A0A077Z223_TRITR Loading...

Regulator of nuclear mRNA

AlphaFold DB , UniProt , Accession A0A077Z223, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 328 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
1M46.6Very low77.1Confident206 Ų20673.9 Ų73.9100%1.01540%0.4SS*.  0131.50-62.8-142.3-102.200109.3V3 H32M1-V3 PolarHBondContact O-N 2.94Å; M1-H32 PolarHBondContact SD-CE1 2.96Å
2S58.1Low78.3Confident48 Ų4875.2 Ų75.234%0.33640%0.395SS..PPolyproline II helixtrans-74.7121.6-174.1176.50000111K8 H33S2-K8 PolarHBondContact OG-NZ 2.94Å; S2-H33 PolarHBondContact O-CE1 3.16Å; S2-H33 PolarHBondContact O-NE2 3.05Å
3V73.8Confident79.5Confident61 Ų6169.7 Ų69.737%0.3737%0.366SS..PPolyproline II helixtrans-58.1136.7174.3178.70000111.1M1 T5 K8M1-V3 PolarHBondContact O-N 2.94Å; V3-T5 HydrophobicContact CG1-CG2 4.45Å; V3-K8 WeakPolarHBondContact O-CD 3.27Å; V3-K8 PolarHBondContact O-NZ 3.43Å
4F81.6Confident80.3Confident23 Ų2370.5 Ų70.510%0.10138%0.38CS..PPolyproline II helixtrans-70.6129.7170.9-179.5-92.2000110.9L9 W29 H33 H36 I40F4-L9 HydrophobicContact CE2-CB 4.3Å; F4-L9 HydrophobicContact CE2-CD1 4.3Å; F4-L9 HydrophobicContact CE2-CD2 4.2Å; F4-L9 HydrophobicContact CZ-CB 4.5Å; F4-L9 HydrophobicContact CZ-CD2 4.01Å; F4-W29 AromaticContact CD2-CH2 3.4Å; F4-W29 HydrophobicContact CD2-CH2 3.4Å; F4-W29 HydrophobicContact CD2-CZ2 4.27Å; F4-W29 AromaticContact CD2-CZ3 3.86Å; F4-W29 HydrophobicContact CD2-CZ3 3.86Å; F4-W29 AromaticContact CE2-CH2 3.89Å; F4-W29 HydrophobicContact CE2-CH2 3.89Å; F4-W29 HydrophobicContact CE2-CZ3 4.04Å; F4-W29 HydrophobicContact CG-CH2 4.34Å; F4-H33 HydrophobicContact CB-CB 4.39Å; F4-H33 HydrophobicContact CD2-CB 3.91Å; F4-H33 HydrophobicContact CG-CB 4.48Å; F4-H36 VanDerWaalsContact CB-CD2 3.44Å; F4-H36 WeakPolarHBondContact CB-CD2 3.35Å; F4-H36 HydrophobicContact CD1-CB 3.97Å; F4-H36 AromaticContact CD1-CD2 3.36Å; F4-H36 WeakPolarHBondContact CD1-CD2 3.36Å; F4-H36 AromaticContact CD1-CG 3.52Å; F4-H36 AromaticContact CD1-NE2 3.81Å; F4-H36 HydrophobicContact CD2-CB 4.3Å; F4-H36 AromaticContact CD2-CD2 3.96Å; F4-H36 HydrophobicContact CE1-CB 3.76Å; F4-H36 AromaticContact CE1-CG 3.77Å; F4-H36 HydrophobicContact CE2-CB 4.12Å; F4-H36 HydrophobicContact CG-CB 4.24Å; F4-H36 AromaticContact CG-CD2 3.29Å; F4-H36 WeakPolarHBondContact CG-CD2 3.46Å; F4-H36 AromaticContact CG-CG 3.85Å; F4-H36 AromaticContact CG-NE2 3.94Å; F4-H36 HydrophobicContact CZ-CB 3.84Å; F4-I40 HydrophobicContact CD2-CD1 4.31Å; F4-I40 HydrophobicContact CE2-CD1 3.7Å; F4-I40 HydrophobicContact CE2-CG1 3.49Å; F4-I40 VanDerWaalsContact CE2-CG1 3.49Å; F4-I40 HydrophobicContact CZ-CD1 4.4Å; F4-I40 HydrophobicContact CZ-CG1 3.83Å
5T79.5Confident81.1Confident56 Ų5674.2 Ų74.234%0.34439%0.394SS..  trans-143.5150.9165.863.40000108.2V3 N7 K8 L9V3-T5 HydrophobicContact CG1-CG2 4.45Å; T5-N7 PolarHBondContact O-N 3.43Å; T5-K8 PolarHBondContact O-N 3.37Å; T5-K8 VanDerWaalsContact O-N 3.11Å; T5-K8 WeakPolarHBondContact OG1-CB 3.47Å; T5-K8 VanDerWaalsContact OG1-CG 3.3Å; T5-K8 WeakPolarHBondContact OG1-CG 3.49Å; T5-K8 PolarHBondContact OG1-N 3.37Å; T5-K8 VanDerWaalsContact OG1-N 3.14Å; T5-L9 PolarHBondContact O-N 3.15Å
6E80Confident81.9Confident117 Ų11770.1 Ų70.155%0.54737%0.372SS..Hα-helixtrans-58.7-35.1176.1-73.7178.8-163.500111.7K8 L9 G10E6-K8 PolarHBondContact O-N 3.21Å; E6-L9 WeakPolarHBondContact O-CB 3.29Å; E6-L9 PolarHBondContact O-N 3.4Å; E6-G10 PolarHBondContact O-N 3.28Å
7N78.5Confident82.5Confident134 Ų13468.8 Ų68.872%0.71737%0.37SS*.Hα-helixtrans-65.3-41.8176.5-150.617.4000111.9T5 L9 G10 V11T5-N7 PolarHBondContact O-N 3.43Å; N7-L9 VanDerWaalsContact C-N 3.34Å; N7-G10 PolarHBondContact O-N 3Å; N7-V11 WeakPolarHBondContact O-CG2 3.24Å; N7-V11 PolarHBondContact O-N 3.49Å
8K82.2Confident83Confident78 Ų7867.9 Ų67.934%0.33937%0.37SS..Hα-helixtrans-66.8-37.3173.6-77.4174.8179.2-175.90111.9S2 V3 T5 E6 V11 R12S2-K8 PolarHBondContact OG-NZ 2.94Å; V3-K8 WeakPolarHBondContact O-CD 3.27Å; V3-K8 PolarHBondContact O-NZ 3.43Å; T5-K8 PolarHBondContact O-N 3.37Å; T5-K8 VanDerWaalsContact O-N 3.11Å; T5-K8 WeakPolarHBondContact OG1-CB 3.47Å; T5-K8 VanDerWaalsContact OG1-CG 3.3Å; T5-K8 WeakPolarHBondContact OG1-CG 3.49Å; T5-K8 PolarHBondContact OG1-N 3.37Å; T5-K8 VanDerWaalsContact OG1-N 3.14Å; E6-K8 PolarHBondContact O-N 3.21Å; K8-V11 PolarHBondContact O-N 3.2Å; K8-R12 VanDerWaalsContact O-CB 3.29Å; K8-R12 WeakPolarHBondContact O-CB 3.34Å; K8-R12 WeakPolarHBondContact O-CG 3.49Å; K8-R12 PolarHBondContact O-N 2.66Å
9L88.3Confident83.6Confident1 Ų167.2 Ų67.21%0.00537%0.371CS..Hα-helixtrans-60.1-48.5173.8-177.667.5000110F4 T5 E6 N7 V11 R12 F13 W29 I40 F43F4-L9 HydrophobicContact CE2-CB 4.3Å; F4-L9 HydrophobicContact CE2-CD1 4.3Å; F4-L9 HydrophobicContact CE2-CD2 4.2Å; F4-L9 HydrophobicContact CZ-CB 4.5Å; F4-L9 HydrophobicContact CZ-CD2 4.01Å; T5-L9 PolarHBondContact O-N 3.15Å; E6-L9 WeakPolarHBondContact O-CB 3.29Å; E6-L9 PolarHBondContact O-N 3.4Å; N7-L9 VanDerWaalsContact C-N 3.34Å; L9-V11 PolarHBondContact O-N 2.98Å; L9-R12 PolarHBondContact O-N 3.18Å; L9-F13 HydrophobicContact CD1-CD2 3.78Å; L9-F13 HydrophobicContact CD1-CE2 3.49Å; L9-F13 VanDerWaalsContact CD1-CE2 3.49Å; L9-F13 HydrophobicContact CG-CD2 4.13Å; L9-F13 HydrophobicContact CG-CE2 4.16Å; L9-F13 WeakPolarHBondContact O-CB 3.43Å; L9-F13 WeakPolarHBondContact O-CD2 3.36Å; L9-F13 PolarHBondContact O-N 3.46Å; L9-W29 HydrophobicContact CD1-CZ3 3.87Å; L9-I40 HydrophobicContact CD1-CG1 4.24Å; L9-I40 HydrophobicContact CD1-CG2 4.41Å; L9-I40 HydrophobicContact CD2-CG1 4.27Å; L9-F43 HydrophobicContact CD2-CB 3.56Å; L9-F43 HydrophobicContact CD2-CD1 3.81Å; L9-F43 HydrophobicContact CD2-CD2 3.98Å; L9-F43 HydrophobicContact CD2-CG 3.49Å; L9-F43 VanDerWaalsContact CD2-CG 3.49Å; L9-F43 HydrophobicContact CG-CD1 3.91Å; L9-F43 HydrophobicContact CG-CE1 4.29Å; L9-F43 HydrophobicContact CG-CG 4.09Å
10G90.1Very high84.1Confident22 Ų2268.9 Ų68.923%0.22738%0.383CS..Hα-helixtrans-59.3-45.2176.300000113.2E6 N7 R12 F13 S14E6-G10 PolarHBondContact O-N 3.28Å; N7-G10 PolarHBondContact O-N 3Å; G10-R12 PolarHBondContact O-N 3.45Å; G10-F13 PolarHBondContact O-N 3.32Å; G10-S14 PolarHBondContact O-N 2.92Å
11V89.5Confident84.6Confident67 Ų6771.6 Ų71.641%0.40639%0.393SS..Hα-helixtrans-62.5-42.7174.8171.70000111.6N7 K8 L9 S14 Q15N7-V11 WeakPolarHBondContact O-CG2 3.24Å; N7-V11 PolarHBondContact O-N 3.49Å; K8-V11 PolarHBondContact O-N 3.2Å; L9-V11 PolarHBondContact O-N 2.98Å; V11-S14 PolarHBondContact O-N 3.02Å; V11-S14 PolarHBondContact O-OG 3.33Å; V11-Q15 WeakPolarHBondContact O-CB 3.49Å; V11-Q15 VanDerWaalsContact O-CG 3.28Å; V11-Q15 WeakPolarHBondContact O-CG 3.35Å; V11-Q15 PolarHBondContact O-N 3.4Å; V11-Q15 VanDerWaalsContact O-N 3.09Å
12R91.8Very high87Confident89 Ų8963 Ų6334%0.33635%0.353SS..Hα-helixtrans-65.7-40.5178.4-74.4-76.5-179.9167.6-2.5111.7K8 L9 G10 Q15 L16 L26K8-R12 VanDerWaalsContact O-CB 3.29Å; K8-R12 WeakPolarHBondContact O-CB 3.34Å; K8-R12 WeakPolarHBondContact O-CG 3.49Å; K8-R12 PolarHBondContact O-N 2.66Å; L9-R12 PolarHBondContact O-N 3.18Å; G10-R12 PolarHBondContact O-N 3.45Å; R12-Q15 PolarHBondContact O-N 2.98Å; R12-L16 PolarHBondContact O-N 2.91Å; R12-L26 HydrophobicContact CB-CD1 3.66Å; R12-L26 HydrophobicContact CG-CD1 4.32Å
13F93.8Very high88.9Confident4 Ų461.4 Ų61.42%0.01834%0.34CS..Hα-helixtrans-63.7-49.6173.5-91.2-118.8000109.9L9 G10 Q15 L16 L26 I30 F43 W44 T47 R56 L60 L63L9-F13 HydrophobicContact CD1-CD2 3.78Å; L9-F13 HydrophobicContact CD1-CE2 3.49Å; L9-F13 VanDerWaalsContact CD1-CE2 3.49Å; L9-F13 HydrophobicContact CG-CD2 4.13Å; L9-F13 HydrophobicContact CG-CE2 4.16Å; L9-F13 WeakPolarHBondContact O-CB 3.43Å; L9-F13 WeakPolarHBondContact O-CD2 3.36Å; L9-F13 PolarHBondContact O-N 3.46Å; G10-F13 PolarHBondContact O-N 3.32Å; F13-Q15 PolarHBondContact O-N 2.92Å; F13-Q15 VanDerWaalsContact O-N 3.15Å; F13-L16 WeakPolarHBondContact O-CB 3.39Å; F13-L16 PolarHBondContact O-N 3.23Å; F13-L26 HydrophobicContact CD2-CD2 4.13Å; F13-L26 HydrophobicContact CE2-CD2 4.32Å; F13-I30 HydrophobicContact CE2-CD1 4.16Å; F13-I30 HydrophobicContact CZ-CD1 4.49Å; F13-F43 HydrophobicContact CB-CE1 4.01Å; F13-F43 HydrophobicContact CD1-CD1 4.07Å; F13-F43 AromaticContact CD1-CE1 3.97Å; F13-F43 HydrophobicContact CD1-CE1 3.97Å; F13-F43 HydrophobicContact CD2-CD1 4.34Å; F13-F43 HydrophobicContact CD2-CE1 4.28Å; F13-F43 HydrophobicContact CE1-CD1 4.2Å; F13-F43 HydrophobicContact CE2-CD1 4.47Å; F13-F43 HydrophobicContact CG-CD1 4.15Å; F13-F43 AromaticContact CG-CE1 3.81Å; F13-F43 HydrophobicContact CG-CE1 3.81Å; F13-F43 HydrophobicContact CZ-CD1 4.39Å; F13-W44 HydrophobicContact CE1-CB 3.98Å; F13-W44 AromaticContact CE1-CD1 3.86Å; F13-W44 HydrophobicContact CE1-CG 4.3Å; F13-W44 HydrophobicContact CZ-CB 4.01Å; F13-T47 HydrophobicContact CD1-CG2 4.14Å; F13-R56 VanDerWaalsContact C-NH2 3.34Å; F13-R56 VanDerWaalsContact O-CZ 3.26Å; F13-R56 PolarHBondContact O-NH1 3.26Å; F13-R56 VanDerWaalsContact O-NH1 3.14Å; F13-R56 PolarHBondContact O-NH2 2.97Å; F13-L60 HydrophobicContact CD1-CD2 3.85Å; F13-L60 HydrophobicContact CE1-CD2 3.91Å; F13-L63 HydrophobicContact CE1-CD2 4.22Å; F13-L63 HydrophobicContact CE2-CD2 4.13Å; F13-L63 HydrophobicContact CZ-CD2 3.8Å
14S91.2Very high90Very high81 Ų8162.5 Ų62.557%0.56634%0.341SS*.Hα-helixtrans-57.3-34-179.572.80000112.8G10 V11 R56G10-S14 PolarHBondContact O-N 2.92Å; V11-S14 PolarHBondContact O-N 3.02Å; V11-S14 PolarHBondContact O-OG 3.33Å; S14-R56 PolarHBondContact O-NH1 3.33Å
15Q91.5Very high90.6Very high126 Ų12664.2 Ų64.259%0.58935%0.354SS*.THydrogen-bonded Turntrans-80.3-8.3176.3-68.3174.2-8.300115.1V11 R12 F13 S17V11-Q15 WeakPolarHBondContact O-CB 3.49Å; V11-Q15 VanDerWaalsContact O-CG 3.28Å; V11-Q15 WeakPolarHBondContact O-CG 3.35Å; V11-Q15 PolarHBondContact O-N 3.4Å; V11-Q15 VanDerWaalsContact O-N 3.09Å; R12-Q15 PolarHBondContact O-N 2.98Å; F13-Q15 PolarHBondContact O-N 2.92Å; F13-Q15 VanDerWaalsContact O-N 3.15Å; Q15-S17 PolarHBondContact O-N 2.67Å
16L94.1Very high91.4Very high8 Ų861.8 Ų61.84%0.04234%0.339CS..  trans-56.7131.1177.4177.866.1000110R12 F13 I23 L26 R56 D59 L60 L63R12-L16 PolarHBondContact O-N 2.91Å; F13-L16 WeakPolarHBondContact O-CB 3.39Å; F13-L16 PolarHBondContact O-N 3.23Å; L16-I23 HydrophobicContact CD1-CG1 3.9Å; L16-L26 HydrophobicContact CB-CD2 4.24Å; L16-L26 HydrophobicContact CD1-CD2 4.15Å; L16-R56 PolarHBondContact O-NH1 3.48Å; L16-D59 HydrophobicContact CD2-CB 4.29Å; L16-D59 HydrophobicContact CG-CB 4.43Å; L16-L60 HydrophobicContact CD2-CD2 3.95Å; L16-L60 HydrophobicContact CD2-CG 4.45Å; L16-L63 HydrophobicContact CD2-CB 4.22Å; L16-L63 HydrophobicContact CD2-CD2 4.13Å
17S92Very high92.2Very high48 Ų4856.3 Ų56.334%0.33631%0.313SS..  trans-130.4169.1176.774.40000109.7Q15 S19 S22Q15-S17 PolarHBondContact O-N 2.67Å; S17-S19 PolarHBondContact O-N 3.03Å; S17-S19 VanDerWaalsContact O-N 3.09Å; S17-S19 PolarHBondContact OG-OG 3.49Å; S17-S22 PolarHBondContact N-OG 3.41Å; S17-S22 VanDerWaalsContact OG-CB 3.23Å; S17-S22 WeakPolarHBondContact OG-CB 3.15Å; S17-S22 PolarHBondContact OG-OG 3.48Å
18S90.9Very high92.9Very high54 Ų5454.2 Ų54.238%0.37831%0.308SS..SBendtrans-72.73.4-179.760.90000115.3R55 D59S18-R55 VanDerWaalsContact CB-NE 3.26Å; S18-R55 PolarHBondContact OG-NH2 3.27Å; S18-D59 VanDerWaalsContact CA-OD1 3.25Å; S18-D59 WeakPolarHBondContact CA-OD1 3.2Å; S18-D59 WeakPolarHBondContact CB-OD1 3.33Å; S18-D59 PolarHBondContact N-OD2 3.34Å
19S95Very high93.5Very high53 Ų5351.6 Ų51.637%0.37130%0.296SS..SBendtrans-77.3141176.6760000110.4S17 Q21 S22 I23S17-S19 PolarHBondContact O-N 3.03Å; S17-S19 VanDerWaalsContact O-N 3.09Å; S17-S19 PolarHBondContact OG-OG 3.49Å; S19-Q21 PolarHBondContact O-N 3.48Å; S19-S22 PolarHBondContact O-N 2.91Å; S19-S22 VanDerWaalsContact OG-CB 3.24Å; S19-S22 WeakPolarHBondContact OG-CB 3.42Å; S19-S22 PolarHBondContact OG-N 2.88Å; S19-I23 PolarHBondContact O-N 3.06Å; S19-I23 VanDerWaalsContact O-N 3.15Å
20V94.5Very high93.8Very high101 Ų10151.7 Ų51.761%0.61230%0.297SS*.Hα-helixtrans-54.7-42.4177.1175.10000110.7S22 I23 Q24V20-S22 PolarHBondContact O-N 3.19Å; V20-I23 PolarHBondContact O-N 3.33Å; V20-Q24 HydrophobicContact CG1-CG 4.18Å; V20-Q24 WeakPolarHBondContact O-CB 3.49Å; V20-Q24 WeakPolarHBondContact O-CG 3.46Å; V20-Q24 PolarHBondContact O-N 2.66Å
21Q94.4Very high94Very high127 Ų12751.8 Ų51.859%0.59329%0.291SS*.Hα-helixtrans-61-41.3178.1-173.361.543.200112.7S19 T25S19-Q21 PolarHBondContact O-N 3.48Å; Q21-T25 PolarHBondContact NE2-OG1 3.31Å; Q21-T25 VanDerWaalsContact O-CB 3.24Å; Q21-T25 WeakPolarHBondContact O-CB 3.33Å; Q21-T25 PolarHBondContact O-N 2.91Å; Q21-T25 PolarHBondContact O-OG1 3.46Å
22S96.5Very high94Very high26 Ų2652.3 Ų52.318%0.18229%0.289CS..Hα-helixtrans-63.8-48.2179-174.50000110.8S17 S19 V20 T25 L26S17-S22 PolarHBondContact N-OG 3.41Å; S17-S22 VanDerWaalsContact OG-CB 3.23Å; S17-S22 WeakPolarHBondContact OG-CB 3.15Å; S17-S22 PolarHBondContact OG-OG 3.48Å; S19-S22 PolarHBondContact O-N 2.91Å; S19-S22 VanDerWaalsContact OG-CB 3.24Å; S19-S22 WeakPolarHBondContact OG-CB 3.42Å; S19-S22 PolarHBondContact OG-N 2.88Å; V20-S22 PolarHBondContact O-N 3.19Å; S22-T25 PolarHBondContact O-N 2.86Å; S22-L26 PolarHBondContact O-N 2.88Å
23I97.5Very high93.9Very high13 Ų1349 Ų497%0.06728%0.278CS..Hα-helixtrans-60.7-48.2178.4-67.5161.4000111.1L16 S19 V20 L26 S27 Y62 E66L16-I23 HydrophobicContact CD1-CG1 3.9Å; S19-I23 PolarHBondContact O-N 3.06Å; S19-I23 VanDerWaalsContact O-N 3.15Å; V20-I23 PolarHBondContact O-N 3.33Å; I23-L26 PolarHBondContact O-N 3.26Å; I23-S27 VanDerWaalsContact O-CB 3.29Å; I23-S27 WeakPolarHBondContact O-CB 3.42Å; I23-S27 PolarHBondContact O-N 2.94Å; I23-Y62 HydrophobicContact CD1-CD2 4.16Å; I23-E66 HydrophobicContact CG2-CB 3.77Å; I23-E66 HydrophobicContact CG2-CG 4.05Å
