS..  trans-74.4131.5175.4-600000109.7Y224 F227 H231Y224-S229 WeakPolarHBondContact CD1-OG 3.36Å; Y224-S229 WeakPolarHBondContact CE1-OG 3.42Å; F227-S229 PolarHBondContact O-N 3.22Å; S229-H231 PolarHBondContact O-N 3.42Å
230T62Low61.6Low118 Ų11890.9 Ų90.972%0.72450%0.504SS*.SBendtrans-67.1-22.3-178.2-450000112.1G95G95-T230 PolarHBondContact O-N 2.91Å
231H54.5Low60.2Low122 Ų12293.4 Ų93.457%0.56552%0.521SS*.SBendtrans-100.497.2173.4-68.686.4000109.7S229 G233S229-H231 PolarHBondContact O-N 3.42Å; H231-G233 VanDerWaalsContact C-N 3.27Å; H231-G233 PolarHBondContact O-N 3.37Å
232G41.9Very low58.4Low88 Ų8895 Ų9591%0.90752%0.52SS*.  trans-7460.4-174.600000115.4
233G49.7Very low56.5Low33 Ų3398.5 Ų98.534%0.3454%0.535SS..SBendtrans-133.6132.317000000110.5H231 H235H231-G233 VanDerWaalsContact C-N 3.27Å; H231-G233 PolarHBondContact O-N 3.37Å; G233-H235 PolarHBondContact O-CD2 3.49Å; G233-H235 PolarHBondContact O-N 2.9Å
234I43.7Very low54.5Low163 Ų163108.8 Ų108.884%0.83657%0.574SS**  trans-66.481.7166.2-59.7165.5000106.3
235H49.2Very low52.5Low112 Ų112115.3 Ų115.352%0.51960%0.598SS.*  trans-93.2105.5175.6-67.7-73.6000107.4G233 F237G233-H235 PolarHBondContact O-CD2 3.49Å; G233-H235 PolarHBondContact O-N 2.9Å; H235-F237 PolarHBondContact O-N 3.26Å
236G45.7Very low50.6Low47 Ų47116.1 Ų116.149%0.48560%0.601SS.*  trans-47.8128.4172.500000110.6G238 R239G236-G238 PolarHBondContact O-N 2.9Å; G236-R239 PolarHBondContact O-N 3.21Å
237F47.9Very low48.5Very low22 Ų22120.4 Ų120.410%0.09661%0.609CS.*THydrogen-bonded Turntrans-58.1130.7172.8-79.3-99.4000109.2F93 D99 T204 S215 T219 H235F93-F237 HydrophobicContact CE1-CE1 4.46Å; D99-F237 HydrophobicContact CB-CE1 3.97Å; D99-F237 HydrophobicContact CB-CZ 3.52Å; D99-F237 WeakPolarHBondContact OD1-CZ 3.25Å; D99-F237 WeakPolarHBondContact OD2-CZ 3.48Å; T204-F237 HydrophobicContact CG2-CD1 4.25Å; S215-F237 WeakPolarHBondContact OG-CB 3.47Å; T219-F237 WeakPolarHBondContact OG1-CE2 3.23Å; T219-F237 WeakPolarHBondContact OG1-CZ 3.4Å; H235-F237 PolarHBondContact O-N 3.26Å
238G51.6Low46.7Very low58 Ų58124.3 Ų124.360%0.59864%0.638SS**THydrogen-bonded Turntrans112.9-14.4-174.400000114.3G236 Q240G236-G238 PolarHBondContact O-N 2.9Å; G238-Q240 PolarHBondContact O-N 3.26Å
239R39.9Very low45.2Very low182 Ų182127.2 Ų127.269%0.68764%0.643SS**  trans-82.7111167.6-160.2171.3175.9159.3-2.7108.9G236 D242G236-R239 PolarHBondContact O-N 3.21Å; R239-D242 IonicContact CZ-OD2 2.9Å; R239-D242 IonicContact NE-OD2 3.87Å; R239-D242 IonicContact NH2-OD2 3.6Å; R239-D242 PolarHBondContact NH2-OD2 2.9Å
240Q38.5Very low43.8Very low164 Ų164132.8 Ų132.877%0.76667%0.671SS**  trans-49.6142.7166.1-66.2178.623.700108.4G238 D242G238-Q240 PolarHBondContact O-N 3.26Å; Q240-D242 PolarHBondContact O-N 3.17Å
241P47.1Very low42.8Very low93 Ų93133.7 Ų133.760%0.60467%0.671SS**  trans-52.7118.6173-17.527.5000107.5F243P241-F243 HydrophobicContact CB-CD2 4.17Å; P241-F243 HydrophobicContact CB-CE2 3.98Å; P241-F243 HydrophobicContact CB-CZ 4.32Å; P241-F243 HydrophobicContact CG-CE2 4.15Å; P241-F243 HydrophobicContact CG-CZ 4.41Å; P241-F243 WeakPolarHBondContact O-CD2 3.18Å; P241-F243 PolarHBondContact O-N 3.5Å
242D38.3Very low42Very low103 Ų103139.2 Ų139.255%0.55169%0.687SS**  trans-61.494.4159.1-94.8-47.2000104.1R239 Q240 R244R239-D242 IonicContact CZ-OD2 2.9Å; R239-D242 IonicContact NE-OD2 3.87Å; R239-D242 IonicContact NH2-OD2 3.6Å; R239-D242 PolarHBondContact NH2-OD2 2.9Å; Q240-D242 PolarHBondContact O-N 3.17Å; D242-R244 PolarHBondContact O-N 3.06Å