24Q96.3Very high93.8Very high84 Ų8453.5 Ų53.539%0.39330%0.295SS..Hα-helixtrans-65.6-42-179.5-75.2178.5-22.900112.6V20 L26 S27 C28 E66V20-Q24 HydrophobicContact CG1-CG 4.18Å; V20-Q24 WeakPolarHBondContact O-CB 3.49Å; V20-Q24 WeakPolarHBondContact O-CG 3.46Å; V20-Q24 PolarHBondContact O-N 2.66Å; Q24-L26 VanDerWaalsContact C-N 3.33Å; Q24-L26 PolarHBondContact O-N 3.41Å; Q24-S27 PolarHBondContact O-N 3.01Å; Q24-C28 VanDerWaalsContact O-CB 3.29Å; Q24-C28 WeakPolarHBondContact O-CB 3.47Å; Q24-C28 PolarHBondContact O-N 3.41Å; Q24-E66 HydrophobicContact CG-CG 4.46Å
25T94.5Very high93.7Very high59 Ų5956.9 Ų56.936%0.36231%0.305SS..Hα-helixtrans-62.2-44.1178.6-57.40000110.6Q21 S22 W29Q21-T25 PolarHBondContact NE2-OG1 3.31Å; Q21-T25 VanDerWaalsContact O-CB 3.24Å; Q21-T25 WeakPolarHBondContact O-CB 3.33Å; Q21-T25 PolarHBondContact O-N 2.91Å; Q21-T25 PolarHBondContact O-OG1 3.46Å; S22-T25 PolarHBondContact O-N 2.86Å; T25-W29 PolarHBondContact O-N 3.47Å; T25-W29 VanDerWaalsContact O-N 3.12Å
26L96.4Very high93.7Very high6 Ų653.9 Ų53.93%0.03129%0.292CS..Hα-helixtrans-69.8-42.6177.6-176.649.3000112R12 F13 L16 S22 I23 Q24 C28 W29 I30 L63R12-L26 HydrophobicContact CB-CD1 3.66Å; R12-L26 HydrophobicContact CG-CD1 4.32Å; F13-L26 HydrophobicContact CD2-CD2 4.13Å; F13-L26 HydrophobicContact CE2-CD2 4.32Å; L16-L26 HydrophobicContact CB-CD2 4.24Å; L16-L26 HydrophobicContact CD1-CD2 4.15Å; S22-L26 PolarHBondContact O-N 2.88Å; I23-L26 PolarHBondContact O-N 3.26Å; Q24-L26 VanDerWaalsContact C-N 3.33Å; Q24-L26 PolarHBondContact O-N 3.41Å; L26-C28 VanDerWaalsContact C-N 3.34Å; L26-C28 PolarHBondContact O-N 2.96Å; L26-W29 HydrophobicContact CD1-CE3 4.29Å; L26-W29 WeakPolarHBondContact O-CB 3.34Å; L26-W29 PolarHBondContact O-N 3.42Å; L26-I30 HydrophobicContact CD1-CD1 4.2Å; L26-I30 HydrophobicContact CD1-CG1 4.18Å; L26-I30 HydrophobicContact CG-CD1 4.03Å; L26-I30 HydrophobicContact CG-CG1 4.48Å; L26-I30 WeakPolarHBondContact O-CG1 3.46Å; L26-I30 PolarHBondContact O-N 3.26Å; L26-L63 HydrophobicContact CB-CD1 3.93Å; L26-L63 HydrophobicContact CD2-CD1 4.11Å; L26-L63 HydrophobicContact CD2-CD2 3.6Å; L26-L63 HydrophobicContact CG-CD1 3.79Å; L26-L63 HydrophobicContact CG-CD2 4.03Å
27S96.7Very high93.7Very high2 Ų255 Ų551%0.01430%0.298CS..Hα-helixtrans-57.9-46175.2177.40000111.9I23 Q24 W29 I30 I31 E66 V67I23-S27 VanDerWaalsContact O-CB 3.29Å; I23-S27 WeakPolarHBondContact O-CB 3.42Å; I23-S27 PolarHBondContact O-N 2.94Å; Q24-S27 PolarHBondContact O-N 3.01Å; S27-W29 VanDerWaalsContact C-N 3.31Å; S27-W29 PolarHBondContact O-N 3.39Å; S27-I30 PolarHBondContact O-N 3.26Å; S27-I31 WeakPolarHBondContact O-CG1 3.42Å; S27-I31 PolarHBondContact O-N 3.46Å; S27-E66 VanDerWaalsContact CB-CG 3.47Å; S27-E66 WeakPolarHBondContact OG-CG 3.28Å; S27-E66 PolarHBondContact OG-O 3.22Å; S27-V67 PolarHBondContact OG-N 3.22Å
28C93.9Very high93.9Very high89 Ų8960.9 Ų60.960%0.60131%0.312SS*.Hα-helixtrans-59.2-43.6176.1-175.30000111.6Q24 L26 I31 H32Q24-C28 VanDerWaalsContact O-CB 3.29Å; Q24-C28 WeakPolarHBondContact O-CB 3.47Å; Q24-C28 PolarHBondContact O-N 3.41Å; L26-C28 VanDerWaalsContact C-N 3.34Å; L26-C28 PolarHBondContact O-N 2.96Å; C28-I31 PolarHBondContact O-N 3.43Å; C28-H32 VanDerWaalsContact O-CB 3.31Å; C28-H32 WeakPolarHBondContact O-CB 3.36Å; C28-H32 PolarHBondContact O-N 3.38Å
29W94.1Very high94Very high23 Ų2363 Ų639%0.08732%0.315CS..Hα-helixtrans-64-41.3176.1-171.889.3000112.3F4 L9 T25 L26 S27 H32 H33F4-W29 AromaticContact CD2-CH2 3.4Å; F4-W29 HydrophobicContact CD2-CH2 3.4Å; F4-W29 HydrophobicContact CD2-CZ2 4.27Å; F4-W29 AromaticContact CD2-CZ3 3.86Å; F4-W29 HydrophobicContact CD2-CZ3 3.86Å; F4-W29 AromaticContact CE2-CH2 3.89Å; F4-W29 HydrophobicContact CE2-CH2 3.89Å; F4-W29 HydrophobicContact CE2-CZ3 4.04Å; F4-W29 HydrophobicContact CG-CH2 4.34Å; L9-W29 HydrophobicContact CD1-CZ3 3.87Å; T25-W29 PolarHBondContact O-N 3.47Å; T25-W29 VanDerWaalsContact O-N 3.12Å; L26-W29 HydrophobicContact CD1-CE3 4.29Å; L26-W29 WeakPolarHBondContact O-CB 3.34Å; L26-W29 PolarHBondContact O-N 3.42Å; S27-W29 VanDerWaalsContact C-N 3.31Å; S27-W29 PolarHBondContact O-N 3.39Å; W29-H32 WeakPolarHBondContact O-CB 3.44Å; W29-H32 PolarHBondContact O-N 3.21Å; W29-H33 AromaticContact CD2-CD2 3.5Å; W29-H33 VanDerWaalsContact CD2-CD2 3.5Å; W29-H33 AromaticContact CE2-CD2 3.22Å; W29-H33 AromaticContact CE2-NE2 3.36Å; W29-H33 AromaticContact CE3-CD2 3.85Å; W29-H33 AromaticContact CH2-CD2 3.78Å; W29-H33 AromaticContact CZ2-CD2 3.39Å; W29-H33 WeakPolarHBondContact CZ2-CD2 3.4Å; W29-H33 AromaticContact CZ2-NE2 3.53Å; W29-H33 AromaticContact CZ3-CD2 3.98Å; W29-H33 AromaticContact NE1-CD2 3.61Å; W29-H33 AromaticContact NE1-NE2 3.34Å; W29-H33 PolarHBondContact NE1-NE2 3.48Å; W29-H33 PolarHBondContact O-CD2 3.47Å; W29-H33 PolarHBondContact O-N 3.09Å; W29-H33 VanDerWaalsContact O-N 3.13Å
30I95.4Very high94Very high4 Ų460.5 Ų60.52%0.02130%0.297CS..Hα-helixtrans-62.5-46.8175.6-74.9172.8000111.3F13 L26 S27 H32 H33 R34 I40 L63 V67 Y78F13-I30 HydrophobicContact CE2-CD1 4.16Å; F13-I30 HydrophobicContact CZ-CD1 4.49Å; L26-I30 HydrophobicContact CD1-CD1 4.2Å; L26-I30 HydrophobicContact CD1-CG1 4.18Å; L26-I30 HydrophobicContact CG-CD1 4.03Å; L26-I30 HydrophobicContact CG-CG1 4.48Å; L26-I30 WeakPolarHBondContact O-CG1 3.46Å; L26-I30 PolarHBondContact O-N 3.26Å; S27-I30 PolarHBondContact O-N 3.26Å; I30-H32 VanDerWaalsContact C-N 3.29Å; I30-H32 PolarHBondContact O-N 3.43Å; I30-H33 CarbonylContact O-C 3.58Å; I30-H33 PolarHBondContact O-N 3.35Å; I30-H33 VanDerWaalsContact O-N 3.13Å; I30-R34 PolarHBondContact O-N 3.04Å; I30-I40 HydrophobicContact CD1-CG2 4.08Å; I30-I40 HydrophobicContact CG1-CG2 4.05Å; I30-I40 HydrophobicContact CG2-CD1 4.32Å; I30-I40 HydrophobicContact CG2-CG2 3.88Å; I30-L63 HydrophobicContact CD1-CD1 4.09Å; I30-L63 HydrophobicContact CD1-CD2 3.93Å; I30-L63 HydrophobicContact CD1-CG 4.19Å; I30-V67 HydrophobicContact CB-CG2 4.13Å; I30-V67 HydrophobicContact CD1-CG2 4.11Å; I30-V67 HydrophobicContact CG2-CG1 3.87Å; I30-V67 HydrophobicContact CG2-CG2 3.75Å; I30-Y78 HydrophobicContact CG2-CE1 3.98Å; I30-Y78 HydrophobicContact CG2-CE2 4.29Å; I30-Y78 VanDerWaalsContact CG2-OH 3.29Å; I30-Y78 WeakPolarHBondContact CG2-OH 3.47Å; I30-Y78 PolarHBondContact O-OH 3.06Å
31I93.1Very high94.2Very high23 Ų2355.8 Ų55.812%0.11827%0.269CS..Hα-helixtrans-66-35.6179.2-67.1168.9000110.8S27 C28 H33 R34 V67 N70S27-I31 WeakPolarHBondContact O-CG1 3.42Å; S27-I31 PolarHBondContact O-N 3.46Å; C28-I31 PolarHBondContact O-N 3.43Å; I31-H33 VanDerWaalsContact C-N 3.27Å; I31-H33 PolarHBondContact O-N 2.95Å; I31-R34 VanDerWaalsContact O-CD 3.26Å; I31-R34 WeakPolarHBondContact O-CD 3.42Å; I31-R34 PolarHBondContact O-N 3.42Å; I31-V67 HydrophobicContact CG1-CG1 4.34Å; I31-N70 HydrophobicContact CD1-CB 3.48Å; I31-N70 VanDerWaalsContact CD1-CB 3.48Å
32H90.5Very high94.3Very high78 Ų7854.4 Ų54.436%0.36127%0.265SS..Hα-helixtrans-59.2-41.4173.3-179.563.4000111.5M1 C28 W29 I30 R34M1-H32 PolarHBondContact SD-CE1 2.96Å; C28-H32 VanDerWaalsContact O-CB 3.31Å; C28-H32 WeakPolarHBondContact O-CB 3.36Å; C28-H32 PolarHBondContact O-N 3.38Å; W29-H32 WeakPolarHBondContact O-CB 3.44Å; W29-H32 PolarHBondContact O-N 3.21Å; I30-H32 VanDerWaalsContact C-N 3.29Å; I30-H32 PolarHBondContact O-N 3.43Å; H32-R34 PolarHBondContact O-N 3.21Å
33H90.3Very high94.3Very high20 Ų2056.1 Ų56.19%0.09327%0.27CS..THydrogen-bonded Turntrans-92.130.3179.2-68.1-58.5000114.7S2 F4 W29 I30 I31 L35 H36 I40S2-H33 PolarHBondContact O-CE1 3.16Å; S2-H33 PolarHBondContact O-NE2 3.05Å; F4-H33 HydrophobicContact CB-CB 4.39Å; F4-H33 HydrophobicContact CD2-CB 3.91Å; F4-H33 HydrophobicContact CG-CB 4.48Å; W29-H33 AromaticContact CD2-CD2 3.5Å; W29-H33 VanDerWaalsContact CD2-CD2 3.5Å; W29-H33 AromaticContact CE2-CD2 3.22Å; W29-H33 AromaticContact CE2-NE2 3.36Å; W29-H33 AromaticContact CE3-CD2 3.85Å; W29-H33 AromaticContact CH2-CD2 3.78Å; W29-H33 AromaticContact CZ2-CD2 3.39Å; W29-H33 WeakPolarHBondContact CZ2-CD2 3.4Å; W29-H33 AromaticContact CZ2-NE2 3.53Å; W29-H33 AromaticContact CZ3-CD2 3.98Å; W29-H33 AromaticContact NE1-CD2 3.61Å; W29-H33 AromaticContact NE1-NE2 3.34Å; W29-H33 PolarHBondContact NE1-NE2 3.48Å; W29-H33 PolarHBondContact O-CD2 3.47Å; W29-H33 PolarHBondContact O-N 3.09Å; W29-H33 VanDerWaalsContact O-N 3.13Å; I30-H33 CarbonylContact O-C 3.58Å; I30-H33 PolarHBondContact O-N 3.35Å; I30-H33 VanDerWaalsContact O-N 3.13Å; I31-H33 VanDerWaalsContact C-N 3.27Å; I31-H33 PolarHBondContact O-N 2.95Å; H33-L35 PolarHBondContact O-N 3.41Å; H33-H36 PolarHBondContact O-N 2.62Å; H33-I40 HydrophobicContact CB-CD1 4.26Å
34R91.4Very high94.3Very high98 Ų9855.6 Ų55.637%0.3727%0.267SS..G310 helixtrans-55.6-19.1-177.676.2-98-174.4-175.56.2116.1I30 I31 H32 H36 D37 H75 Y78I30-R34 PolarHBondContact O-N 3.04Å; I31-R34 VanDerWaalsContact O-CD 3.26Å; I31-R34 WeakPolarHBondContact O-CD 3.42Å; I31-R34 PolarHBondContact O-N 3.42Å; H32-R34 PolarHBondContact O-N 3.21Å; R34-H36 PolarHBondContact O-N 3.41Å; R34-H36 VanDerWaalsContact O-N 3.14Å; R34-D37 WeakPolarHBondContact O-CB 3.36Å; R34-D37 VanDerWaalsContact O-CG 3.31Å; R34-D37 PolarHBondContact O-N 3.46Å; R34-H75 HydrophobicContact CB-CB 4.23Å; R34-H75 VanDerWaalsContact CD-CD2 3.4Å; R34-H75 WeakPolarHBondContact CD-CD2 3.31Å; R34-H75 WeakPolarHBondContact CD-CE1 3.31Å; R34-H75 WeakPolarHBondContact CD-NE2 3.32Å; R34-H75 HydrophobicContact CG-CB 4.38Å; R34-H75 VanDerWaalsContact CG-CG 3.48Å; R34-H75 VanDerWaalsContact CG-ND1 3.35Å; R34-H75 WeakPolarHBondContact CG-ND1 3.43Å; R34-H75 VanDerWaalsContact CZ-CE1 3.45Å; R34-H75 VanDerWaalsContact CZ-NE2 3.28Å; R34-H75 PolarHBondContact NE-CE1 2.79Å; R34-H75 PolarHBondContact NE-NE2 2.83Å; R34-Y78 HydrophobicContact CB-CE2 3.74Å
35L88.8Confident94.4Very high152 Ų15251.9 Ų51.980%0.79625%0.25SC*.G310 helixtrans-64.9-14.4175.5-61.8178.3000111.9H33H33-L35 PolarHBondContact O-N 3.41Å
36H91.8Very high94.5Very high64 Ų6454.4 Ų54.430%0.29626%0.257SS..G310 helixtrans-111.324.1175.2-52.6-61.6000112F4 H33 R34 R38 K39 I40F4-H36 VanDerWaalsContact CB-CD2 3.44Å; F4-H36 WeakPolarHBondContact CB-CD2 3.35Å; F4-H36 HydrophobicContact CD1-CB 3.97Å; F4-H36 AromaticContact CD1-CD2 3.36Å; F4-H36 WeakPolarHBondContact CD1-CD2 3.36Å; F4-H36 AromaticContact CD1-CG 3.52Å; F4-H36 AromaticContact CD1-NE2 3.81Å; F4-H36 HydrophobicContact CD2-CB 4.3Å; F4-H36 AromaticContact CD2-CD2 3.96Å; F4-H36 HydrophobicContact CE1-CB 3.76Å; F4-H36 AromaticContact CE1-CG 3.77Å; F4-H36 HydrophobicContact CE2-CB 4.12Å; F4-H36 HydrophobicContact CG-CB 4.24Å; F4-H36 AromaticContact CG-CD2 3.29Å; F4-H36 WeakPolarHBondContact CG-CD2 3.46Å; F4-H36 AromaticContact CG-CG 3.85Å; F4-H36 AromaticContact CG-NE2 3.94Å; F4-H36 HydrophobicContact CZ-CB 3.84Å; H33-H36 PolarHBondContact O-N 2.62Å; R34-H36 PolarHBondContact O-N 3.41Å; R34-H36 VanDerWaalsContact O-N 3.14Å; H36-R38 VanDerWaalsContact C-N 3.35Å; H36-R38 PolarHBondContact O-N 2.83Å; H36-K39 PolarHBondContact O-N 2.92Å; H36-I40 HydrophobicContact CB-CD1 4.21Å; H36-I40 HydrophobicContact CB-CG1 4.45Å; H36-I40 VanDerWaalsContact O-CG1 3.31Å; H36-I40 WeakPolarHBondContact O-CG1 3.35Å; H36-I40 PolarHBondContact O-N 3.39Å
37D94.6Very high94.4Very high32 Ų3255.2 Ų55.217%0.17126%0.263CS..Hα-helixtrans-50.3-47.9-176573.6000113.5R34 I40 V41 A77 Y78 L81R34-D37 WeakPolarHBondContact O-CB 3.36Å; R34-D37 VanDerWaalsContact O-CG 3.31Å; R34-D37 PolarHBondContact O-N 3.46Å; D37-I40 PolarHBondContact O-N 3.46Å; D37-V41 WeakPolarHBondContact O-CB 3.4Å; D37-V41 VanDerWaalsContact O-CG2 3.27Å; D37-V41 WeakPolarHBondContact O-CG2 3.16Å; D37-V41 PolarHBondContact O-N 3.34Å; D37-A77 VanDerWaalsContact OD2-CB 3.28Å; D37-A77 WeakPolarHBondContact OD2-CB 3.18Å; D37-Y78 HydrophobicContact CB-CD1 4.02Å; D37-Y78 HydrophobicContact CB-CE1 3.53Å; D37-Y78 HydrophobicContact CB-CE2 4.31Å; D37-L81 HydrophobicContact CB-CD1 3.63Å; D37-L81 VanDerWaalsContact CG-CD1 3.45Å
38R94.7Very high94.5Very high171 Ų17155.1 Ų55.165%0.64526%0.262SS*.Hα-helixtrans-59-51.5177.9-68.4-175.2-177.3-175.32.1111.7H36 I40 V41 D42 L81H36-R38 VanDerWaalsContact C-N 3.35Å; H36-R38 PolarHBondContact O-N 2.83Å; R38-I40 VanDerWaalsContact C-N 3.28Å; R38-I40 PolarHBondContact O-N 2.99Å; R38-V41 PolarHBondContact O-N 3.29Å; R38-D42 WeakPolarHBondContact O-CB 3.32Å; R38-D42 VanDerWaalsContact O-CG 3.25Å; R38-D42 PolarHBondContact O-N 3.15Å; R38-L81 HydrophobicContact CG-CD1 4.08Å; R38-L81 HydrophobicContact CG-CD2 3.87Å
39K92.9Very high94.6Very high98 Ų9855.6 Ų55.643%0.42625%0.251SS..Hα-helixtrans-60.5-39.2178.4-71.1-169.8177.7-171.40111.8H36 F43H36-K39 PolarHBondContact O-N 2.92Å; K39-F43 VanDerWaalsContact O-CB 3.28Å; K39-F43 WeakPolarHBondContact O-CB 3.26Å; K39-F43 PolarHBondContact O-N 2.79Å
40I96.6Very high94.6Very high1 Ų158.6 Ų58.61%0.00528%0.276CS..Hα-helixtrans-66.5-43.8178.2-68.1164.6000110.9F4 L9 I30 H33 H36 D37 R38 F43 W44 Y78F4-I40 HydrophobicContact CD2-CD1 4.31Å; F4-I40 HydrophobicContact CE2-CD1 3.7Å; F4-I40 HydrophobicContact CE2-CG1 3.49Å; F4-I40 VanDerWaalsContact CE2-CG1 3.49Å; F4-I40 HydrophobicContact CZ-CD1 4.4Å; F4-I40 HydrophobicContact CZ-CG1 3.83Å; L9-I40 HydrophobicContact CD1-CG1 4.24Å; L9-I40 HydrophobicContact CD1-CG2 4.41Å; L9-I40 HydrophobicContact CD2-CG1 4.27Å; I30-I40 HydrophobicContact CD1-CG2 4.08Å; I30-I40 HydrophobicContact CG1-CG2 4.05Å; I30-I40 HydrophobicContact CG2-CD1 4.32Å; I30-I40 HydrophobicContact CG2-CG2 3.88Å; H33-I40 HydrophobicContact CB-CD1 4.26Å; H36-I40 HydrophobicContact CB-CD1 4.21Å; H36-I40 HydrophobicContact CB-CG1 4.45Å; H36-I40 VanDerWaalsContact O-CG1 3.31Å; H36-I40 WeakPolarHBondContact O-CG1 3.35Å; H36-I40 PolarHBondContact O-N 3.39Å; D37-I40 PolarHBondContact O-N 3.46Å; R38-I40 VanDerWaalsContact C-N 3.28Å; R38-I40 PolarHBondContact O-N 2.99Å; I40-F43 PolarHBondContact O-N 3.41Å; I40-W44 WeakPolarHBondContact O-CB 3.4Å; I40-W44 PolarHBondContact O-N 3.37Å; I40-Y78 WeakPolarHBondContact CD1-OH 3.34Å
41V98Very high94.6Very high2 Ų259.3 Ų59.31%0.01228%0.279CS..Hα-helixtrans-68.5-40.3179.5174.10000111.2D37 R38 W44 L45 Y78 L81 F82 V85D37-V41 WeakPolarHBondContact O-CB 3.4Å; D37-V41 VanDerWaalsContact O-CG2 3.27Å; D37-V41 WeakPolarHBondContact O-CG2 3.16Å; D37-V41 PolarHBondContact O-N 3.34Å; R38-V41 PolarHBondContact O-N 3.29Å; V41-W44 PolarHBondContact O-N 3.29Å; V41-L45 WeakPolarHBondContact O-CB 3.19Å; V41-L45 PolarHBondContact O-N 3.28Å; V41-Y78 HydrophobicContact CG2-CD1 4.05Å; V41-Y78 HydrophobicContact CG2-CE1 4.22Å; V41-L81 HydrophobicContact CB-CB 4.39Å; V41-L81 HydrophobicContact CG1-CB 4.23Å; V41-L81 HydrophobicContact CG2-CB 3.93Å; V41-L81 HydrophobicContact CG2-CD1 4.35Å; V41-F82 HydrophobicContact CG2-CD2 4.17Å; V41-F82 HydrophobicContact CG2-CE1 4.41Å; V41-F82 HydrophobicContact CG2-CE2 3.88Å; V41-F82 HydrophobicContact CG2-CZ 4.02Å; V41-V85 HydrophobicContact CG1-CG1 4.16Å; V41-V85 HydrophobicContact CG1-CG2 3.6Å
42D96.1Very high94.7Very high98 Ų9863.9 Ų63.952%0.52430%0.303SS..Hα-helixtrans-63.1-44.7174.6-70.1-23.3000111.3R38 W44 L45 E46R38-D42 WeakPolarHBondContact O-CB 3.32Å; R38-D42 VanDerWaalsContact O-CG 3.25Å; R38-D42 PolarHBondContact O-N 3.15Å; D42-W44 VanDerWaalsContact C-N 3.33Å; D42-W44 PolarHBondContact O-N 3.37Å; D42-L45 PolarHBondContact O-N 2.95Å; D42-E46 PolarHBondContact O-N 2.93Å
43F96Very high95Very high62 Ų6267.5 Ų67.527%0.27231%0.314SS..Hα-helixtrans-62.9-40.4175.7-170.9-82.7000111.8L9 F13 K39 I40 E46 T47L9-F43 HydrophobicContact CD2-CB 3.56Å; L9-F43 HydrophobicContact CD2-CD1 3.81Å; L9-F43 HydrophobicContact CD2-CD2 3.98Å; L9-F43 HydrophobicContact CD2-CG 3.49Å; L9-F43 VanDerWaalsContact CD2-CG 3.49Å; L9-F43 HydrophobicContact CG-CD1 3.91Å; L9-F43 HydrophobicContact CG-CE1 4.29Å; L9-F43 HydrophobicContact CG-CG 4.09Å; F13-F43 HydrophobicContact CB-CE1 4.01Å; F13-F43 HydrophobicContact CD1-CD1 4.07Å; F13-F43 AromaticContact CD1-CE1 3.97Å; F13-F43 HydrophobicContact CD1-CE1 3.97Å; F13-F43 HydrophobicContact CD2-CD1 4.34Å; F13-F43 HydrophobicContact CD2-CE1 4.28Å; F13-F43 HydrophobicContact CE1-CD1 4.2Å; F13-F43 HydrophobicContact CE2-CD1 4.47Å; F13-F43 HydrophobicContact CG-CD1 4.15Å; F13-F43 AromaticContact CG-CE1 3.81Å; F13-F43 HydrophobicContact CG-CE1 3.81Å; F13-F43 HydrophobicContact CZ-CD1 4.39Å; K39-F43 VanDerWaalsContact O-CB 3.28Å; K39-F43 WeakPolarHBondContact O-CB 3.26Å; K39-F43 PolarHBondContact O-N 2.79Å; I40-F43 PolarHBondContact O-N 3.41Å; F43-E46 PolarHBondContact O-N 2.82Å; F43-T47 WeakPolarHBondContact CE1-OG1 3.36Å; F43-T47 WeakPolarHBondContact O-CB 3.25Å; F43-T47 PolarHBondContact O-N 3.4Å; F43-T47 PolarHBondContact O-OG1 3.32Å
44W98.4Very high95.4Very high1 Ų167.4 Ų67.40%0.00432%0.316CS..Hα-helixtrans-61.1-46.2174.6174.392000111.3F13 I40 V41 D42 E46 T47 V48 L60 F61 A64 F82 V85 L86 A89F13-W44 HydrophobicContact CE1-CB 3.98Å; F13-W44 AromaticContact CE1-CD1 3.86Å; F13-W44 HydrophobicContact CE1-CG 4.3Å; F13-W44 HydrophobicContact CZ-CB 4.01Å; I40-W44 WeakPolarHBondContact O-CB 3.4Å; I40-W44 PolarHBondContact O-N 3.37Å; V41-W44 PolarHBondContact O-N 3.29Å; D42-W44 VanDerWaalsContact C-N 3.33Å; D42-W44 PolarHBondContact O-N 3.37Å; W44-E46 PolarHBondContact O-N 3.12Å; W44-T47 PolarHBondContact O-N 2.66Å; W44-V48 HydrophobicContact CD2-CG2 4.02Å; W44-V48 HydrophobicContact CE3-CG2 4.4Å; W44-V48 HydrophobicContact CH2-CG2 4.11Å; W44-V48 HydrophobicContact CZ2-CG2 3.72Å; W44-V48 HydrophobicContact CZ3-CG2 4.44Å; W44-V48 WeakPolarHBondContact O-CG2 3.34Å; W44-V48 PolarHBondContact O-N 3.46Å; W44-L60 PolarHBondContact NE1-O 3.07Å; W44-F61 HydrophobicContact CH2-CE1 4.35Å; W44-F61 HydrophobicContact CH2-CZ 4.3Å; W44-F61 HydrophobicContact CZ2-CD1 4.47Å; W44-F61 HydrophobicContact CZ2-CD2 4.45Å; W44-F61 HydrophobicContact CZ2-CE2 4.49Å; W44-F61 HydrophobicContact CZ2-CG 4.45Å; W44-A64 HydrophobicContact CZ2-CB 3.8Å; W44-F82 AromaticContact CD2-CE1 3.75Å; W44-F82 HydrophobicContact CD2-CE1 3.75Å; W44-F82 HydrophobicContact CE3-CD1 4.29Å; W44-F82 AromaticContact CE3-CE1 3.84Å; W44-F82 HydrophobicContact CE3-CE1 3.84Å; W44-F82 HydrophobicContact CG-CE1 4.12Å; W44-F82 HydrophobicContact CZ3-CD1 4.35Å; W44-F82 HydrophobicContact CZ3-CE1 4.29Å; W44-V85 HydrophobicContact CE3-CG2 4.24Å; W44-V85 HydrophobicContact CZ3-CG2 3.91Å; W44-L86 HydrophobicContact CH2-CD2 3.88Å; W44-L86 HydrophobicContact CZ2-CD2 4.5Å; W44-A89 HydrophobicContact CH2-CB 3.49Å; W44-A89 VanDerWaalsContact CH2-CB 3.49Å; W44-A89 HydrophobicContact CZ3-CB 3.54Å
45L97.9Very high95.7Very high7 Ų768 Ų684%0.03732%0.318CS..Hα-helixtrans-61.2-46.2179.1176.960.9000111.4V41 D42 T47 V48 R49 V85 E88 A89V41-L45 WeakPolarHBondContact O-CB 3.19Å; V41-L45 PolarHBondContact O-N 3.28Å; D42-L45 PolarHBondContact O-N 2.95Å; L45-T47 VanDerWaalsContact C-N 3.33Å; L45-T47 PolarHBondContact O-N 3.25Å; L45-V48 PolarHBondContact O-N 3.49Å; L45-R49 HydrophobicContact CD1-CG 4.4Å; L45-R49 WeakPolarHBondContact O-CG 3.46Å; L45-R49 PolarHBondContact O-N 3.11Å; L45-V85 HydrophobicContact CD1-CB 4.34Å; L45-V85 HydrophobicContact CD2-CB 4.03Å; L45-V85 HydrophobicContact CD2-CG1 3.91Å; L45-E88 HydrophobicContact CD1-CG 4.23Å; L45-A89 HydrophobicContact CD1-CB 3.73Å
46E96.4Very high96.1Very high111 Ų11162.1 Ų62.152%0.51929%0.285SS..Hα-helixtrans-64.2-40.2178.4-160.563.4-163.700111.5D42 F43 W44 V48 R49 S50D42-E46 PolarHBondContact O-N 2.93Å; F43-E46 PolarHBondContact O-N 2.82Å; W44-E46 PolarHBondContact O-N 3.12Å; E46-V48 VanDerWaalsContact C-N 3.34Å; E46-V48 PolarHBondContact O-N 3.1Å; E46-R49 PolarHBondContact O-N 2.98Å; E46-R49 IonicContact OE2-NH1 2.72Å; E46-R49 PolarHBondContact OE2-NH1 3.38Å; E46-S50 PolarHBondContact O-N 2.93Å; E46-S50 VanDerWaalsContact O-N 3.13Å; E46-S50 PolarHBondContact O-OG 3.46Å
47T95.5Very high96.4Very high23 Ų2359 Ų5914%0.14127%0.271CS..Hα-helixtrans-60.7-44.2174-54.90000111F13 F43 W44 L45 S50 E51 L60F13-T47 HydrophobicContact CD1-CG2 4.14Å; F43-T47 WeakPolarHBondContact CE1-OG1 3.36Å; F43-T47 WeakPolarHBondContact O-CB 3.25Å; F43-T47 PolarHBondContact O-N 3.4Å; F43-T47 PolarHBondContact O-OG1 3.32Å; W44-T47 PolarHBondContact O-N 2.66Å; L45-T47 VanDerWaalsContact C-N 3.33Å; L45-T47 PolarHBondContact O-N 3.25Å; T47-S50 PolarHBondContact O-N 2.98Å; T47-S50 PolarHBondContact O-OG 3.23Å; T47-E51 WeakPolarHBondContact O-CB 3.35Å; T47-E51 PolarHBondContact O-N 3.46Å; T47-L60 HydrophobicContact CG2-CD1 3.94Å; T47-L60 HydrophobicContact CG2-CD2 4.07Å
48V97.8Very high96.5Very high0 Ų057.6 Ų57.60%026%0.263CS..Hα-helixtrans-63-49.2177.3171.60000111W44 L45 E46 S50 E51 L60 F61 A89 V93W44-V48 HydrophobicContact CD2-CG2 4.02Å; W44-V48 HydrophobicContact CE3-CG2 4.4Å; W44-V48 HydrophobicContact CH2-CG2 4.11Å; W44-V48 HydrophobicContact CZ2-CG2 3.72Å; W44-V48 HydrophobicContact CZ3-CG2 4.44Å; W44-V48 WeakPolarHBondContact O-CG2 3.34Å; W44-V48 PolarHBondContact O-N 3.46Å; L45-V48 PolarHBondContact O-N 3.49Å; E46-V48 VanDerWaalsContact C-N 3.34Å; E46-V48 PolarHBondContact O-N 3.1Å; V48-S50 PolarHBondContact O-N 3.28Å; V48-S50 VanDerWaalsContact O-N 3.17Å; V48-E51 PolarHBondContact O-N 3.33Å; V48-L60 HydrophobicContact CG2-CB 4.01Å; V48-L60 HydrophobicContact CG2-CD1 3.9Å; V48-F61 HydrophobicContact CG1-CE2 4.13Å; V48-A89 HydrophobicContact CG1-CB 4Å; V48-V93 HydrophobicContact CG1-CB 4.44Å; V48-V93 HydrophobicContact CG1-CG1 3.63Å; V48-V93 HydrophobicContact CG1-CG2 3.95Å; V48-V93 WeakPolarHBondContact O-CG1 3.45Å
49R96Very high96.7Very high100 Ų10050 Ų5038%0.37724%0.235SC..Hα-helixtrans-57.3-33-179.5-74.6-177.1-174.6138.2-3.5113.3L45 E46 E88L45-R49 HydrophobicContact CD1-CG 4.4Å; L45-R49 WeakPolarHBondContact O-CG 3.46Å; L45-R49 PolarHBondContact O-N 3.11Å; E46-R49 PolarHBondContact O-N 2.98Å; E46-R49 IonicContact OE2-NH1 2.72Å; E46-R49 PolarHBondContact OE2-NH1 3.38Å; R49-E88 IonicContact CZ-OE1 3.45Å; R49-E88 IonicContact NE-OE1 3.55Å; R49-E88 PolarHBondContact NE-OE1 3.12Å; R49-E88 IonicContact NH2-OE1 3.51Å; R49-E88 PolarHBondContact NH2-OE1 2.89Å; R49-E88 IonicContact NH2-OE2 2.69Å; R49-E88 PolarHBondContact NH2-OE2 3.09Å; R49-E88 VanDerWaalsContact NH2-OE2 3.17Å
50S94Very high96.9Very high86 Ų8645.3 Ų45.360%0.60122%0.215SC*.THydrogen-bonded Turntrans-86.7-7-179.268.80000114.5E46 T47 V48E46-S50 PolarHBondContact O-N 2.93Å; E46-S50 VanDerWaalsContact O-N 3.13Å; E46-S50 PolarHBondContact O-OG 3.46Å; T47-S50 PolarHBondContact O-N 2.98Å; T47-S50 PolarHBondContact O-OG 3.23Å; V48-S50 PolarHBondContact O-N 3.28Å; V48-S50 VanDerWaalsContact O-N 3.17Å
51E95.5Very high97Very high18 Ų1845.2 Ų45.28%0.08422%0.215CC..  trans-97.9137.9-174.8-175.562.6-108.900112.4T47 V48 R53 R56 I57 L60T47-E51 WeakPolarHBondContact O-CB 3.35Å; T47-E51 PolarHBondContact O-N 3.46Å; V48-E51 PolarHBondContact O-N 3.33Å; E51-R53 VanDerWaalsContact OE1-CB 3.24Å; E51-R53 WeakPolarHBondContact OE1-CB 3.27Å; E51-R53 WeakPolarHBondContact OE1-CG 3.36Å; E51-R53 IonicContact OE1-CZ 3.5Å; E51-R53 PolarHBondContact OE1-N 3.48Å; E51-R53 IonicContact OE1-NE 3.22Å; E51-R53 PolarHBondContact OE1-NE 2.9Å; E51-R53 IonicContact OE1-NH2 3.12Å; E51-R53 IonicContact OE2-CZ 3.1Å; E51-R53 IonicContact OE2-NE 3.89Å; E51-R53 IonicContact OE2-NH2 2.84Å; E51-R53 PolarHBondContact OE2-NH2 3.41Å; E51-R56 HydrophobicContact CG-CB 4.01Å; E51-R56 HydrophobicContact CG-CG 3.84Å; E51-R56 WeakPolarHBondContact OE2-CG 3.46Å; E51-I57 HydrophobicContact CB-CG1 4.2Å; E51-I57 HydrophobicContact CG-CG1 3.78Å; E51-L60 HydrophobicContact CB-CD1 4.5Å
52N96.4Very high97Very high119 Ų11948.3 Ų48.364%0.63623%0.227SC*.  trans-125.4-10.4-175.736.80.5000112.4S54N52-S54 PolarHBondContact O-N 3.29Å
53R97Very high97.1Very high154 Ų15443.8 Ų43.858%0.58120%0.202SC*.  trans-81.5114.1174.7-64.3169.4-69.1157.6-5.1110.7E51 R55 R56 I57E51-R53 VanDerWaalsContact OE1-CB 3.24Å; E51-R53 WeakPolarHBondContact OE1-CB 3.27Å; E51-R53 WeakPolarHBondContact OE1-CG 3.36Å; E51-R53 IonicContact OE1-CZ 3.5Å; E51-R53 PolarHBondContact OE1-N 3.48Å; E51-R53 IonicContact OE1-NE 3.22Å; E51-R53 PolarHBondContact OE1-NE 2.9Å; E51-R53 IonicContact OE1-NH2 3.12Å; E51-R53 IonicContact OE2-CZ 3.1Å; E51-R53 IonicContact OE2-NE 3.89Å; E51-R53 IonicContact OE2-NH2 2.84Å; E51-R53 PolarHBondContact OE2-NH2 3.41Å; R53-R55 VanDerWaalsContact C-N 3.29Å; R53-R55 PolarHBondContact O-N 3.04Å; R53-R55 VanDerWaalsContact O-N 3.13Å; R53-R56 HydrophobicContact CB-CB 4.07Å; R53-R56 PolarHBondContact O-N 2.96Å; R53-I57 PolarHBondContact O-N 3.06Å
54S97.5Very high97.2Very high19 Ų1940.8 Ų40.813%0.13319%0.189CC..Hα-helixtrans-48.5-44-178.4-174.20000114.6N52 L58 C96 L97 N98 H101N52-S54 PolarHBondContact O-N 3.29Å; S54-L58 PolarHBondContact O-N 3.17Å; S54-C96 WeakPolarHBondContact CA-O 3.19Å; S54-C96 VanDerWaalsContact CB-O 3.22Å; S54-C96 WeakPolarHBondContact CB-O 3.38Å; S54-L97 WeakPolarHBondContact OG-CA 3.46Å; S54-N98 PolarHBondContact OG-N 2.88Å; S54-H101 WeakPolarHBondContact CB-ND1 3.35Å; S54-H101 PolarHBondContact OG-ND1 2.99Å
55R97.3Very high97.2Very high110 Ų11041.9 Ų41.942%0.41520%0.195SC..Hα-helixtrans-64.6-42.3179.1-179.455.5172-118.8-2.8112.2S18 R53 L58 D59S18-R55 VanDerWaalsContact CB-NE 3.26Å; S18-R55 PolarHBondContact OG-NH2 3.27Å; R53-R55 VanDerWaalsContact C-N 3.29Å; R53-R55 PolarHBondContact O-N 3.04Å; R53-R55 VanDerWaalsContact O-N 3.13Å; R55-L58 WeakPolarHBondContact O-CB 3.44Å; R55-L58 PolarHBondContact O-N 2.77Å; R55-D59 IonicContact NE-OD1 3.95Å; R55-D59 VanDerWaalsContact O-CG 3.3Å; R55-D59 PolarHBondContact O-N 2.86Å
56R97.2Very high97.2Very high28 Ų2843.5 Ų43.511%0.10620%0.202CC..Hα-helixtrans-71.7-36.1-176.7-178.754.2-179-143.5-9.8112F13 S14 L16 E51 R53 L58 D59 L60F13-R56 VanDerWaalsContact C-NH2 3.34Å; F13-R56 VanDerWaalsContact O-CZ 3.26Å; F13-R56 PolarHBondContact O-NH1 3.26Å; F13-R56 VanDerWaalsContact O-NH1 3.14Å; F13-R56 PolarHBondContact O-NH2 2.97Å; S14-R56 PolarHBondContact O-NH1 3.33Å; L16-R56 PolarHBondContact O-NH1 3.48Å; E51-R56 HydrophobicContact CG-CB 4.01Å; E51-R56 HydrophobicContact CG-CG 3.84Å; E51-R56 WeakPolarHBondContact OE2-CG 3.46Å; R53-R56 HydrophobicContact CB-CB 4.07Å; R53-R56 PolarHBondContact O-N 2.96Å; R56-L58 VanDerWaalsContact C-N 3.32Å; R56-D59 PolarHBondContact O-N 3.23Å; R56-L60 WeakPolarHBondContact O-CG 3.47Å; R56-L60 PolarHBondContact O-N 2.72Å
57I98.2Very high97.2Very high0 Ų038.2 Ų38.20%018%0.178CC..Hα-helixtrans-57-49169.4-65.7159.6000109.9E51 R53 D59 L60 F61 V93 C96 L97E51-I57 HydrophobicContact CB-CG1 4.2Å; E51-I57 HydrophobicContact CG-CG1 3.78Å; R53-I57 PolarHBondContact O-N 3.06Å; I57-D59 VanDerWaalsContact C-N 3.33Å; I57-D59 PolarHBondContact O-N 2.67Å; I57-L60 WeakPolarHBondContact O-CB 3.47Å; I57-L60 PolarHBondContact O-N 3.25Å; I57-F61 HydrophobicContact CG2-CD2 3.94Å; I57-F61 HydrophobicContact CG2-CE2 3.98Å; I57-F61 WeakPolarHBondContact O-CD2 3.47Å; I57-F61 PolarHBondContact O-N 3.26Å; I57-V93 HydrophobicContact CD1-CB 3.9Å; I57-V93 HydrophobicContact CD1-CG1 4.38Å; I57-V93 HydrophobicContact CD1-CG2 4.47Å; I57-V93 HydrophobicContact CG1-CB 4.31Å; I57-V93 HydrophobicContact CG2-CB 4.19Å; I57-V93 HydrophobicContact CG2-CG2 3.55Å; I57-C96 HydrophobicContact CD1-CB 3.54Å; I57-L97 HydrophobicContact CB-CD2 4.01Å; I57-L97 HydrophobicContact CG2-CD1 4.37Å; I57-L97 HydrophobicContact CG2-CD2 3.75Å; I57-L97 HydrophobicContact CG2-CG 4.14Å
58L97.9Very high97.3Very high2 Ų237.1 Ų37.11%0.0117%0.171CC..Hα-helixtrans-58.5-44.7178.6-176.765.9000111.9S54 R55 R56 L60 F61 Y62 H101 K104 L105S54-L58 PolarHBondContact O-N 3.17Å; R55-L58 WeakPolarHBondContact O-CB 3.44Å; R55-L58 PolarHBondContact O-N 2.77Å; R56-L58 VanDerWaalsContact C-N 3.32Å; L58-L60 VanDerWaalsContact C-N 3.3Å; L58-L60 PolarHBondContact O-N 2.86Å; L58-F61 PolarHBondContact O-N 2.91Å; L58-Y62 HydrophobicContact CD1-CD1 4.18Å; L58-Y62 HydrophobicContact CD1-CE1 3.66Å; L58-Y62 HydrophobicContact CD1-CE2 4.3Å; L58-Y62 HydrophobicContact CD2-CE2 4.04Å; L58-Y62 HydrophobicContact CG-CD2 4.27Å; L58-Y62 HydrophobicContact CG-CE1 4.16Å; L58-Y62 HydrophobicContact CG-CE2 3.89Å; L58-Y62 PolarHBondContact O-N 2.95Å; L58-H101 HydrophobicContact CB-CB 4.39Å; L58-H101 HydrophobicContact CD2-CB 4.12Å; L58-K104 HydrophobicContact CD1-CB 4.09Å; L58-K104 HydrophobicContact CD2-CB 4.06Å; L58-K104 HydrophobicContact CD2-CD 3.78Å; L58-L105 HydrophobicContact CD1-CB 4.25Å; L58-L105 HydrophobicContact CD1-CD1 4.34Å