243F42.8Very low41.9Very low185 Ų185138.3 Ų138.381%0.81168%0.677SS**  trans-67.256.1159.9-66.7-86.1000107.5P241 R245P241-F243 HydrophobicContact CB-CD2 4.17Å; P241-F243 HydrophobicContact CB-CE2 3.98Å; P241-F243 HydrophobicContact CB-CZ 4.32Å; P241-F243 HydrophobicContact CG-CE2 4.15Å; P241-F243 HydrophobicContact CG-CZ 4.41Å; P241-F243 WeakPolarHBondContact O-CD2 3.18Å; P241-F243 PolarHBondContact O-N 3.5Å; F243-R245 PolarHBondContact O-N 2.92Å
244R37.2Very low41.6Very low220 Ų220142.7 Ų142.783%0.8370%0.698SS**  trans-65.590.8155.1-93.1-174.6178.11670.5104.7D242 R246D242-R244 PolarHBondContact O-N 3.06Å; R244-R246 PolarHBondContact O-N 2.78Å
245R37.4Very low41.7Very low217 Ų217142.2 Ų142.282%0.81969%0.691SS**  trans-9.9105.9156-81.8171.5166.6166.4-4.5109.3F243 R247F243-R245 PolarHBondContact O-N 2.92Å; R245-R247 PolarHBondContact O-N 3.03Å
246R37.7Very low42.3Very low233 Ų233144.5 Ų144.588%0.87971%0.708SS**  trans-58.287.4144.9-80.4-177.7177.5175.90.4105.1R244R244-R246 PolarHBondContact O-N 2.78Å
247R34Very low42.8Very low207 Ų207152.7 Ų152.778%0.78172%0.724SS**  trans-56.7132156-95.5-178.8169.1179.6-3.4104.9R245 Q249R245-R247 PolarHBondContact O-N 3.03Å; R247-Q249 PolarHBondContact O-N 2.91Å
248P40.6Very low42.9Very low116 Ų116155.1 Ų155.175%0.75376%0.755SS**  trans-55111.3169.8-16.928.6000106.5D250P248-D250 PolarHBondContact O-N 2.96Å
249Q41.7Very low43.2Very low159 Ų159160.9 Ų160.974%0.74377%0.766SS**  trans-76.684169.2-174.4164.9-13.500105.1R247 D251R247-Q249 PolarHBondContact O-N 2.91Å; Q249-D251 HydrophobicContact CG-CB 4.41Å; Q249-D251 PolarHBondContact NE2-OD1 3.02Å; Q249-D251 PolarHBondContact O-N 2.94Å
250D39.5Very low44Very low147 Ų147155.7 Ų155.779%0.78677%0.769SS**  trans-59.294.7154.3-88-34.1000106P248 R252P248-D250 PolarHBondContact O-N 2.96Å; D250-R252 PolarHBondContact O-N 3.49Å
251D40.1Very low45Very low136 Ų136156.2 Ų156.273%0.72777%0.771SS**  trans-77.757.5-180-138.928.5000109.6Q249Q249-D251 HydrophobicContact CG-CB 4.41Å; Q249-D251 PolarHBondContact NE2-OD1 3.02Å; Q249-D251 PolarHBondContact O-N 2.94Å
252R37.7Very low45.7Very low239 Ų239158.6 Ų158.690%0.90278%0.783SS**  trans-129.682170.8-77.7-171.8179.8174.82109.5D250D250-R252 PolarHBondContact O-N 3.49Å
253G40.4Very low46.7Very low68 Ų68161.3 Ų161.370%0.70180%0.797SS**  trans73.6121.2154.200000116
254T42.8Very low47.5Very low126 Ų126156 Ų15677%0.77379%0.794SS**  147.999.3124.6-57.70000110.2
255H46.8Very low47.8Very low152 Ų152149 Ų14970%0.70479%0.791SS**  trans22.9100.7147.7-51.987.2000118.5W257H255-W257 PolarHBondContact O-N 2.84Å
256N60.1Low48.4Very low161 Ų161150.3 Ų150.386%0.86181%0.814SS**  trans-8690.2165.9-170.327.1000110G258N256-G258 PolarHBondContact O-N 3.31Å
257W56.5Low48.9Very low219 Ų219146.2 Ų146.283%0.8381%0.811SS**  trans-73.1120.9173.8-68.786.3000110.8H255H255-W257 PolarHBondContact O-N 2.84Å
258G50.9Low49.7Very low72 Ų72142.9 Ų142.974%0.74281%0.812SS**  trans50100.1144.300000119.1N256N256-G258 PolarHBondContact O-N 3.31Å
259H57.6Low50.2Low180 Ų180144.4 Ų144.483%0.83382%0.815SS**  trans-87.1104.9152.9-98-57.3000109.8
260G56.3Low50.7Low72 Ų72143.6 Ų143.674%0.74282%0.82SS**  trans-66.7138.9173.100000112.3
261H60Low51.4Low176 Ų176143.4 Ų143.482%0.81582%0.822SS**  trans-88.3123171.5-78.362000109.3
262V61.4Low52.2Low143 Ų143143.9 Ų143.987%0.86783%0.828SS**  trans-86.6105.9165.9-179.50000106.9
263L59Low53.2Low159 Ų159137.1 Ų137.183%0.83282%0.823SS**PPolyproline II helixtrans-81.3119.8169.2-69.6173.7000108.1
264G61Low54.2Low74 Ų74142.4 Ų142.476%0.76383%0.832SS**PPolyproline II helixtrans-56.8140.6-176.900000112.9
265G42.7Very low55.2Low73 Ų73143.8 Ų143.875%0.75384%0.837SS**PPolyproline II helixtrans-77.9132.4165.500000111.1
266N49.8Very low55.9Low244 Ų244143 Ų143100%1.30585%0.849SS**  -150.70127.6-91.8-15.9000106.9

Retrieved 266 of 266 residues in 123.1 ms (Link to these results)

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