59D97.9Very high97.1Very high10 Ų1038.9 Ų38.95%0.05318%0.179CC..Hα-helixtrans-60.3-38.9178-63.1-22000111.9L16 S18 R55 R56 I57 Y62 L63L16-D59 HydrophobicContact CD2-CB 4.29Å; L16-D59 HydrophobicContact CG-CB 4.43Å; S18-D59 VanDerWaalsContact CA-OD1 3.25Å; S18-D59 WeakPolarHBondContact CA-OD1 3.2Å; S18-D59 WeakPolarHBondContact CB-OD1 3.33Å; S18-D59 PolarHBondContact N-OD2 3.34Å; R55-D59 IonicContact NE-OD1 3.95Å; R55-D59 VanDerWaalsContact O-CG 3.3Å; R55-D59 PolarHBondContact O-N 2.86Å; R56-D59 PolarHBondContact O-N 3.23Å; I57-D59 VanDerWaalsContact C-N 3.33Å; I57-D59 PolarHBondContact O-N 2.67Å; D59-Y62 PolarHBondContact O-N 3.39Å; D59-L63 PolarHBondContact O-N 3.3Å
60L98.5Very high97Very high0 Ų038.2 Ų38.20%018%0.183CC..Hα-helixtrans-66.3-40.2175.9-70.6165.9000112.4F13 L16 W44 T47 V48 E51 R56 I57 L58 L63 A64F13-L60 HydrophobicContact CD1-CD2 3.85Å; F13-L60 HydrophobicContact CE1-CD2 3.91Å; L16-L60 HydrophobicContact CD2-CD2 3.95Å; L16-L60 HydrophobicContact CD2-CG 4.45Å; W44-L60 PolarHBondContact NE1-O 3.07Å; T47-L60 HydrophobicContact CG2-CD1 3.94Å; T47-L60 HydrophobicContact CG2-CD2 4.07Å; V48-L60 HydrophobicContact CG2-CB 4.01Å; V48-L60 HydrophobicContact CG2-CD1 3.9Å; E51-L60 HydrophobicContact CB-CD1 4.5Å; R56-L60 WeakPolarHBondContact O-CG 3.47Å; R56-L60 PolarHBondContact O-N 2.72Å; I57-L60 WeakPolarHBondContact O-CB 3.47Å; I57-L60 PolarHBondContact O-N 3.25Å; L58-L60 VanDerWaalsContact C-N 3.3Å; L58-L60 PolarHBondContact O-N 2.86Å; L60-L63 WeakPolarHBondContact O-CB 3.17Å; L60-L63 PolarHBondContact O-N 3.32Å; L60-A64 PolarHBondContact O-N 3Å
61F98.3Very high96.9Very high0 Ų034.1 Ų34.10%015%0.154CC..Hα-helixtrans-69.8-33.8174.8-87.5-94.5000112.4W44 V48 I57 L58 L63 A64 N65 L86 A89 L90 V93 L105W44-F61 HydrophobicContact CH2-CE1 4.35Å; W44-F61 HydrophobicContact CH2-CZ 4.3Å; W44-F61 HydrophobicContact CZ2-CD1 4.47Å; W44-F61 HydrophobicContact CZ2-CD2 4.45Å; W44-F61 HydrophobicContact CZ2-CE2 4.49Å; W44-F61 HydrophobicContact CZ2-CG 4.45Å; V48-F61 HydrophobicContact CG1-CE2 4.13Å; I57-F61 HydrophobicContact CG2-CD2 3.94Å; I57-F61 HydrophobicContact CG2-CE2 3.98Å; I57-F61 WeakPolarHBondContact O-CD2 3.47Å; I57-F61 PolarHBondContact O-N 3.26Å; L58-F61 PolarHBondContact O-N 2.91Å; F61-L63 VanDerWaalsContact C-N 3.33Å; F61-A64 PolarHBondContact O-N 3.38Å; F61-N65 WeakPolarHBondContact O-CB 3.38Å; F61-N65 PolarHBondContact O-N 3.2Å; F61-L86 HydrophobicContact CD1-CD2 3.97Å; F61-L86 HydrophobicContact CE1-CD2 3.65Å; F61-A89 HydrophobicContact CZ-CB 4.15Å; F61-L90 HydrophobicContact CE1-CB 4.35Å; F61-L90 HydrophobicContact CZ-CB 4.02Å; F61-L90 HydrophobicContact CZ-CD1 4.21Å; F61-V93 HydrophobicContact CE2-CG2 4.05Å; F61-L105 HydrophobicContact CB-CD1 3.36Å; F61-L105 HydrophobicContact CD1-CD1 3.65Å; F61-L105 HydrophobicContact CD1-CD2 4.26Å; F61-L105 HydrophobicContact CD2-CD1 4.42Å; F61-L105 HydrophobicContact CE1-CD2 4.42Å; F61-L105 HydrophobicContact CG-CD1 3.56Å; F61-L105 HydrophobicContact CG-CD2 4.33Å
62Y98.2Very high96.5Very high67 Ų6738 Ų3826%0.26317%0.168SC..Hα-helixtrans-65.6-36.7171.5-73.7-10.3000112.4I23 L58 D59 N65 E66I23-Y62 HydrophobicContact CD1-CD2 4.16Å; L58-Y62 HydrophobicContact CD1-CD1 4.18Å; L58-Y62 HydrophobicContact CD1-CE1 3.66Å; L58-Y62 HydrophobicContact CD1-CE2 4.3Å; L58-Y62 HydrophobicContact CD2-CE2 4.04Å; L58-Y62 HydrophobicContact CG-CD2 4.27Å; L58-Y62 HydrophobicContact CG-CE1 4.16Å; L58-Y62 HydrophobicContact CG-CE2 3.89Å; L58-Y62 PolarHBondContact O-N 2.95Å; D59-Y62 PolarHBondContact O-N 3.39Å; Y62-N65 WeakPolarHBondContact O-CB 3.34Å; Y62-N65 PolarHBondContact O-N 3.34Å; Y62-E66 WeakPolarHBondContact O-CB 3.5Å; Y62-E66 PolarHBondContact O-N 3.14Å
63L98.3Very high95.7Very high2 Ų242.1 Ų42.11%0.0118%0.18CC..Hα-helixtrans-61.1-47.7170.5179.566.1000111.6F13 L16 L26 I30 D59 L60 F61 N65 E66 V67F13-L63 HydrophobicContact CE1-CD2 4.22Å; F13-L63 HydrophobicContact CE2-CD2 4.13Å; F13-L63 HydrophobicContact CZ-CD2 3.8Å; L16-L63 HydrophobicContact CD2-CB 4.22Å; L16-L63 HydrophobicContact CD2-CD2 4.13Å; L26-L63 HydrophobicContact CB-CD1 3.93Å; L26-L63 HydrophobicContact CD2-CD1 4.11Å; L26-L63 HydrophobicContact CD2-CD2 3.6Å; L26-L63 HydrophobicContact CG-CD1 3.79Å; L26-L63 HydrophobicContact CG-CD2 4.03Å; I30-L63 HydrophobicContact CD1-CD1 4.09Å; I30-L63 HydrophobicContact CD1-CD2 3.93Å; I30-L63 HydrophobicContact CD1-CG 4.19Å; D59-L63 PolarHBondContact O-N 3.3Å; L60-L63 WeakPolarHBondContact O-CB 3.17Å; L60-L63 PolarHBondContact O-N 3.32Å; F61-L63 VanDerWaalsContact C-N 3.33Å; L63-N65 VanDerWaalsContact C-N 3.32Å; L63-N65 PolarHBondContact O-N 3.25Å; L63-E66 PolarHBondContact O-N 2.97Å; L63-V67 HydrophobicContact CD1-CG2 4.36Å; L63-V67 WeakPolarHBondContact O-CG2 3.28Å; L63-V67 PolarHBondContact O-N 3.06Å
64A98Very high94.7Very high0 Ų042.4 Ų42.40%019%0.186CC..Hα-helixtrans-57.4-46.5176.700000111.2W44 L60 F61 E66 V67 V68 F82W44-A64 HydrophobicContact CZ2-CB 3.8Å; L60-A64 PolarHBondContact O-N 3Å; F61-A64 PolarHBondContact O-N 3.38Å; A64-E66 PolarHBondContact O-N 3.26Å; A64-V67 PolarHBondContact O-N 3.07Å; A64-V68 WeakPolarHBondContact O-CG2 3.42Å; A64-V68 PolarHBondContact O-N 3.3Å; A64-F82 HydrophobicContact CB-CD1 3.93Å; A64-F82 HydrophobicContact CB-CE1 3.56Å; A64-F82 HydrophobicContact CB-CZ 4.04Å
65N97.5Very high94Very high24 Ų2443.6 Ų43.613%0.12819%0.189CC..Hα-helixtrans-54.5-49.5174172.561.5000112.5F61 Y62 L63 V67 V68 Q69 T108 W112F61-N65 WeakPolarHBondContact O-CB 3.38Å; F61-N65 PolarHBondContact O-N 3.2Å; Y62-N65 WeakPolarHBondContact O-CB 3.34Å; Y62-N65 PolarHBondContact O-N 3.34Å; L63-N65 VanDerWaalsContact C-N 3.32Å; L63-N65 PolarHBondContact O-N 3.25Å; N65-V67 VanDerWaalsContact C-N 3.3Å; N65-V67 PolarHBondContact O-N 2.89Å; N65-V68 WeakPolarHBondContact O-CG2 3.13Å; N65-V68 PolarHBondContact O-N 2.7Å; N65-Q69 WeakPolarHBondContact O-CB 3.39Å; N65-Q69 WeakPolarHBondContact O-CG 3.4Å; N65-Q69 PolarHBondContact O-N 2.8Å; N65-Q69 PolarHBondContact OD1-NE2 2.93Å; N65-T108 HydrophobicContact CB-CG2 3.8Å; N65-W112 HydrophobicContact CB-CZ2 4.01Å; N65-W112 PolarHBondContact OD1-NE1 3Å
66E97.1Very high93.7Very high41 Ų4142.2 Ų42.219%0.19220%0.195CC..Hα-helixtrans-63.7-38-178.7-164.265.9-168.500111.5I23 Q24 S27 Y62 L63 A64 N70I23-E66 HydrophobicContact CG2-CB 3.77Å; I23-E66 HydrophobicContact CG2-CG 4.05Å; Q24-E66 HydrophobicContact CG-CG 4.46Å; S27-E66 VanDerWaalsContact CB-CG 3.47Å; S27-E66 WeakPolarHBondContact OG-CG 3.28Å; S27-E66 PolarHBondContact OG-O 3.22Å; Y62-E66 WeakPolarHBondContact O-CB 3.5Å; Y62-E66 PolarHBondContact O-N 3.14Å; L63-E66 PolarHBondContact O-N 2.97Å; A64-E66 PolarHBondContact O-N 3.26Å; E66-N70 VanDerWaalsContact CD-ND2 3.28Å; E66-N70 VanDerWaalsContact O-CB 3.31Å; E66-N70 WeakPolarHBondContact O-CB 3.29Å; E66-N70 PolarHBondContact O-N 2.83Å; E66-N70 PolarHBondContact O-ND2 3.46Å; E66-N70 PolarHBondContact OE1-ND2 3.11Å
67V97.3Very high93.5Very high0 Ų042.8 Ų42.80%021%0.205CC..Hα-helixtrans-69.4-50.9177.7174.40000110.8S27 I30 I31 L63 A64 N65 Q69 N70 S71 Y78 F82S27-V67 PolarHBondContact OG-N 3.22Å; I30-V67 HydrophobicContact CB-CG2 4.13Å; I30-V67 HydrophobicContact CD1-CG2 4.11Å; I30-V67 HydrophobicContact CG2-CG1 3.87Å; I30-V67 HydrophobicContact CG2-CG2 3.75Å; I31-V67 HydrophobicContact CG1-CG1 4.34Å; L63-V67 HydrophobicContact CD1-CG2 4.36Å; L63-V67 WeakPolarHBondContact O-CG2 3.28Å; L63-V67 PolarHBondContact O-N 3.06Å; A64-V67 PolarHBondContact O-N 3.07Å; N65-V67 VanDerWaalsContact C-N 3.3Å; N65-V67 PolarHBondContact O-N 2.89Å; V67-Q69 VanDerWaalsContact C-N 3.31Å; V67-Q69 PolarHBondContact O-N 2.85Å; V67-N70 PolarHBondContact O-N 3.47Å; V67-S71 WeakPolarHBondContact O-CB 3.31Å; V67-S71 PolarHBondContact O-N 3.04Å; V67-S71 PolarHBondContact O-OG 2.84Å; V67-Y78 HydrophobicContact CG1-CD1 3.85Å; V67-Y78 HydrophobicContact CG1-CD2 3.97Å; V67-Y78 HydrophobicContact CG1-CE1 4.2Å; V67-Y78 HydrophobicContact CG1-CE2 4.29Å; V67-Y78 HydrophobicContact CG1-CG 3.74Å; V67-F82 HydrophobicContact CB-CE2 4.14Å; V67-F82 HydrophobicContact CG1-CE2 3.82Å
68V96.9Very high93.4Very high0 Ų042.8 Ų42.80%021%0.205CC..Hα-helixtrans-63.6-37.5-177.4-65.60000111.8A64 N65 S71 R72 F82 W112 V117 F118A64-V68 WeakPolarHBondContact O-CG2 3.42Å; A64-V68 PolarHBondContact O-N 3.3Å; N65-V68 WeakPolarHBondContact O-CG2 3.13Å; N65-V68 PolarHBondContact O-N 2.7Å; V68-S71 PolarHBondContact O-OG 3.47Å; V68-R72 WeakPolarHBondContact O-CG 3.22Å; V68-F82 HydrophobicContact CG1-CB 3.64Å; V68-F82 HydrophobicContact CG1-CD2 3.37Å; V68-F82 HydrophobicContact CG1-CE2 4.24Å; V68-F82 HydrophobicContact CG1-CG 3.71Å; V68-W112 HydrophobicContact CG2-CZ2 4.31Å; V68-V117 HydrophobicContact CB-CG1 4.28Å; V68-V117 HydrophobicContact CG2-CG1 4.02Å; V68-F118 HydrophobicContact CG1-CZ 4.15Å
69Q93.5Very high93.3Very high36 Ų3643.6 Ų43.617%0.16821%0.211CC..Hα-helixtrans-73-39.6-179.7-69.3-154.452.400113.2N65 V67 V117N65-Q69 WeakPolarHBondContact O-CB 3.39Å; N65-Q69 WeakPolarHBondContact O-CG 3.4Å; N65-Q69 PolarHBondContact O-N 2.8Å; N65-Q69 PolarHBondContact OD1-NE2 2.93Å; V67-Q69 VanDerWaalsContact C-N 3.31Å; V67-Q69 PolarHBondContact O-N 2.85Å; Q69-V117 HydrophobicContact CG-CG2 4.28Å
70N94Very high93.2Very high86 Ų8647.8 Ų47.846%0.4624%0.237SC..Hα-helixtrans-83.3-19.9-178.3-72-56.8000113.5I31 E66 V67I31-N70 HydrophobicContact CD1-CB 3.48Å; I31-N70 VanDerWaalsContact CD1-CB 3.48Å; E66-N70 VanDerWaalsContact CD-ND2 3.28Å; E66-N70 VanDerWaalsContact O-CB 3.31Å; E66-N70 WeakPolarHBondContact O-CB 3.29Å; E66-N70 PolarHBondContact O-N 2.83Å; E66-N70 PolarHBondContact O-ND2 3.46Å; E66-N70 PolarHBondContact OE1-ND2 3.11Å; V67-N70 PolarHBondContact O-N 3.47Å
71S92.9Very high93.1Very high0 Ų049.9 Ų49.90%025%0.247CC..Hα-helixtrans-85.9-21.3179.360.10000114.1V67 V68 K73 K74 H75 Y78V67-S71 WeakPolarHBondContact O-CB 3.31Å; V67-S71 PolarHBondContact O-N 3.04Å; V67-S71 PolarHBondContact O-OG 2.84Å; V68-S71 PolarHBondContact O-OG 3.47Å; S71-K73 VanDerWaalsContact C-N 3.3Å; S71-K73 PolarHBondContact O-N 3.02Å; S71-K74 PolarHBondContact O-N 3.17Å; S71-H75 WeakPolarHBondContact CB-O 3.46Å; S71-H75 CarbonylContact O-C 3.34Å; S71-H75 VanDerWaalsContact O-C 3.27Å; S71-H75 WeakPolarHBondContact O-CA 3.5Å; S71-H75 PolarHBondContact O-N 3.3Å; S71-Y78 WeakPolarHBondContact OG-CB 3.37Å
72R86.2Confident93Very high99 Ų9950 Ų5037%0.37425%0.248SC..THydrogen-bonded Turntrans-44.2-46.4-170.3-56.9-176.761-174.53.1115.8V68 V79 R115 K116V68-R72 WeakPolarHBondContact O-CG 3.22Å; R72-V79 HydrophobicContact CG-CG2 4.06Å; R72-R115 PolarHBondContact NH1-O 2.86Å; R72-K116 PolarHBondContact NH2-O 3.42Å
73K79.2Confident92.9Very high206 Ų20649.9 Ų49.990%0.89625%0.25SC*.THydrogen-bonded Turntrans-79.9-37.8-178-72.3-172.5177.9-177.30113S71S71-K73 VanDerWaalsContact C-N 3.3Å; S71-K73 PolarHBondContact O-N 3.02Å
74K77.2Confident92.8Very high161 Ų16150.9 Ų50.970%0.726%0.261SS*.THydrogen-bonded Turntrans-91.1-38.2-171.1-67.4-172.7178.1-1790112.2S71S71-K74 PolarHBondContact O-N 3.17Å
75H83.4Confident92.7Very high43 Ų4351.7 Ų51.720%0.19927%0.266CS..  trans-14776.1-171.9-65.3-56.7000110.8R34 S71 A77 Y78R34-H75 HydrophobicContact CB-CB 4.23Å; R34-H75 VanDerWaalsContact CD-CD2 3.4Å; R34-H75 WeakPolarHBondContact CD-CD2 3.31Å; R34-H75 WeakPolarHBondContact CD-CE1 3.31Å; R34-H75 WeakPolarHBondContact CD-NE2 3.32Å; R34-H75 HydrophobicContact CG-CB 4.38Å; R34-H75 VanDerWaalsContact CG-CG 3.48Å; R34-H75 VanDerWaalsContact CG-ND1 3.35Å; R34-H75 WeakPolarHBondContact CG-ND1 3.43Å; R34-H75 VanDerWaalsContact CZ-CE1 3.45Å; R34-H75 VanDerWaalsContact CZ-NE2 3.28Å; R34-H75 PolarHBondContact NE-CE1 2.79Å; R34-H75 PolarHBondContact NE-NE2 2.83Å; S71-H75 WeakPolarHBondContact CB-O 3.46Å; S71-H75 CarbonylContact O-C 3.34Å; S71-H75 VanDerWaalsContact O-C 3.27Å; S71-H75 WeakPolarHBondContact O-CA 3.5Å; S71-H75 PolarHBondContact O-N 3.3Å; H75-A77 PolarHBondContact O-N 2.59Å; H75-A77 VanDerWaalsContact O-N 3.12Å; H75-Y78 HydrophobicContact CB-CD2 4.33Å; H75-Y78 PolarHBondContact O-N 2.89Å
76P89.6Confident92.7Very high81 Ų8150.6 Ų50.653%0.52626%0.26SS..THydrogen-bonded Turntrans-63.3-18.3-17725.2-34.1000113.6Y78 V79P76-Y78 PolarHBondContact O-N 2.88Å; P76-V79 WeakPolarHBondContact O-CB 3.22Å; P76-V79 PolarHBondContact O-N 2.72Å
77A93.2Very high92.6Very high40 Ų4048.9 Ų48.933%0.33125%0.252SS..Hα-helixtrans-53.7-36178.900000113.3D37 H75 V79 T80 L81D37-A77 VanDerWaalsContact OD2-CB 3.28Å; D37-A77 WeakPolarHBondContact OD2-CB 3.18Å; H75-A77 PolarHBondContact O-N 2.59Å; H75-A77 VanDerWaalsContact O-N 3.12Å; A77-V79 VanDerWaalsContact C-N 3.28Å; A77-V79 PolarHBondContact O-N 2.84Å; A77-T80 PolarHBondContact O-N 2.96Å; A77-L81 WeakPolarHBondContact O-CB 3.47Å; A77-L81 VanDerWaalsContact O-CG 3.28Å; A77-L81 WeakPolarHBondContact O-CG 3.26Å; A77-L81 PolarHBondContact O-N 3.46Å
78Y96.3Very high92.5Very high0 Ų050.9 Ų50.90%026%0.261CS..Hα-helixtrans-60.5-36.4176.2-83.9-59.1000112.7I30 R34 D37 I40 V41 V67 S71 H75 P76 L81 F82I30-Y78 HydrophobicContact CG2-CE1 3.98Å; I30-Y78 HydrophobicContact CG2-CE2 4.29Å; I30-Y78 VanDerWaalsContact CG2-OH 3.29Å; I30-Y78 WeakPolarHBondContact CG2-OH 3.47Å; I30-Y78 PolarHBondContact O-OH 3.06Å; R34-Y78 HydrophobicContact CB-CE2 3.74Å; D37-Y78 HydrophobicContact CB-CD1 4.02Å; D37-Y78 HydrophobicContact CB-CE1 3.53Å; D37-Y78 HydrophobicContact CB-CE2 4.31Å; I40-Y78 WeakPolarHBondContact CD1-OH 3.34Å; V41-Y78 HydrophobicContact CG2-CD1 4.05Å; V41-Y78 HydrophobicContact CG2-CE1 4.22Å; V67-Y78 HydrophobicContact CG1-CD1 3.85Å; V67-Y78 HydrophobicContact CG1-CD2 3.97Å; V67-Y78 HydrophobicContact CG1-CE1 4.2Å; V67-Y78 HydrophobicContact CG1-CE2 4.29Å; V67-Y78 HydrophobicContact CG1-CG 3.74Å; S71-Y78 WeakPolarHBondContact OG-CB 3.37Å; H75-Y78 HydrophobicContact CB-CD2 4.33Å; H75-Y78 PolarHBondContact O-N 2.89Å; P76-Y78 PolarHBondContact O-N 2.88Å; Y78-L81 PolarHBondContact O-N 3.03Å; Y78-F82 HydrophobicContact CD1-CD2 4.34Å; Y78-F82 AromaticContact CD1-CE2 3.98Å; Y78-F82 HydrophobicContact CD1-CE2 3.98Å; Y78-F82 WeakPolarHBondContact O-CB 3.41Å; Y78-F82 VanDerWaalsContact O-CD2 3.25Å; Y78-F82 WeakPolarHBondContact O-CD2 3.17Å; Y78-F82 PolarHBondContact O-N 3.38Å
79V95.7Very high92.5Very high20 Ų2050.9 Ų50.912%0.12126%0.261CS..Hα-helixtrans-62.2-51.5177.3-177.10000109.1R72 P76 A77 L81 F82 E83 V117 F118R72-V79 HydrophobicContact CG-CG2 4.06Å; P76-V79 WeakPolarHBondContact O-CB 3.22Å; P76-V79 PolarHBondContact O-N 2.72Å; A77-V79 VanDerWaalsContact C-N 3.28Å; A77-V79 PolarHBondContact O-N 2.84Å; V79-L81 VanDerWaalsContact C-N 3.33Å; V79-L81 PolarHBondContact O-N 3.35Å; V79-F82 PolarHBondContact O-N 2.91Å; V79-E83 WeakPolarHBondContact O-CB 3.38Å; V79-E83 PolarHBondContact O-N 3.41Å; V79-V117 WeakPolarHBondContact CG1-O 3.16Å; V79-F118 HydrophobicContact CG1-CD1 3.96Å; V79-F118 HydrophobicContact CG1-CE1 3.62Å; V79-F118 HydrophobicContact CG1-CZ 4.48Å; V79-F118 WeakPolarHBondContact O-CE1 3.21Å
80T94.9Very high92.7Very high98 Ų9849.1 Ų49.160%0.60125%0.253SS*.Hα-helixtrans-62.5-38.9-179.9-42.40000112.6A77 G84A77-T80 PolarHBondContact O-N 2.96Å; T80-G84 PolarHBondContact O-N 3.17Å
81L96.6Very high92.8Very high43 Ų4350.3 Ų50.323%0.22525%0.252CS..Hα-helixtrans-68.4-47.2178.6-70.9170.5000111.9D37 R38 V41 A77 Y78 V79 G84D37-L81 HydrophobicContact CB-CD1 3.63Å; D37-L81 VanDerWaalsContact CG-CD1 3.45Å; R38-L81 HydrophobicContact CG-CD1 4.08Å; R38-L81 HydrophobicContact CG-CD2 3.87Å; V41-L81 HydrophobicContact CB-CB 4.39Å; V41-L81 HydrophobicContact CG1-CB 4.23Å; V41-L81 HydrophobicContact CG2-CB 3.93Å; V41-L81 HydrophobicContact CG2-CD1 4.35Å; A77-L81 WeakPolarHBondContact O-CB 3.47Å; A77-L81 VanDerWaalsContact O-CG 3.28Å; A77-L81 WeakPolarHBondContact O-CG 3.26Å; A77-L81 PolarHBondContact O-N 3.46Å; Y78-L81 PolarHBondContact O-N 3.03Å; V79-L81 VanDerWaalsContact C-N 3.33Å; V79-L81 PolarHBondContact O-N 3.35Å; L81-G84 PolarHBondContact O-N 3.23Å; L81-G84 VanDerWaalsContact O-N 3.16Å
82F97.7Very high92.9Very high4 Ų452.8 Ų52.82%0.01827%0.269CS..Hα-helixtrans-65.9-38.6177.8-85.4-69.4000112.2V41 W44 A64 V67 V68 Y78 V79 G84 V85 L86 F118V41-F82 HydrophobicContact CG2-CD2 4.17Å; V41-F82 HydrophobicContact CG2-CE1 4.41Å; V41-F82 HydrophobicContact CG2-CE2 3.88Å; V41-F82 HydrophobicContact CG2-CZ 4.02Å; W44-F82 AromaticContact CD2-CE1 3.75Å; W44-F82 HydrophobicContact CD2-CE1 3.75Å; W44-F82 HydrophobicContact CE3-CD1 4.29Å; W44-F82 AromaticContact CE3-CE1 3.84Å; W44-F82 HydrophobicContact CE3-CE1 3.84Å; W44-F82 HydrophobicContact CG-CE1 4.12Å; W44-F82 HydrophobicContact CZ3-CD1 4.35Å; W44-F82 HydrophobicContact CZ3-CE1 4.29Å; A64-F82 HydrophobicContact CB-CD1 3.93Å; A64-F82 HydrophobicContact CB-CE1 3.56Å; A64-F82 HydrophobicContact CB-CZ 4.04Å; V67-F82 HydrophobicContact CB-CE2 4.14Å; V67-F82 HydrophobicContact CG1-CE2 3.82Å; V68-F82 HydrophobicContact CG1-CB 3.64Å; V68-F82 HydrophobicContact CG1-CD2 3.37Å; V68-F82 HydrophobicContact CG1-CE2 4.24Å; V68-F82 HydrophobicContact CG1-CG 3.71Å; Y78-F82 HydrophobicContact CD1-CD2 4.34Å; Y78-F82 AromaticContact CD1-CE2 3.98Å; Y78-F82 HydrophobicContact CD1-CE2 3.98Å; Y78-F82 WeakPolarHBondContact O-CB 3.41Å; Y78-F82 VanDerWaalsContact O-CD2 3.25Å; Y78-F82 WeakPolarHBondContact O-CD2 3.17Å; Y78-F82 PolarHBondContact O-N 3.38Å; V79-F82 PolarHBondContact O-N 2.91Å; F82-G84 PolarHBondContact O-N 3.09Å; F82-V85 HydrophobicContact CD1-CG2 4.33Å; F82-V85 PolarHBondContact O-N 3.27Å; F82-V85 VanDerWaalsContact O-N 3.1Å; F82-L86 HydrophobicContact CB-CD1 4.04Å; F82-L86 HydrophobicContact CB-CG 4.38Å; F82-L86 VanDerWaalsContact O-CB 3.26Å; F82-L86 WeakPolarHBondContact O-CB 3.38Å; F82-L86 WeakPolarHBondContact O-CD1 3.38Å; F82-L86 WeakPolarHBondContact O-CG 3.34Å; F82-L86 PolarHBondContact O-N 3.28Å; F82-F118 HydrophobicContact CB-CZ 4.33Å
83E95.8Very high93.4Very high63 Ų6348.2 Ų48.229%0.29425%0.252SS..Hα-helixtrans-54.1-40.9172.2-169.2175.1-171.100111.1V79 V85 F118 P119 F122V79-E83 WeakPolarHBondContact O-CB 3.38Å; V79-E83 PolarHBondContact O-N 3.41Å; E83-V85 VanDerWaalsContact C-N 3.26Å; E83-V85 PolarHBondContact O-N 3.07Å; E83-F118 HydrophobicContact CB-CD1 3.92Å; E83-F118 HydrophobicContact CB-CE1 3.69Å; E83-F118 HydrophobicContact CG-CD1 4.05Å; E83-F118 HydrophobicContact CG-CE1 4.33Å; E83-P119 WeakPolarHBondContact OE1-CD 3.29Å; E83-F122 HydrophobicContact CB-CZ 4.41Å; E83-F122 HydrophobicContact CG-CD1 4.26Å; E83-F122 HydrophobicContact CG-CD2 3.87Å; E83-F122 HydrophobicContact CG-CE1 4.17Å; E83-F122 HydrophobicContact CG-CE2 3.79Å; E83-F122 HydrophobicContact CG-CG 4.09Å; E83-F122 HydrophobicContact CG-CZ 3.94Å; E83-F122 WeakPolarHBondContact O-CE2 3.31Å; E83-F122 WeakPolarHBondContact O-CZ 3.39Å
84G95.6Very high94.2Very high24 Ų2439.3 Ų39.325%0.24722%0.215CC..Hα-helixtrans-67.8-16179.800000116.1T80 L81 F82T80-G84 PolarHBondContact O-N 3.17Å; L81-G84 PolarHBondContact O-N 3.23Å; L81-G84 VanDerWaalsContact O-N 3.16Å; F82-G84 PolarHBondContact O-N 3.09Å
85V96.4Very high95.1Very high17 Ų1741.2 Ų41.210%0.10322%0.223CC..Hα-helixtrans-126-16.3-173.5-58.50000114.6V41 W44 L45 F82 E83 E87 E88 A89V41-V85 HydrophobicContact CG1-CG1 4.16Å; V41-V85 HydrophobicContact CG1-CG2 3.6Å; W44-V85 HydrophobicContact CE3-CG2 4.24Å; W44-V85 HydrophobicContact CZ3-CG2 3.91Å; L45-V85 HydrophobicContact CD1-CB 4.34Å; L45-V85 HydrophobicContact CD2-CB 4.03Å; L45-V85 HydrophobicContact CD2-CG1 3.91Å; F82-V85 HydrophobicContact CD1-CG2 4.33Å; F82-V85 PolarHBondContact O-N 3.27Å; F82-V85 VanDerWaalsContact O-N 3.1Å; E83-V85 VanDerWaalsContact C-N 3.26Å; E83-V85 PolarHBondContact O-N 3.07Å; V85-E87 PolarHBondContact O-N 3.21Å; V85-E88 WeakPolarHBondContact O-CB 3.34Å; V85-E88 PolarHBondContact O-N 3.38Å; V85-A89 WeakPolarHBondContact O-CB 3.48Å; V85-A89 PolarHBondContact O-N 3.07Å
86L97.3Very high95.7Very high0 Ų041.5 Ų41.50%023%0.229CC..Hα-helixtrans-66.2-38.9-171.8-92.3167.1000113.5W44 F61 F82 A89 L90 W112 F118 F122 L126W44-L86 HydrophobicContact CH2-CD2 3.88Å; W44-L86 HydrophobicContact CZ2-CD2 4.5Å; F61-L86 HydrophobicContact CD1-CD2 3.97Å; F61-L86 HydrophobicContact CE1-CD2 3.65Å; F82-L86 HydrophobicContact CB-CD1 4.04Å; F82-L86 HydrophobicContact CB-CG 4.38Å; F82-L86 VanDerWaalsContact O-CB 3.26Å; F82-L86 WeakPolarHBondContact O-CB 3.38Å; F82-L86 WeakPolarHBondContact O-CD1 3.38Å; F82-L86 WeakPolarHBondContact O-CG 3.34Å; F82-L86 PolarHBondContact O-N 3.28Å; L86-A89 PolarHBondContact O-N 2.95Å; L86-L90 VanDerWaalsContact O-CB 3.3Å; L86-L90 WeakPolarHBondContact O-CB 3.41Å; L86-L90 PolarHBondContact O-N 3.24Å; L86-W112 HydrophobicContact CD1-CH2 3.65Å; L86-W112 HydrophobicContact CD1-CZ3 3.78Å; L86-W112 HydrophobicContact CD2-CH2 3.82Å; L86-W112 HydrophobicContact CD2-CZ3 4.31Å; L86-W112 HydrophobicContact CG-CH2 4.42Å; L86-F118 HydrophobicContact CD1-CE2 3.62Å; L86-F118 HydrophobicContact CD1-CZ 3.6Å; L86-F122 HydrophobicContact CB-CE1 4.45Å; L86-F122 HydrophobicContact CB-CZ 3.84Å; L86-F122 HydrophobicContact CD1-CE1 4.34Å; L86-F122 HydrophobicContact CD1-CZ 4.43Å; L86-L126 HydrophobicContact CB-CD2 4.32Å
87E95.7Very high96Very high6 Ų638.4 Ų38.43%0.02821%0.209CC..Hα-helixtrans-62.6-45.1174.7-75.8-175.3157.700111.2V85 L90 Y91 F122 L126 I129 S137 W139V85-E87 PolarHBondContact O-N 3.21Å; E87-L90 PolarHBondContact O-N 3.34Å; E87-Y91 VanDerWaalsContact O-CB 3.3Å; E87-Y91 WeakPolarHBondContact O-CB 3.36Å; E87-Y91 PolarHBondContact O-N 2.91Å; E87-F122 HydrophobicContact CG-CD2 4.34Å; E87-F122 HydrophobicContact CG-CE2 3.73Å; E87-F122 HydrophobicContact CG-CZ 4.32Å; E87-L126 HydrophobicContact CB-CD2 4.45Å; E87-L126 HydrophobicContact CG-CD2 3.88Å; E87-L126 HydrophobicContact CG-CG 4.5Å; E87-I129 HydrophobicContact CB-CD1 3.78Å; E87-I129 HydrophobicContact CG-CD1 3.93Å; E87-S137 VanDerWaalsContact CD-OG 3.24Å; E87-S137 WeakPolarHBondContact OE1-CB 3.43Å; E87-S137 PolarHBondContact OE1-OG 3.38Å; E87-S137 PolarHBondContact OE2-OG 3.46Å; E87-W139 HydrophobicContact CB-CG 4.27Å
88E95Very high96.2Very high41 Ų4139.9 Ų39.919%0.19221%0.211CC..Hα-helixtrans-59.9-51.8176.3178160.1-161.700111.7L45 R49 V85 L90 Y91 S92 W139L45-E88 HydrophobicContact CD1-CG 4.23Å; R49-E88 IonicContact CZ-OE1 3.45Å; R49-E88 IonicContact NE-OE1 3.55Å; R49-E88 PolarHBondContact NE-OE1 3.12Å; R49-E88 IonicContact NH2-OE1 3.51Å; R49-E88 PolarHBondContact NH2-OE1 2.89Å; R49-E88 IonicContact NH2-OE2 2.69Å; R49-E88 PolarHBondContact NH2-OE2 3.09Å; R49-E88 VanDerWaalsContact NH2-OE2 3.17Å; V85-E88 WeakPolarHBondContact O-CB 3.34Å; V85-E88 PolarHBondContact O-N 3.38Å; E88-L90 VanDerWaalsContact C-N 3.32Å; E88-L90 PolarHBondContact O-N 3.43Å; E88-Y91 PolarHBondContact O-N 3.44Å; E88-S92 PolarHBondContact O-N 3.16Å; E88-W139 HydrophobicContact CB-CD2 4.3Å; E88-W139 HydrophobicContact CB-CE3 3.51Å; E88-W139 HydrophobicContact CB-CH2 3.66Å; E88-W139 HydrophobicContact CB-CZ2 4.42Å; E88-W139 HydrophobicContact CB-CZ3 3.18Å; E88-W139 HydrophobicContact CG-CE3 4.03Å; E88-W139 HydrophobicContact CG-CH2 3.58Å; E88-W139 HydrophobicContact CG-CZ3 3.2Å
89A96.7Very high96.3Very high0 Ų043.4 Ų43.40%024%0.24CC..Hα-helixtrans-55.5-51.2-179.600000109.8W44 L45 V48 F61 V85 L86 Y91 S92 V93W44-A89 HydrophobicContact CH2-CB 3.49Å; W44-A89 VanDerWaalsContact CH2-CB 3.49Å; W44-A89 HydrophobicContact CZ3-CB 3.54Å; L45-A89 HydrophobicContact CD1-CB 3.73Å; V48-A89 HydrophobicContact CG1-CB 4Å; F61-A89 HydrophobicContact CZ-CB 4.15Å; V85-A89 WeakPolarHBondContact O-CB 3.48Å; V85-A89 PolarHBondContact O-N 3.07Å; L86-A89 PolarHBondContact O-N 2.95Å; A89-Y91 PolarHBondContact O-N 2.86Å; A89-S92 PolarHBondContact O-N 3.37Å; A89-S92 PolarHBondContact O-OG 3.17Å; A89-V93 WeakPolarHBondContact O-CG2 3.35Å; A89-V93 PolarHBondContact O-N 3.17Å
90L97Very high96.3Very high0 Ų047.6 Ų47.60%026%0.258CS..Hα-helixtrans-62.7-46.3-179.3-177.459.5000111.8F61 L86 E87 E88 S92 V93 V94 L97 L105 F109 L126 I129 A130F61-L90 HydrophobicContact CE1-CB 4.35Å; F61-L90 HydrophobicContact CZ-CB 4.02Å; F61-L90 HydrophobicContact CZ-CD1 4.21Å; L86-L90 VanDerWaalsContact O-CB 3.3Å; L86-L90 WeakPolarHBondContact O-CB 3.41Å; L86-L90 PolarHBondContact O-N 3.24Å; E87-L90 PolarHBondContact O-N 3.34Å; E88-L90 VanDerWaalsContact C-N 3.32Å; E88-L90 PolarHBondContact O-N 3.43Å; L90-S92 PolarHBondContact O-N 2.89Å; L90-V93 PolarHBondContact O-N 3.2Å; L90-V94 HydrophobicContact CD1-CB 4.48Å; L90-V94 VanDerWaalsContact O-CB 3.32Å; L90-V94 WeakPolarHBondContact O-CB 3.4Å; L90-V94 PolarHBondContact O-N 3.48Å; L90-L97 HydrophobicContact CD1-CD1 4.45Å; L90-L105 HydrophobicContact CD1-CD2 3.56Å; L90-F109 HydrophobicContact CD2-CE2 4.17Å; L90-F109 HydrophobicContact CD2-CZ 3.73Å; L90-L126 HydrophobicContact CB-CD2 4.46Å; L90-L126 HydrophobicContact CD2-CB 4.21Å; L90-L126 HydrophobicContact CD2-CD2 3.91Å; L90-L126 WeakPolarHBondContact CD2-O 3.48Å; L90-I129 HydrophobicContact CB-CG2 4.24Å; L90-I129 HydrophobicContact CD2-CB 4.02Å; L90-I129 HydrophobicContact CD2-CG2 3.96Å; L90-I129 HydrophobicContact CG-CB 4.34Å; L90-I129 HydrophobicContact CG-CG2 3.71Å; L90-A130 HydrophobicContact CD2-CB 4.47Å
91Y95.5Very high96.5Very high111 Ų11143.6 Ų43.644%0.43523%0.233SC..Hα-helixtrans-58.7-38.2179.4-176.6-96.2000111.8E87 E88 A89 V93 I129 P135 W139E87-Y91 VanDerWaalsContact O-CB 3.3Å; E87-Y91 WeakPolarHBondContact O-CB 3.36Å; E87-Y91 PolarHBondContact O-N 2.91Å; E88-Y91 PolarHBondContact O-N 3.44Å; A89-Y91 PolarHBondContact O-N 2.86Å; Y91-V93 VanDerWaalsContact C-N 3.32Å; Y91-V93 PolarHBondContact O-N 2.79Å; Y91-I129 HydrophobicContact CD2-CG2 4.21Å; Y91-P135 HydrophobicContact CD2-CG 4.13Å; Y91-W139 HydrophobicContact CD1-CZ2 4.26Å; Y91-W139 HydrophobicContact CG-CZ2 4.28Å
92S95.3Very high96.6Very high52 Ų5242.8 Ų42.836%0.36423%0.228SC..Hα-helixtrans-66.9-29.5-179.8730000114E88 A89 L90E88-S92 PolarHBondContact O-N 3.16Å; A89-S92 PolarHBondContact O-N 3.37Å; A89-S92 PolarHBondContact O-OG 3.17Å; L90-S92 PolarHBondContact O-N 2.89Å
93V96.7Very high96.6Very high2 Ų246.8 Ų46.81%0.01225%0.25CC..Hα-helixtrans-119.7-2.8-172.1-58.30000115.1V48 I57 F61 A89 L90 Y91 K95 C96 L97V48-V93 HydrophobicContact CG1-CB 4.44Å; V48-V93 HydrophobicContact CG1-CG1 3.63Å; V48-V93 HydrophobicContact CG1-CG2 3.95Å; V48-V93 WeakPolarHBondContact O-CG1 3.45Å; I57-V93 HydrophobicContact CD1-CB 3.9Å; I57-V93 HydrophobicContact CD1-CG1 4.38Å; I57-V93 HydrophobicContact CD1-CG2 4.47Å; I57-V93 HydrophobicContact CG1-CB 4.31Å; I57-V93 HydrophobicContact CG2-CB 4.19Å; I57-V93 HydrophobicContact CG2-CG2 3.55Å; F61-V93 HydrophobicContact CE2-CG2 4.05Å; A89-V93 WeakPolarHBondContact O-CG2 3.35Å; A89-V93 PolarHBondContact O-N 3.17Å; L90-V93 PolarHBondContact O-N 3.2Å; Y91-V93 VanDerWaalsContact C-N 3.32Å; Y91-V93 PolarHBondContact O-N 2.79Å; V93-K95 PolarHBondContact O-N 3.32Å; V93-K95 VanDerWaalsContact O-N 3.12Å; V93-C96 WeakPolarHBondContact O-CA 3.25Å; V93-C96 WeakPolarHBondContact O-CB 3.48Å; V93-C96 PolarHBondContact O-N 3.15Å; V93-L97 PolarHBondContact O-N 3.35Å
94V96.3Very high96.7Very high20 Ų2046.5 Ų46.512%0.12125%0.248CC..G310 helixtrans-56.7-34.9-174.668.80000112.4L90 C96 L97 L102L90-V94 HydrophobicContact CD1-CB 4.48Å; L90-V94 VanDerWaalsContact O-CB 3.32Å; L90-V94 WeakPolarHBondContact O-CB 3.4Å; L90-V94 PolarHBondContact O-N 3.48Å; V94-C96 PolarHBondContact O-N 3.16Å; V94-L97 PolarHBondContact O-N 2.73Å; V94-L102 HydrophobicContact CG2-CD1 4.18Å
95K95.6Very high96.7Very high201 Ų20145.4 Ų45.487%0.87424%0.236SC*.G310 helixtrans-70.8-19.1177.4-62.4-176-179.3179.90113.6V93V93-K95 PolarHBondContact O-N 3.32Å; V93-K95 VanDerWaalsContact O-N 3.12Å
96C96.6Very high96.8Very high48 Ų4847.7 Ų47.732%0.32425%0.245SC..G310 helixtrans-89.1-5.7177.4-57.80000112.4S54 I57 V93 V94S54-C96 WeakPolarHBondContact CA-O 3.19Å; S54-C96 VanDerWaalsContact CB-O 3.22Å; S54-C96 WeakPolarHBondContact CB-O 3.38Å; I57-C96 HydrophobicContact CD1-CB 3.54Å; V93-C96 WeakPolarHBondContact O-CA 3.25Å; V93-C96 WeakPolarHBondContact O-CB 3.48Å; V93-C96 PolarHBondContact O-N 3.15Å; V94-C96 PolarHBondContact O-N 3.16Å
97L96.8Very high96.8Very high17 Ų1756.1 Ų56.19%0.08928%0.277CS..  trans-88.2129.1177.2-72.3168.9000111.3S54 I57 L90 V93 V94 H101 L102 L105S54-L97 WeakPolarHBondContact OG-CA 3.46Å; I57-L97 HydrophobicContact CB-CD2 4.01Å; I57-L97 HydrophobicContact CG2-CD1 4.37Å; I57-L97 HydrophobicContact CG2-CD2 3.75Å; I57-L97 HydrophobicContact CG2-CG 4.14Å; L90-L97 HydrophobicContact CD1-CD1 4.45Å; V93-L97 PolarHBondContact O-N 3.35Å; V94-L97 PolarHBondContact O-N 2.73Å; L97-H101 HydrophobicContact CD2-CB 4.01Å; L97-L102 HydrophobicContact CB-CB 4.23Å; L97-L102 HydrophobicContact CD1-CD1 3.95Å; L97-L105 HydrophobicContact CD1-CD2 3.87Å
98N97.1Very high96.9Very high70 Ų7056.4 Ų56.437%0.37428%0.278SS..  trans-73.3165.2167.37224.3000110.9S54 E100 H101 L102S54-N98 PolarHBondContact OG-N 2.88Å; N98-E100 VanDerWaalsContact C-N 3.29Å; N98-E100 PolarHBondContact O-N 3.36Å; N98-E100 PolarHBondContact OD1-N 3.49Å; N98-H101 PolarHBondContact ND2-ND1 2.89Å; N98-H101 PolarHBondContact O-N 3.27Å; N98-H101 WeakPolarHBondContact OD1-CB 3.45Å; N98-H101 VanDerWaalsContact OD1-CG 3.24Å; N98-H101 PolarHBondContact OD1-N 2.98Å; N98-H101 PolarHBondContact OD1-ND1 3.33Å; N98-H101 VanDerWaalsContact OD1-ND1 3.16Å; N98-L102 WeakPolarHBondContact O-CB 3.19Å; N98-L102 PolarHBondContact O-N 2.76Å
99A97.1Very high97Very high74 Ų7454.4 Ų54.461%0.61227%0.269SS*.Hα-helixtrans-58.9-38.1-175.800000113.3N103A99-N103 WeakPolarHBondContact O-CB 3.35Å; A99-N103 VanDerWaalsContact O-CG 3.32Å; A99-N103 PolarHBondContact O-N 2.94Å; A99-N103 PolarHBondContact O-ND2 3.16Å
100E97.8Very high97.1Very high109 Ų10958 Ų5851%0.50929%0.288SS..Hα-helixtrans-64.1-51.1179.1-170.9-160.7146.300111.7N98 N103 K104N98-E100 VanDerWaalsContact C-N 3.29Å; N98-E100 PolarHBondContact O-N 3.36Å; N98-E100 PolarHBondContact OD1-N 3.49Å; E100-N103 PolarHBondContact O-N 3.41Å; E100-K104 WeakPolarHBondContact O-CG 3.41Å; E100-K104 PolarHBondContact O-N 2.65Å; E100-K104 WeakPolarHBondContact OE1-CE 3.41Å; E100-K104 IonicContact OE1-NZ 3.75Å; E100-K104 PolarHBondContact OE1-NZ 3Å
101H98.1Very high97.1Very high14 Ų1460.1 Ų60.17%0.06530%0.301CS..Hα-helixtrans-69.7-35.4-179.1-63.8144.8000111.9S54 L58 L97 N98 K104 L105S54-H101 WeakPolarHBondContact CB-ND1 3.35Å; S54-H101 PolarHBondContact OG-ND1 2.99Å; L58-H101 HydrophobicContact CB-CB 4.39Å; L58-H101 HydrophobicContact CD2-CB 4.12Å; L97-H101 HydrophobicContact CD2-CB 4.01Å; N98-H101 PolarHBondContact ND2-ND1 2.89Å; N98-H101 PolarHBondContact O-N 3.27Å; N98-H101 WeakPolarHBondContact OD1-CB 3.45Å; N98-H101 VanDerWaalsContact OD1-CG 3.24Å; N98-H101 PolarHBondContact OD1-N 2.98Å; N98-H101 PolarHBondContact OD1-ND1 3.33Å; N98-H101 VanDerWaalsContact OD1-ND1 3.16Å; H101-K104 WeakPolarHBondContact O-CB 3.26Å; H101-K104 PolarHBondContact O-N 3.03Å; H101-L105 PolarHBondContact O-N 3.36Å
102L97.8Very high97.2Very high26 Ų2654.9 Ų54.914%0.13628%0.281CS..Hα-helixtrans-63.8-40.9173.7-174.162.7000111.7V94 L97 N98 L105 K106 A130V94-L102 HydrophobicContact CG2-CD1 4.18Å; L97-L102 HydrophobicContact CB-CB 4.23Å; L97-L102 HydrophobicContact CD1-CD1 3.95Å; N98-L102 WeakPolarHBondContact O-CB 3.19Å; N98-L102 PolarHBondContact O-N 2.76Å; L102-L105 PolarHBondContact O-N 3.1Å; L102-K106 WeakPolarHBondContact O-CG 3.44Å; L102-K106 PolarHBondContact O-N 3.24Å; L102-A130 HydrophobicContact CD1-CB 4.07Å
103N98Very high97.2Very high87 Ų8755.4 Ų55.447%0.46528%0.277SS..Hα-helixtrans-65.8-38.1174.9-79.1-20.1000112.3A99 E100 L105 K106 R107A99-N103 WeakPolarHBondContact O-CB 3.35Å; A99-N103 VanDerWaalsContact O-CG 3.32Å; A99-N103 PolarHBondContact O-N 2.94Å; A99-N103 PolarHBondContact O-ND2 3.16Å; E100-N103 PolarHBondContact O-N 3.41Å; N103-L105 VanDerWaalsContact C-N 3.32Å; N103-K106 PolarHBondContact O-N 3.35Å; N103-R107 WeakPolarHBondContact O-CG 3.4Å; N103-R107 PolarHBondContact O-N 2.92Å
104K97.7Very high97.2Very high58 Ų5862.6 Ų62.625%0.25231%0.313SS..Hα-helixtrans-60.8-42171.4-77.2173176.2169.70111.7L58 E100 H101 R107 T108L58-K104 HydrophobicContact CD1-CB 4.09Å; L58-K104 HydrophobicContact CD2-CB 4.06Å; L58-K104 HydrophobicContact CD2-CD 3.78Å; E100-K104 WeakPolarHBondContact O-CG 3.41Å; E100-K104 PolarHBondContact O-N 2.65Å; E100-K104 WeakPolarHBondContact OE1-CE 3.41Å; E100-K104 IonicContact OE1-NZ 3.75Å; E100-K104 PolarHBondContact OE1-NZ 3Å; H101-K104 WeakPolarHBondContact O-CB 3.26Å; H101-K104 PolarHBondContact O-N 3.03Å; K104-R107 WeakPolarHBondContact O-CB 3.42Å; K104-R107 PolarHBondContact O-N 2.9Å; K104-T108 PolarHBondContact O-N 2.92Å; K104-T108 PolarHBondContact O-OG1 3.07Å
105L97.1Very high97.2Very high1 Ų168.5 Ų68.51%0.00533%0.333CS..Hα-helixtrans-66.4-39.5177.7-167.267000112.6L58 F61 L90 L97 H101 L102 N103 R107 T108 F109L58-L105 HydrophobicContact CD1-CB 4.25Å; L58-L105 HydrophobicContact CD1-CD1 4.34Å; F61-L105 HydrophobicContact CB-CD1 3.36Å; F61-L105 HydrophobicContact CD1-CD1 3.65Å; F61-L105 HydrophobicContact CD1-CD2 4.26Å; F61-L105 HydrophobicContact CD2-CD1 4.42Å; F61-L105 HydrophobicContact CE1-CD2 4.42Å; F61-L105 HydrophobicContact CG-CD1 3.56Å; F61-L105 HydrophobicContact CG-CD2 4.33Å; L90-L105 HydrophobicContact CD1-CD2 3.56Å; L97-L105 HydrophobicContact CD1-CD2 3.87Å; H101-L105 PolarHBondContact O-N 3.36Å; L102-L105 PolarHBondContact O-N 3.1Å; N103-L105 VanDerWaalsContact C-N 3.32Å; L105-R107 VanDerWaalsContact C-N 3.29Å; L105-R107 PolarHBondContact O-N 3.45Å; L105-T108 WeakPolarHBondContact O-CA 3.44Å; L105-T108 WeakPolarHBondContact O-CB 3.29Å; L105-T108 PolarHBondContact O-N 3.12Å; L105-F109 HydrophobicContact CD1-CE1 4.38Å; L105-F109 HydrophobicContact CD2-CE1 4.47Å; L105-F109 HydrophobicContact CD2-CZ 3.92Å; L105-F109 HydrophobicContact CG-CE1 3.95Å; L105-F109 HydrophobicContact CG-CZ 3.71Å; L105-F109 PolarHBondContact O-N 3.47Å
106K97.7Very high97.2Very high64 Ų6467 Ų6728%0.27833%0.326SS..Hα-helixtrans-58-40.5174.2-74.3173.1179.5174.80112.2L102 N103 T108 F109 D110 A130L102-K106 WeakPolarHBondContact O-CG 3.44Å; L102-K106 PolarHBondContact O-N 3.24Å; N103-K106 PolarHBondContact O-N 3.35Å; K106-T108 PolarHBondContact O-N 3.34Å; K106-F109 VanDerWaalsContact O-CB 3.3Å; K106-F109 WeakPolarHBondContact O-CB 3.44Å; K106-F109 PolarHBondContact O-N 2.97Å; K106-D110 PolarHBondContact O-N 3.39Å; K106-A130 HydrophobicContact CG-CB 4.43Å
107R97.8Very high97.1Very high178 Ų17865.1 Ų65.167%0.67231%0.313SS*.Hα-helixtrans-60.1-34.6174.2-66.6175.2-177.8179.20.2112.4N103 K104 L105 F109 D110 V111N103-R107 WeakPolarHBondContact O-CG 3.4Å; N103-R107 PolarHBondContact O-N 2.92Å; K104-R107 WeakPolarHBondContact O-CB 3.42Å; K104-R107 PolarHBondContact O-N 2.9Å; L105-R107 VanDerWaalsContact C-N 3.29Å; L105-R107 PolarHBondContact O-N 3.45Å; R107-F109 VanDerWaalsContact C-N 3.29Å; R107-F109 PolarHBondContact O-N 3.32Å; R107-D110 PolarHBondContact O-N 3.46Å; R107-V111 WeakPolarHBondContact O-CG2 3.28Å; R107-V111 PolarHBondContact O-N 3.47Å; R107-V111 VanDerWaalsContact O-N 3.08Å
108T97.6Very high97.1Very high11 Ų1164.8 Ų64.87%0.06731%0.311CS..Hα-helixtrans-62.6-37.9174.2-510000111.5N65 K104 L105 K106 V111 W112N65-T108 HydrophobicContact CB-CG2 3.8Å; K104-T108 PolarHBondContact O-N 2.92Å; K104-T108 PolarHBondContact O-OG1 3.07Å; L105-T108 WeakPolarHBondContact O-CA 3.44Å; L105-T108 WeakPolarHBondContact O-CB 3.29Å; L105-T108 PolarHBondContact O-N 3.12Å; K106-T108 PolarHBondContact O-N 3.34Å; T108-V111 PolarHBondContact O-N 2.86Å; T108-W112 HydrophobicContact CG2-CD2 4.4Å; T108-W112 HydrophobicContact CG2-CZ2 3.91Å; T108-W112 PolarHBondContact O-N 3.09Å
109F97.9Very high96.9Very high0 Ų064.8 Ų64.80%032%0.315CS..Hα-helixtrans-64.8-41.3176.2-53.5-23.7000111.7L90 L105 K106 R107 V111 W112 E113 I123 L126 R127 A130L90-F109 HydrophobicContact CD2-CE2 4.17Å; L90-F109 HydrophobicContact CD2-CZ 3.73Å; L105-F109 HydrophobicContact CD1-CE1 4.38Å; L105-F109 HydrophobicContact CD2-CE1 4.47Å; L105-F109 HydrophobicContact CD2-CZ 3.92Å; L105-F109 HydrophobicContact CG-CE1 3.95Å; L105-F109 HydrophobicContact CG-CZ 3.71Å; L105-F109 PolarHBondContact O-N 3.47Å; K106-F109 VanDerWaalsContact O-CB 3.3Å; K106-F109 WeakPolarHBondContact O-CB 3.44Å; K106-F109 PolarHBondContact O-N 2.97Å; R107-F109 VanDerWaalsContact C-N 3.29Å; R107-F109 PolarHBondContact O-N 3.32Å; F109-V111 VanDerWaalsContact C-N 3.28Å; F109-V111 PolarHBondContact O-N 3.36Å; F109-W112 AromaticContact CD1-CE3 3.9Å; F109-W112 HydrophobicContact CD1-CE3 3.9Å; F109-W112 AromaticContact CD1-CZ3 3.81Å; F109-W112 HydrophobicContact CD1-CZ3 3.81Å; F109-W112 AromaticContact CE1-CZ3 4Å; F109-W112 HydrophobicContact CE1-CZ3 4Å; F109-W112 WeakPolarHBondContact O-CB 3.48Å; F109-W112 PolarHBondContact O-N 3.06Å; F109-W112 VanDerWaalsContact O-N 3.13Å; F109-E113 PolarHBondContact O-N 2.91Å; F109-I123 HydrophobicContact CB-CG2 4.12Å; F109-L126 HydrophobicContact CD1-CD1 4.14Å; F109-L126 HydrophobicContact CD2-CB 4.29Å; F109-L126 HydrophobicContact CE1-CB 4.38Å; F109-L126 HydrophobicContact CE1-CD1 4.1Å; F109-L126 HydrophobicContact CE2-CB 4.09Å; F109-L126 HydrophobicContact CZ-CB 4.15Å; F109-R127 HydrophobicContact CD2-CG 4.29Å; F109-A130 HydrophobicContact CE2-CB 4.12Å
110D97.6Very high96.8Very high74 Ų7467.3 Ų67.340%0.39631%0.313SS..Hα-helixtrans-62.9-37.5176.4-55.8-32.5000111.3K106 R107 E113 M114 R127K106-D110 PolarHBondContact O-N 3.39Å; R107-D110 PolarHBondContact O-N 3.46Å; D110-E113 PolarHBondContact O-N 3.24Å; D110-M114 VanDerWaalsContact O-CB 3.29Å; D110-M114 WeakPolarHBondContact O-CB 3.28Å; D110-M114 PolarHBondContact O-N 2.73Å; D110-R127 IonicContact OD1-CZ 3.71Å; D110-R127 IonicContact OD1-NE 2.59Å; D110-R127 IonicContact OD1-NH2 3.9Å; D110-R127 PolarHBondContact OD1-NH2 3.25Å
111V97Very high96.5Very high46 Ų4668.2 Ų68.228%0.27932%0.321SS..Hα-helixtrans-65.1-41.6173.1173.50000111.5R107 T108 F109 E113 R115R107-V111 WeakPolarHBondContact O-CG2 3.28Å; R107-V111 PolarHBondContact O-N 3.47Å; R107-V111 VanDerWaalsContact O-N 3.08Å; T108-V111 PolarHBondContact O-N 2.86Å; F109-V111 VanDerWaalsContact C-N 3.28Å; F109-V111 PolarHBondContact O-N 3.36Å; V111-E113 VanDerWaalsContact C-N 3.32Å; V111-E113 PolarHBondContact O-N 2.96Å; V111-R115 HydrophobicContact CG1-CG 4.39Å; V111-R115 VanDerWaalsContact O-CB 3.32Å; V111-R115 WeakPolarHBondContact O-CB 3.46Å; V111-R115 WeakPolarHBondContact O-CG 3.45Å; V111-R115 PolarHBondContact O-N 3.29Å
112W97.3Very high96.4Very high1 Ų168.4 Ų68.40%0.00432%0.321CS..Hα-helixtrans-63.3-38.3176.2-71.1-13.2000112.4N65 V68 L86 T108 F109 K116 V117 F118 I123 L126N65-W112 HydrophobicContact CB-CZ2 4.01Å; N65-W112 PolarHBondContact OD1-NE1 3Å; V68-W112 HydrophobicContact CG2-CZ2 4.31Å; L86-W112 HydrophobicContact CD1-CH2 3.65Å; L86-W112 HydrophobicContact CD1-CZ3 3.78Å; L86-W112 HydrophobicContact CD2-CH2 3.82Å; L86-W112 HydrophobicContact CD2-CZ3 4.31Å; L86-W112 HydrophobicContact CG-CH2 4.42Å; T108-W112 HydrophobicContact CG2-CD2 4.4Å; T108-W112 HydrophobicContact CG2-CZ2 3.91Å; T108-W112 PolarHBondContact O-N 3.09Å; F109-W112 AromaticContact CD1-CE3 3.9Å; F109-W112 HydrophobicContact CD1-CE3 3.9Å; F109-W112 AromaticContact CD1-CZ3 3.81Å; F109-W112 HydrophobicContact CD1-CZ3 3.81Å; F109-W112 AromaticContact CE1-CZ3 4Å; F109-W112 HydrophobicContact CE1-CZ3 4Å; F109-W112 WeakPolarHBondContact O-CB 3.48Å; F109-W112 PolarHBondContact O-N 3.06Å; F109-W112 VanDerWaalsContact O-N 3.13Å; W112-K116 WeakPolarHBondContact O-CA 3.47Å; W112-K116 PolarHBondContact O-N 3.14Å; W112-V117 HydrophobicContact CB-CB 4.07Å; W112-V117 HydrophobicContact CB-CG2 4.43Å; W112-V117 HydrophobicContact CG-CB 4.17Å; W112-V117 HydrophobicContact CG-CG1 4.47Å; W112-V117 HydrophobicContact CG-CG2 4.46Å; W112-V117 PolarHBondContact O-N 3.35Å; W112-F118 HydrophobicContact CB-CD2 4.25Å; W112-F118 AromaticContact CD2-CD2 3.79Å; W112-F118 HydrophobicContact CD2-CD2 3.79Å; W112-F118 AromaticContact CD2-CE2 3.71Å; W112-F118 HydrophobicContact CD2-CE2 3.71Å; W112-F118 AromaticContact CE3-CD2 3.63Å; W112-F118 HydrophobicContact CE3-CD2 3.63Å; W112-F118 AromaticContact CE3-CE2 3.64Å; W112-F118 HydrophobicContact CE3-CE2 3.64Å; W112-F118 HydrophobicContact CG-CD2 4.09Å; W112-F118 HydrophobicContact CG-CE2 4.3Å; W112-F118 HydrophobicContact CH2-CE2 4.18Å; W112-F118 HydrophobicContact CZ2-CE2 4.25Å; W112-F118 HydrophobicContact CZ3-CD2 4.24Å; W112-F118 AromaticContact CZ3-CE2 3.88Å; W112-F118 HydrophobicContact CZ3-CE2 3.88Å; W112-I123 HydrophobicContact CB-CD1 3.97Å; W112-L126 HydrophobicContact CE3-CD1 4.15Å; W112-L126 HydrophobicContact CZ3-CD1 3.79Å
113E96.7Very high96.3Very high62 Ų6267.1 Ų67.129%0.2932%0.315SS..Hα-helixtrans-68.5-51.2176.9-173.6175.2-119.600110.9F109 D110 V111 R115 K116 F120 I123 R127F109-E113 PolarHBondContact O-N 2.91Å; D110-E113 PolarHBondContact O-N 3.24Å; V111-E113 VanDerWaalsContact C-N 3.32Å; V111-E113 PolarHBondContact O-N 2.96Å; E113-R115 VanDerWaalsContact C-N 3.27Å; E113-R115 PolarHBondContact O-N 3.32Å; E113-K116 PolarHBondContact O-N 3.18Å; E113-F120 WeakPolarHBondContact OE1-CD2 3.42Å; E113-F120 WeakPolarHBondContact OE1-CE2 3.31Å; E113-I123 HydrophobicContact CB-CD1 3.62Å; E113-I123 HydrophobicContact CB-CG2 4.41Å; E113-I123 HydrophobicContact CG-CD1 4.35Å; E113-I123 VanDerWaalsContact N-CD1 3.31Å; E113-R127 IonicContact OE1-CZ 3.74Å; E113-R127 IonicContact OE1-NH1 2.84Å; E113-R127 PolarHBondContact OE1-NH1 3.45Å; E113-R127 IonicContact OE1-NH2 3.71Å; E113-R127 IonicContact OE2-CZ 2.9Å; E113-R127 IonicContact OE2-NH1 3.36Å; E113-R127 PolarHBondContact OE2-NH1 3.12Å; E113-R127 IonicContact OE2-NH2 3.74Å; E113-R127 PolarHBondContact OE2-NH2 2.95Å
114M96.7Very high96.2Very high153 Ų15364.9 Ų64.975%0.75431%0.306SS*.Hα-helixtrans-55.8-42.7178.4-176.8-164.3-65.400111.8D110 K116D110-M114 VanDerWaalsContact O-CB 3.29Å; D110-M114 WeakPolarHBondContact O-CB 3.28Å; D110-M114 PolarHBondContact O-N 2.73Å; M114-K116 VanDerWaalsContact C-N 3.31Å
115R95.9Very high96Very high144 Ų14462.4 Ų62.454%0.54330%0.297SS..THydrogen-bonded Turntrans-86.92.1-179.6-64.3-178.5-178.2-160.1-1.8113.3R72 V111 E113 V117R72-R115 PolarHBondContact NH1-O 2.86Å; V111-R115 HydrophobicContact CG1-CG 4.39Å; V111-R115 VanDerWaalsContact O-CB 3.32Å; V111-R115 WeakPolarHBondContact O-CB 3.46Å; V111-R115 WeakPolarHBondContact O-CG 3.45Å; V111-R115 PolarHBondContact O-N 3.29Å; E113-R115 VanDerWaalsContact C-N 3.27Å; E113-R115 PolarHBondContact O-N 3.32Å; R115-V117 VanDerWaalsContact C-N 3.26Å; R115-V117 HydrophobicContact CB-CG2 3.91Å; R115-V117 PolarHBondContact O-N 3.05Å
116K95.1Very high96Very high169 Ų16962.4 Ų62.474%0.73530%0.297SS*.THydrogen-bonded Turntrans49.446.2-175.7-56-178.3179-177.20112R72 W112 E113 M114R72-K116 PolarHBondContact NH2-O 3.42Å; W112-K116 WeakPolarHBondContact O-CA 3.47Å; W112-K116 PolarHBondContact O-N 3.14Å; E113-K116 PolarHBondContact O-N 3.18Å; M114-K116 VanDerWaalsContact C-N 3.31Å
117V95.2Very high95.9Very high9 Ų961.6 Ų61.66%0.05529%0.292CS..SBendtrans-73.3-43.5177.4-179.30000109.8V68 Q69 V79 W112 R115V68-V117 HydrophobicContact CB-CG1 4.28Å; V68-V117 HydrophobicContact CG2-CG1 4.02Å; Q69-V117 HydrophobicContact CG-CG2 4.28Å; V79-V117 WeakPolarHBondContact CG1-O 3.16Å; W112-V117 HydrophobicContact CB-CB 4.07Å; W112-V117 HydrophobicContact CB-CG2 4.43Å; W112-V117 HydrophobicContact CG-CB 4.17Å; W112-V117 HydrophobicContact CG-CG1 4.47Å; W112-V117 HydrophobicContact CG-CG2 4.46Å; W112-V117 PolarHBondContact O-N 3.35Å; R115-V117 VanDerWaalsContact C-N 3.26Å; R115-V117 HydrophobicContact CB-CG2 3.91Å; R115-V117 PolarHBondContact O-N 3.05Å
118F95.5Very high95.8Very high11 Ų1153.5 Ų53.55%0.04826%0.263CS..SBendtrans-125160.9176-63.1-62.4000111.2V68 V79 F82 E83 L86 W112 F122 I123V68-F118 HydrophobicContact CG1-CZ 4.15Å; V79-F118 HydrophobicContact CG1-CD1 3.96Å; V79-F118 HydrophobicContact CG1-CE1 3.62Å; V79-F118 HydrophobicContact CG1-CZ 4.48Å; V79-F118 WeakPolarHBondContact O-CE1 3.21Å; F82-F118 HydrophobicContact CB-CZ 4.33Å; E83-F118 HydrophobicContact CB-CD1 3.92Å; E83-F118 HydrophobicContact CB-CE1 3.69Å; E83-F118 HydrophobicContact CG-CD1 4.05Å; E83-F118 HydrophobicContact CG-CE1 4.33Å; L86-F118 HydrophobicContact CD1-CE2 3.62Å; L86-F118 HydrophobicContact CD1-CZ 3.6Å; W112-F118 HydrophobicContact CB-CD2 4.25Å; W112-F118 AromaticContact CD2-CD2 3.79Å; W112-F118 HydrophobicContact CD2-CD2 3.79Å; W112-F118 AromaticContact CD2-CE2 3.71Å; W112-F118 HydrophobicContact CD2-CE2 3.71Å; W112-F118 AromaticContact CE3-CD2 3.63Å; W112-F118 HydrophobicContact CE3-CD2 3.63Å; W112-F118 AromaticContact CE3-CE2 3.64Å; W112-F118 HydrophobicContact CE3-CE2 3.64Å; W112-F118 HydrophobicContact CG-CD2 4.09Å; W112-F118 HydrophobicContact CG-CE2 4.3Å; W112-F118 HydrophobicContact CH2-CE2 4.18Å; W112-F118 HydrophobicContact CZ2-CE2 4.25Å; W112-F118 HydrophobicContact CZ3-CD2 4.24Å; W112-F118 AromaticContact CZ3-CE2 3.88Å; W112-F118 HydrophobicContact CZ3-CE2 3.88Å; F118-F122 HydrophobicContact CB-CD1 3.62Å; F118-F122 HydrophobicContact CB-CE1 4.23Å; F118-F122 HydrophobicContact CD1-CD1 4.24Å; F118-F122 HydrophobicContact CD1-CE1 4.17Å; F118-F122 HydrophobicContact CD2-CD1 4.21Å; F118-F122 AromaticContact CD2-CE1 4Å; F118-F122 HydrophobicContact CD2-CE1 4Å; F118-F122 HydrophobicContact CE2-CE1 4.38Å; F118-F122 AromaticContact CG-CD1 3.78Å; F118-F122 HydrophobicContact CG-CD1 3.78Å; F118-F122 AromaticContact CG-CE1 3.88Å; F118-F122 HydrophobicContact CG-CE1 3.88Å; F118-I123 HydrophobicContact CB-CD1 4.21Å; F118-I123 HydrophobicContact CB-CG1 4.01Å
119P94.1Very high95.6Very high69 Ų6953 Ų5345%0.44826%0.26SS..  trans-60.9151.4173.4-21.433.6000112.8E83 D121 F122 I123E83-P119 WeakPolarHBondContact OE1-CD 3.29Å; P119-D121 VanDerWaalsContact C-N 3.35Å; P119-D121 PolarHBondContact O-N 3.32Å; P119-F122 HydrophobicContact CB-CB 4.48Å; P119-F122 WeakPolarHBondContact O-CB 3.36Å; P119-F122 PolarHBondContact O-N 2.69Å; P119-I123 WeakPolarHBondContact O-CG1 3.43Å; P119-I123 PolarHBondContact O-N 2.96Å; P119-I123 VanDerWaalsContact O-N 3.16Å
120F93.8Very high95.5Very high128 Ų12853.1 Ų53.156%0.56126%0.261SS*.Hα-helixtrans-57.1-44.1179.9176.5-95000113.1E113 F122 I123 S124E113-F120 WeakPolarHBondContact OE1-CD2 3.42Å; E113-F120 WeakPolarHBondContact OE1-CE2 3.31Å; F120-F122 VanDerWaalsContact C-N 3.31Å; F120-F122 PolarHBondContact O-N 2.93Å; F120-I123 PolarHBondContact O-N 3.18Å; F120-S124 WeakPolarHBondContact O-CB 3.31Å; F120-S124 PolarHBondContact O-N 2.93Å; F120-S124 PolarHBondContact O-OG 3.42Å; F120-S124 VanDerWaalsContact O-OG 3.08Å
121D93Very high95.3Very high128 Ų12856.6 Ų56.668%0.68427%0.268SS*.Hα-helixtrans-63.2-39.4-178.3-63.1-25.1000111.8P119 S124 G125P119-D121 VanDerWaalsContact C-N 3.35Å; P119-D121 PolarHBondContact O-N 3.32Å; D121-S124 WeakPolarHBondContact O-CB 3.39Å; D121-S124 PolarHBondContact O-N 3.13Å; D121-G125 PolarHBondContact O-N 3.13Å
122F94.8Very high94.9Very high17 Ų1757.3 Ų57.38%0.07529%0.286CS..Hα-helixtrans-64-45.6176.2178.8-101.3000111.7E83 L86 E87 F118 P119 F120 S124 G125 L126E83-F122 HydrophobicContact CB-CZ 4.41Å; E83-F122 HydrophobicContact CG-CD1 4.26Å; E83-F122 HydrophobicContact CG-CD2 3.87Å; E83-F122 HydrophobicContact CG-CE1 4.17Å; E83-F122 HydrophobicContact CG-CE2 3.79Å; E83-F122 HydrophobicContact CG-CG 4.09Å; E83-F122 HydrophobicContact CG-CZ 3.94Å; E83-F122 WeakPolarHBondContact O-CE2 3.31Å; E83-F122 WeakPolarHBondContact O-CZ 3.39Å; L86-F122 HydrophobicContact CB-CE1 4.45Å; L86-F122 HydrophobicContact CB-CZ 3.84Å; L86-F122 HydrophobicContact CD1-CE1 4.34Å; L86-F122 HydrophobicContact CD1-CZ 4.43Å; E87-F122 HydrophobicContact CG-CD2 4.34Å; E87-F122 HydrophobicContact CG-CE2 3.73Å; E87-F122 HydrophobicContact CG-CZ 4.32Å; F118-F122 HydrophobicContact CB-CD1 3.62Å; F118-F122 HydrophobicContact CB-CE1 4.23Å; F118-F122 HydrophobicContact CD1-CD1 4.24Å; F118-F122 HydrophobicContact CD1-CE1 4.17Å; F118-F122 HydrophobicContact CD2-CD1 4.21Å; F118-F122 AromaticContact CD2-CE1 4Å; F118-F122 HydrophobicContact CD2-CE1 4Å; F118-F122 HydrophobicContact CE2-CE1 4.38Å; F118-F122 AromaticContact CG-CD1 3.78Å; F118-F122 HydrophobicContact CG-CD1 3.78Å; F118-F122 AromaticContact CG-CE1 3.88Å; F118-F122 HydrophobicContact CG-CE1 3.88Å; P119-F122 HydrophobicContact CB-CB 4.48Å; P119-F122 WeakPolarHBondContact O-CB 3.36Å; P119-F122 PolarHBondContact O-N 2.69Å; F120-F122 VanDerWaalsContact C-N 3.31Å; F120-F122 PolarHBondContact O-N 2.93Å; F122-S124 VanDerWaalsContact C-N 3.29Å; F122-S124 PolarHBondContact O-N 2.87Å; F122-G125 WeakPolarHBondContact O-CA 3.29Å; F122-G125 PolarHBondContact O-N 3.43Å; F122-G125 VanDerWaalsContact O-N 3.14Å; F122-L126 HydrophobicContact CD1-CD1 4.19Å; F122-L126 HydrophobicContact CE1-CD1 3.67Å; F122-L126 HydrophobicContact CE1-CG 4.2Å; F122-L126 HydrophobicContact CZ-CD1 4.22Å; F122-L126 HydrophobicContact CZ-CD2 4.45Å; F122-L126 HydrophobicContact CZ-CG 4.39Å; F122-L126 PolarHBondContact O-N 3.37Å
123I96.3Very high94.4Very high0 Ų061.5 Ų61.50%031%0.305CS..Hα-helixtrans-64.3-38177.5-63.4178.3000110.8F109 W112 E113 F118 P119 F120 G125 L126 R127F109-I123 HydrophobicContact CB-CG2 4.12Å; W112-I123 HydrophobicContact CB-CD1 3.97Å; E113-I123 HydrophobicContact CB-CD1 3.62Å; E113-I123 HydrophobicContact CB-CG2 4.41Å; E113-I123 HydrophobicContact CG-CD1 4.35Å; E113-I123 VanDerWaalsContact N-CD1 3.31Å; F118-I123 HydrophobicContact CB-CD1 4.21Å; F118-I123 HydrophobicContact CB-CG1 4.01Å; P119-I123 WeakPolarHBondContact O-CG1 3.43Å; P119-I123 PolarHBondContact O-N 2.96Å; P119-I123 VanDerWaalsContact O-N 3.16Å; F120-I123 PolarHBondContact O-N 3.18Å; I123-G125 VanDerWaalsContact C-N 3.31Å; I123-G125 PolarHBondContact O-N 3.17Å; I123-L126 PolarHBondContact O-N 2.9Å; I123-R127 WeakPolarHBondContact O-CG 3.44Å; I123-R127 PolarHBondContact O-N 2.89Å
124S94.6Very high93.3Very high40 Ų4063.2 Ų63.228%0.2832%0.32SS..Hα-helixtrans-61.4-38.9173.7-66.20000112.1F120 D121 F122 R127 A128F120-S124 WeakPolarHBondContact O-CB 3.31Å; F120-S124 PolarHBondContact O-N 2.93Å; F120-S124 PolarHBondContact O-OG 3.42Å; F120-S124 VanDerWaalsContact O-OG 3.08Å; D121-S124 WeakPolarHBondContact O-CB 3.39Å; D121-S124 PolarHBondContact O-N 3.13Å; F122-S124 VanDerWaalsContact C-N 3.29Å; F122-S124 PolarHBondContact O-N 2.87Å; S124-R127 PolarHBondContact O-N 3.2Å; S124-A128 PolarHBondContact O-N 3.23Å
125G94.6Very high91.7Very high6 Ų656.2 Ų56.26%0.06229%0.286CS..Hα-helixtrans-59.1-47.5171.200000113D121 F122 I123 R127 A128 I129D121-G125 PolarHBondContact O-N 3.13Å; F122-G125 WeakPolarHBondContact O-CA 3.29Å; F122-G125 PolarHBondContact O-N 3.43Å; F122-G125 VanDerWaalsContact O-N 3.14Å; I123-G125 VanDerWaalsContact C-N 3.31Å; I123-G125 PolarHBondContact O-N 3.17Å; G125-R127 VanDerWaalsContact C-N 3.32Å; G125-R127 PolarHBondContact O-N 3.45Å; G125-A128 WeakPolarHBondContact O-CB 3.45Å; G125-A128 PolarHBondContact O-N 3.44Å; G125-I129 WeakPolarHBondContact O-CG1 3.5Å; G125-I129 PolarHBondContact O-N 3.3Å
126L96.1Very high89.9Confident0 Ų056.2 Ų56.20%030%0.302CS..Hα-helixtrans-60.3-40.1175.4-66.4176.1000112.5L86 E87 L90 F109 W112 F122 I123 I129 A130L86-L126 HydrophobicContact CB-CD2 4.32Å; E87-L126 HydrophobicContact CB-CD2 4.45Å; E87-L126 HydrophobicContact CG-CD2 3.88Å; E87-L126 HydrophobicContact CG-CG 4.5Å; L90-L126 HydrophobicContact CB-CD2 4.46Å; L90-L126 HydrophobicContact CD2-CB 4.21Å; L90-L126 HydrophobicContact CD2-CD2 3.91Å; L90-L126 WeakPolarHBondContact CD2-O 3.48Å; F109-L126 HydrophobicContact CD1-CD1 4.14Å; F109-L126 HydrophobicContact CD2-CB 4.29Å; F109-L126 HydrophobicContact CE1-CB 4.38Å; F109-L126 HydrophobicContact CE1-CD1 4.1Å; F109-L126 HydrophobicContact CE2-CB 4.09Å; F109-L126 HydrophobicContact CZ-CB 4.15Å; W112-L126 HydrophobicContact CE3-CD1 4.15Å; W112-L126 HydrophobicContact CZ3-CD1 3.79Å; F122-L126 HydrophobicContact CD1-CD1 4.19Å; F122-L126 HydrophobicContact CE1-CD1 3.67Å; F122-L126 HydrophobicContact CE1-CG 4.2Å; F122-L126 HydrophobicContact CZ-CD1 4.22Å; F122-L126 HydrophobicContact CZ-CD2 4.45Å; F122-L126 HydrophobicContact CZ-CG 4.39Å; F122-L126 PolarHBondContact O-N 3.37Å; I123-L126 PolarHBondContact O-N 2.9Å; L126-I129 PolarHBondContact O-N 2.94Å; L126-A130 WeakPolarHBondContact O-CB 3.32Å; L126-A130 PolarHBondContact O-N 3.34Å
127R96.3Very high87.9Confident48 Ų4849.9 Ų49.918%0.18128%0.279CS..Hα-helixtrans-64.2-39.5176.2-71.7175.6178.2137.3-3.8112F109 D110 E113 I123 S124 G125 A130 R131F109-R127 HydrophobicContact CD2-CG 4.29Å; D110-R127 IonicContact OD1-CZ 3.71Å; D110-R127 IonicContact OD1-NE 2.59Å; D110-R127 IonicContact OD1-NH2 3.9Å; D110-R127 PolarHBondContact OD1-NH2 3.25Å; E113-R127 IonicContact OE1-CZ 3.74Å; E113-R127 IonicContact OE1-NH1 2.84Å; E113-R127 PolarHBondContact OE1-NH1 3.45Å; E113-R127 IonicContact OE1-NH2 3.71Å; E113-R127 IonicContact OE2-CZ 2.9Å; E113-R127 IonicContact OE2-NH1 3.36Å; E113-R127 PolarHBondContact OE2-NH1 3.12Å; E113-R127 IonicContact OE2-NH2 3.74Å; E113-R127 PolarHBondContact OE2-NH2 2.95Å; I123-R127 WeakPolarHBondContact O-CG 3.44Å; I123-R127 PolarHBondContact O-N 2.89Å; S124-R127 PolarHBondContact O-N 3.2Å; G125-R127 VanDerWaalsContact C-N 3.32Å; G125-R127 PolarHBondContact O-N 3.45Å; R127-A130 PolarHBondContact O-N 2.92Å; R127-R131 WeakPolarHBondContact O-CG 3.47Å; R127-R131 PolarHBondContact O-N 2.95Å
128A94.9Very high86Confident7 Ų754.6 Ų54.66%0.05830%0.304CS..Hα-helixtrans-61.7-49.5174.700000111.3S124 G125 A130 R131 G132 E133S124-A128 PolarHBondContact O-N 3.23Å; G125-A128 WeakPolarHBondContact O-CB 3.45Å; G125-A128 PolarHBondContact O-N 3.44Å; A128-A130 VanDerWaalsContact C-N 3.27Å; A128-A130 PolarHBondContact O-N 3.15Å; A128-R131 WeakPolarHBondContact O-CA 3.1Å; A128-R131 WeakPolarHBondContact O-CB 3.26Å; A128-R131 PolarHBondContact O-N 3.33Å; A128-G132 PolarHBondContact O-N 3.2Å; A128-E133 HydrophobicContact CB-CB 4.11Å; A128-E133 VanDerWaalsContact CB-OE2 3.28Å; A128-E133 WeakPolarHBondContact CB-OE2 3.46Å; A128-E133 WeakPolarHBondContact O-CB 3.45Å; A128-E133 PolarHBondContact O-N 2.94Å
129I95.1Very high84.3Confident1 Ų155.7 Ų55.71%0.00531%0.307CS..Hα-helixtrans-57.7-42.9175.8-61.5167000110.7E87 L90 Y91 G125 L126 R131 G132 P135E87-I129 HydrophobicContact CB-CD1 3.78Å; E87-I129 HydrophobicContact CG-CD1 3.93Å; L90-I129 HydrophobicContact CB-CG2 4.24Å; L90-I129 HydrophobicContact CD2-CB 4.02Å; L90-I129 HydrophobicContact CD2-CG2 3.96Å; L90-I129 HydrophobicContact CG-CB 4.34Å; L90-I129 HydrophobicContact CG-CG2 3.71Å; Y91-I129 HydrophobicContact CD2-CG2 4.21Å; G125-I129 WeakPolarHBondContact O-CG1 3.5Å; G125-I129 PolarHBondContact O-N 3.3Å; L126-I129 PolarHBondContact O-N 2.94Å; I129-R131 PolarHBondContact O-N 2.92Å; I129-G132 WeakPolarHBondContact O-CA 3.33Å; I129-G132 PolarHBondContact O-N 3.5Å; I129-P135 HydrophobicContact CD1-CB 3.88Å; I129-P135 HydrophobicContact CD1-CG 3.91Å; I129-P135 HydrophobicContact CG1-CB 3.79Å; I129-P135 HydrophobicContact CG1-CG 3.79Å
130A95.4Very high82.3Confident3 Ų356 Ų563%0.02531%0.305CS..THydrogen-bonded Turntrans-66.6-12.6177.400000114.4L90 L102 K106 F109 L126 R127 A128L90-A130 HydrophobicContact CD2-CB 4.47Å; L102-A130 HydrophobicContact CD1-CB 4.07Å; K106-A130 HydrophobicContact CG-CB 4.43Å; F109-A130 HydrophobicContact CE2-CB 4.12Å; L126-A130 WeakPolarHBondContact O-CB 3.32Å; L126-A130 PolarHBondContact O-N 3.34Å; R127-A130 PolarHBondContact O-N 2.92Å; A128-A130 VanDerWaalsContact C-N 3.27Å; A128-A130 PolarHBondContact O-N 3.15Å
131R93.8Very high80.2Confident146 Ų14658.3 Ų58.355%0.55131%0.31SS*.THydrogen-bonded Turntrans-94.1-2.3168.9-68.4-173.7-59.9-97.4-3.1112.9R127 A128 I129 E133R127-R131 WeakPolarHBondContact O-CG 3.47Å; R127-R131 PolarHBondContact O-N 2.95Å; A128-R131 WeakPolarHBondContact O-CA 3.1Å; A128-R131 WeakPolarHBondContact O-CB 3.26Å; A128-R131 PolarHBondContact O-N 3.33Å; I129-R131 PolarHBondContact O-N 2.92Å; R131-E133 HydrophobicContact CB-CG 4.43Å; R131-E133 IonicContact CZ-OE1 2.63Å; R131-E133 IonicContact CZ-OE2 3.49Å; R131-E133 IonicContact NE-OE1 2.83Å; R131-E133 PolarHBondContact NE-OE1 3.38Å; R131-E133 IonicContact NE-OE2 2.75Å; R131-E133 IonicContact NH2-OE1 3.56Å; R131-E133 PolarHBondContact NH2-OE1 3.41Å; R131-E133 IonicContact NH2-OE2 3.33Å; R131-E133 PolarHBondContact NH2-OE2 2.91Å; R131-E133 VanDerWaalsContact NH2-OE2 3.1Å
132G88.2Confident78.1Confident62 Ų6260.4 Ų60.464%0.63931%0.308SS*.THydrogen-bonded Turntrans86.810.4-175.600000113.8A128 I129A128-G132 PolarHBondContact O-N 3.2Å; I129-G132 WeakPolarHBondContact O-CA 3.33Å; I129-G132 PolarHBondContact O-N 3.5Å
133E86.3Confident75.7Confident88 Ų8860.8 Ų60.841%0.41131%0.312SS..PPolyproline II helixtrans-76.9148.1176.3-63.7159.9-150.300110.3A128 R131A128-E133 HydrophobicContact CB-CB 4.11Å; A128-E133 VanDerWaalsContact CB-OE2 3.28Å; A128-E133 WeakPolarHBondContact CB-OE2 3.46Å; A128-E133 WeakPolarHBondContact O-CB 3.45Å; A128-E133 PolarHBondContact O-N 2.94Å; R131-E133 HydrophobicContact CB-CG 4.43Å; R131-E133 IonicContact CZ-OE1 2.63Å; R131-E133 IonicContact CZ-OE2 3.49Å; R131-E133 IonicContact NE-OE1 2.83Å; R131-E133 PolarHBondContact NE-OE1 3.38Å; R131-E133 IonicContact NE-OE2 2.75Å; R131-E133 IonicContact NH2-OE1 3.56Å; R131-E133 PolarHBondContact NH2-OE1 3.41Å; R131-E133 IonicContact NH2-OE2 3.33Å; R131-E133 PolarHBondContact NH2-OE2 2.91Å; R131-E133 VanDerWaalsContact NH2-OE2 3.1Å
134V72.7Confident72.9Confident99 Ų9968.1 Ų68.160%0.634%0.344SS*.PPolyproline II helixtrans-73.1126173.4-174.80000107.8T136V134-T136 PolarHBondContact O-N 3.12Å
135P64.8Low70.4Confident6 Ų670.5 Ų70.54%0.03935%0.354CS..PPolyproline II helixtrans-59.7127.3-177.411.3-19.3000111.6Y91 I129 S137 W139 L140Y91-P135 HydrophobicContact CD2-CG 4.13Å; I129-P135 HydrophobicContact CD1-CB 3.88Å; I129-P135 HydrophobicContact CD1-CG 3.91Å; I129-P135 HydrophobicContact CG1-CB 3.79Å; I129-P135 HydrophobicContact CG1-CG 3.79Å; P135-S137 VanDerWaalsContact C-N 3.26Å; P135-W139 HydrophobicContact CG-CZ2 4.49Å; P135-W139 VanDerWaalsContact CG-NE1 3.25Å; P135-L140 HydrophobicContact CB-CD1 4.26Å; P135-L140 HydrophobicContact CG-CD1 3.76Å; P135-L140 VanDerWaalsContact O-CD1 3.27Å; P135-L140 WeakPolarHBondContact O-CD1 3.42Å
136T56.7Low67.9Low144 Ų14473.4 Ų73.488%0.88337%0.373SS*.  trans-82.3-2.6173.926.30000113.1V134V134-T136 PolarHBondContact O-N 3.12Å
137S54.4Low65.1Low36 Ų3681.2 Ų81.225%0.25240%0.402SS..SBendtrans-91.1158.6-169.4153.50000114.4E87 P135 W139 L140E87-S137 VanDerWaalsContact CD-OG 3.24Å; E87-S137 WeakPolarHBondContact OE1-CB 3.43Å; E87-S137 PolarHBondContact OE1-OG 3.38Å; E87-S137 PolarHBondContact OE2-OG 3.46Å; P135-S137 VanDerWaalsContact C-N 3.26Å; S137-W139 PolarHBondContact O-N 3.43Å; S137-L140 PolarHBondContact O-N 3.32Å
138N54Low62.3Low107 Ų10780.8 Ų80.857%0.57241%0.407SS*.THydrogen-bonded Turntrans-48-18.3-170-105.1-20.7000116.8L140 R141 R142N138-L140 VanDerWaalsContact C-N 3.29Å; N138-L140 PolarHBondContact O-N 2.91Å; N138-R141 WeakPolarHBondContact O-CA 3.44Å; N138-R141 WeakPolarHBondContact O-CB 3.38Å; N138-R141 PolarHBondContact O-N 3.18Å; N138-R142 PolarHBondContact O-N 3.49Å
139W60.6Low59.7Low34 Ų3486.8 Ų86.813%0.12944%0.437CS..Hα-helixtrans-66-31.9179.896.3-75000112.4E87 E88 Y91 P135 S137 R141 R142 T143E87-W139 HydrophobicContact CB-CG 4.27Å; E88-W139 HydrophobicContact CB-CD2 4.3Å; E88-W139 HydrophobicContact CB-CE3 3.51Å; E88-W139 HydrophobicContact CB-CH2 3.66Å; E88-W139 HydrophobicContact CB-CZ2 4.42Å; E88-W139 HydrophobicContact CB-CZ3 3.18Å; E88-W139 HydrophobicContact CG-CE3 4.03Å; E88-W139 HydrophobicContact CG-CH2 3.58Å; E88-W139 HydrophobicContact CG-CZ3 3.2Å; Y91-W139 HydrophobicContact CD1-CZ2 4.26Å; Y91-W139 HydrophobicContact CG-CZ2 4.28Å; P135-W139 HydrophobicContact CG-CZ2 4.49Å; P135-W139 VanDerWaalsContact CG-NE1 3.25Å; S137-W139 PolarHBondContact O-N 3.43Å; W139-R141 VanDerWaalsContact C-N 3.29Å; W139-R141 PolarHBondContact O-N 3.43Å; W139-R142 PolarHBondContact O-N 2.99Å; W139-T143 HydrophobicContact CE3-CG2 3.76Å; W139-T143 HydrophobicContact CZ3-CG2 3.88Å; W139-T143 WeakPolarHBondContact O-CG2 3.38Å; W139-T143 PolarHBondContact O-N 3Å; W139-T143 PolarHBondContact O-OG1 2.76Å
140L52.2Low56.9Low77 Ų7796.7 Ų96.740%0.40348%0.475SS..Hα-helixtrans-66.7-31.3170.9-98.3122.9000111.9P135 S137 N138 T143 K144P135-L140 HydrophobicContact CB-CD1 4.26Å; P135-L140 HydrophobicContact CG-CD1 3.76Å; P135-L140 VanDerWaalsContact O-CD1 3.27Å; P135-L140 WeakPolarHBondContact O-CD1 3.42Å; S137-L140 PolarHBondContact O-N 3.32Å; N138-L140 VanDerWaalsContact C-N 3.29Å; N138-L140 PolarHBondContact O-N 2.91Å; L140-T143 WeakPolarHBondContact CA-OG1 3.38Å; L140-T143 PolarHBondContact O-OG1 3.39Å; L140-K144 WeakPolarHBondContact O-CB 3.41Å; L140-K144 PolarHBondContact O-N 2.97Å
141R49.7Very low54.1Low176 Ų176107.3 Ų107.366%0.66451%0.514SS*.Hα-helixtrans-68.8-44.9170.7-95.2177.273.5-173.94.7111.5N138 W139 T143 K144 D145N138-R141 WeakPolarHBondContact O-CA 3.44Å; N138-R141 WeakPolarHBondContact O-CB 3.38Å; N138-R141 PolarHBondContact O-N 3.18Å; W139-R141 VanDerWaalsContact C-N 3.29Å; W139-R141 PolarHBondContact O-N 3.43Å; R141-T143 VanDerWaalsContact C-N 3.34Å; R141-T143 PolarHBondContact O-N 3.41Å; R141-K144 CarbonylContact O-C 3.27Å; R141-K144 PolarHBondContact O-N 2.82Å; R141-D145 PolarHBondContact O-N 3.02Å
142R48Very low51.2Low172 Ų172105 Ų10565%0.64952%0.521SS*.Hα-helixtrans-62.2-37.2175.5-94.6167.563.7179.7-2.9113.2N138 W139 S146N138-R142 PolarHBondContact O-N 3.49Å; W139-R142 PolarHBondContact O-N 2.99Å; R142-S146 PolarHBondContact O-N 3.3Å; R142-S146 PolarHBondContact O-OG 3.43Å
143T45.2Very low48.8Very low24 Ų24105.2 Ų105.215%0.14752%0.516CS..Hα-helixtrans-79.5-27.7176.753.40000112.9W139 L140 R141 S146 R147W139-T143 HydrophobicContact CE3-CG2 3.76Å; W139-T143 HydrophobicContact CZ3-CG2 3.88Å; W139-T143 WeakPolarHBondContact O-CG2 3.38Å; W139-T143 PolarHBondContact O-N 3Å; W139-T143 PolarHBondContact O-OG1 2.76Å; L140-T143 WeakPolarHBondContact CA-OG1 3.38Å; L140-T143 PolarHBondContact O-OG1 3.39Å; R141-T143 VanDerWaalsContact C-N 3.34Å; R141-T143 PolarHBondContact O-N 3.41Å; T143-S146 WeakPolarHBondContact CA-OG 2.98Å; T143-S146 PolarHBondContact O-OG 2.66Å; T143-S146 VanDerWaalsContact O-OG 3.1Å; T143-R147 VanDerWaalsContact O-CB 3.32Å; T143-R147 WeakPolarHBondContact O-CB 3.14Å; T143-R147 WeakPolarHBondContact O-CG 3.25Å; T143-R147 PolarHBondContact O-N 2.81Å
144K38.2Very low46.1Very low155 Ų155103.5 Ų103.567%0.67452%0.522SS*.Hα-helixtrans-75.9-29171-159.3171.8-171.6178.50111.4L140 R141 S148L140-K144 WeakPolarHBondContact O-CB 3.41Å; L140-K144 PolarHBondContact O-N 2.97Å; R141-K144 CarbonylContact O-C 3.27Å; R141-K144 PolarHBondContact O-N 2.82Å; K144-S148 VanDerWaalsContact O-CA 3.32Å; K144-S148 WeakPolarHBondContact O-CA 3.31Å; K144-S148 WeakPolarHBondContact O-CB 3.27Å; K144-S148 PolarHBondContact O-N 3.38Å; K144-S148 PolarHBondContact O-OG 3.46Å
145D42.3Very low44Very low90 Ų90109.6 Ų109.648%0.48153%0.534SS..Hα-helixtrans-72.9-35.8168.3-76.6-29.4000111.7R141 L149R141-D145 PolarHBondContact O-N 3.02Å; D145-L149 VanDerWaalsContact O-CB 3.25Å; D145-L149 WeakPolarHBondContact O-CB 3.4Å; D145-L149 WeakPolarHBondContact O-CD1 3.49Å; D145-L149 PolarHBondContact O-N 3.23Å
146S41.4Very low42.6Very low67 Ų67114.7 Ų114.747%0.46957%0.568SS.*Hα-helixtrans-74.7-23.9173.167.90000114.1R142 T143 R150R142-S146 PolarHBondContact O-N 3.3Å; R142-S146 PolarHBondContact O-OG 3.43Å; T143-S146 WeakPolarHBondContact CA-OG 2.98Å; T143-S146 PolarHBondContact O-OG 2.66Å; T143-S146 VanDerWaalsContact O-OG 3.1Å; S146-R150 WeakPolarHBondContact O-CG 3.32Å
147R37.9Very low41.4Very low164 Ų164113.3 Ų113.362%0.61956%0.559SS**Hα-helixtrans-93.1-25.2171.7-73.1-178.7-153.2161.49.3114.3T143 R150 R151T143-R147 VanDerWaalsContact O-CB 3.32Å; T143-R147 WeakPolarHBondContact O-CB 3.14Å; T143-R147 WeakPolarHBondContact O-CG 3.25Å; T143-R147 PolarHBondContact O-N 2.81Å; R147-R150 CarbonylContact O-C 3.51Å; R147-R150 WeakPolarHBondContact O-CB 3.37Å; R147-R150 PolarHBondContact O-N 2.91Å; R147-R151 PolarHBondContact O-N 3.39Å
148S35.8Very low40.5Very low39 Ų39118.8 Ų118.827%0.27358%0.581SS.*Hα-helixtrans-80.3-32.7172.177.50000110.2K144 R150 R151 S152K144-S148 VanDerWaalsContact O-CA 3.32Å; K144-S148 WeakPolarHBondContact O-CA 3.31Å; K144-S148 WeakPolarHBondContact O-CB 3.27Å; K144-S148 PolarHBondContact O-N 3.38Å; K144-S148 PolarHBondContact O-OG 3.46Å; S148-R150 PolarHBondContact O-N 2.91Å; S148-R150 VanDerWaalsContact O-N 3.16Å; S148-R151 PolarHBondContact O-N 3.16Å; S148-S152 WeakPolarHBondContact O-CA 3.46Å; S148-S152 WeakPolarHBondContact O-CB 3.43Å; S148-S152 PolarHBondContact O-N 3.37Å; S148-S152 PolarHBondContact O-OG 2.64Å
149L40.3Very low39.4Very low133 Ų133122.4 Ų122.470%0.69659%0.591SS**Hα-helixtrans-61.2-21.1162.4-97.282.9000112.4D145 A153D145-L149 VanDerWaalsContact O-CB 3.25Å; D145-L149 WeakPolarHBondContact O-CB 3.4Å; D145-L149 WeakPolarHBondContact O-CD1 3.49Å; D145-L149 PolarHBondContact O-N 3.23Å; L149-A153 WeakPolarHBondContact O-CB 3.28Å
150R37.1Very low38.1Very low209 Ų209128.8 Ų128.879%0.78963%0.628SS**Hα-helixtrans-93.5-19.8176-77.5-178.5154.2-155.7-4.2115.1S146 R147 S148S146-R150 WeakPolarHBondContact O-CG 3.32Å; R147-R150 CarbonylContact O-C 3.51Å; R147-R150 WeakPolarHBondContact O-CB 3.37Å; R147-R150 PolarHBondContact O-N 2.91Å; S148-R150 PolarHBondContact O-N 2.91Å; S148-R150 VanDerWaalsContact O-N 3.16Å
151R35.7Very low37.3Very low225 Ų225129.6 Ų129.685%0.84964%0.64SS**Hα-helixtrans-109.3-21178.9-74.218074174.22.4113.7R147 S148R147-R151 PolarHBondContact O-N 3.39Å; S148-R151 PolarHBondContact O-N 3.16Å
152S34Very low36.4Very low99 Ų99124.1 Ų124.169%0.69264%0.638SS**SBendtrans-95.53.2167.3-45.90000112S148 G154S148-S152 WeakPolarHBondContact O-CA 3.46Å; S148-S152 WeakPolarHBondContact O-CB 3.43Å; S148-S152 PolarHBondContact O-N 3.37Å; S148-S152 PolarHBondContact O-OG 2.64Å; S152-G154 PolarHBondContact O-N 2.93Å
153A38.7Very low36.1Very low65 Ų65125.1 Ų125.154%0.53764%0.644SS.*  trans-62.780.4148.500000107.3L149L149-A153 WeakPolarHBondContact O-CB 3.28Å
154G29Very low35.8Very low53 Ų53132.5 Ų132.555%0.54668%0.676SS.*  trans-43.4144.4148.100000107.8S152S152-G154 PolarHBondContact O-N 2.93Å
155R28.7Very low36.4Very low226 Ų226132 Ų13285%0.85368%0.679SS**SBendtrans-13.2111159-174178.8-157.6-122.55108.9T157R155-T157 PolarHBondContact O-N 3.41Å
156P34.8Very low36.8Very low114 Ų114130.1 Ų130.174%0.7467%0.672SS**  trans-58.3102.2-178.620.8-28.8000105.8E158P156-E158 PolarHBondContact O-N 3.2Å
157T31.8Very low37.4Very low114 Ų114133.4 Ų133.470%0.69969%0.69SS**  trans-62.2101.9154.449.50000101.8R155 K159R155-T157 PolarHBondContact O-N 3.41Å; T157-K159 PolarHBondContact O-N 3.04Å
158E34.6Very low38.4Very low152 Ų152129.5 Ų129.571%0.7168%0.681SS**  trans-51.384163.2-72.7175.9153.400106.6P156 D160 N287P156-E158 PolarHBondContact O-N 3.2Å; E158-D160 VanDerWaalsContact C-N 3.29Å; E158-D160 PolarHBondContact O-N 3.47Å; E158-N287 PolarHBondContact OE1-ND2 3.36Å
159K31.6Very low39.2Very low182 Ų182135.2 Ų135.279%0.79170%0.703SS**  trans-81.198153.4-84-170.3174.3-176.30103.9T157 S161T157-K159 PolarHBondContact O-N 3.04Å; K159-S161 PolarHBondContact O-N 2.92Å
160D33.3Very low39.8Very low168 Ų168134.2 Ų134.290%0.89870%0.695SS**  trans-44.483.5154.1-162.223.7000108.4E158E158-D160 VanDerWaalsContact C-N 3.29Å; E158-D160 PolarHBondContact O-N 3.47Å
161S35.2Very low40.7Very low95 Ų95124.6 Ų124.666%0.66466%0.661SS**  trans-111.5105.7174.21750000103.8K159 Y163K159-S161 PolarHBondContact O-N 2.92Å; S161-Y163 PolarHBondContact O-N 3.34Å
162G31.4Very low41.6Very low61 Ų61116.9 Ų116.963%0.62964%0.636SS**  trans-42.4127.1-179.800000110.7E164G162-E164 VanDerWaalsContact C-N 3.27Å; G162-E164 PolarHBondContact O-N 2.83Å
163Y40.1Very low42.7Very low193 Ų193118.4 Ų118.476%0.75763%0.627SS**  trans-66.497163.5-98.9-96.3000106.3S161 I165S161-Y163 PolarHBondContact O-N 3.34Å; Y163-I165 PolarHBondContact O-N 2.93Å
164E40.6Very low43.6Very low178 Ų178123.3 Ų123.383%0.83263%0.631SS**  trans-65115.7161.3-71.2-173.6168.900106.9G162 P166G162-E164 VanDerWaalsContact C-N 3.27Å; G162-E164 PolarHBondContact O-N 2.83Å; E164-P166 WeakPolarHBondContact O-CD 3.38Å
165I51.1Low44.9Very low145 Ų145124.4 Ų124.474%0.74463%0.627SS**  trans-57119.6167-62.5169.9000105.1Y163 T167Y163-I165 PolarHBondContact O-N 2.93Å; I165-T167 PolarHBondContact O-N 2.9Å
166P50Low46.2Very low50 Ų50115 Ų11533%0.32559%0.594SS.*  trans-54.7119.4179-22.431.6000108.9E164 I172 V175E164-P166 WeakPolarHBondContact O-CD 3.38Å; P166-I172 WeakPolarHBondContact O-CG1 3.5Å; P166-V175 HydrophobicContact CG-CG2 4.37Å
167T54.5Low47.4Very low137 Ų137112 Ų11284%0.8458%0.584SS**  trans-90-13.9-179.749.40000112I165I165-T167 PolarHBondContact O-N 2.9Å
168D57.6Low48.9Very low82 Ų82110 Ų11044%0.43959%0.585SS.*SBendtrans-83.8140.9175.971.3103.1000111.6E170 G171 I172D168-E170 PolarHBondContact O-N 2.96Å; D168-E170 VanDerWaalsContact O-N 3.11Å; D168-E170 PolarHBondContact OD1-N 3.42Å; D168-G171 PolarHBondContact O-N 2.85Å; D168-G171 VanDerWaalsContact O-N 3.09Å; D168-G171 PolarHBondContact OD1-N 2.67Å; D168-I172 WeakPolarHBondContact O-CG1 3.26Å; D168-I172 PolarHBondContact O-N 3.27Å
169E52.3Low50.5Low158 Ų158103.3 Ų103.374%0.73856%0.556SS**Hα-helixtrans-52.7-35.1-178.4-87.4-162.9151.400113.4I172 R173E169-I172 PolarHBondContact O-N 3.21Å; E169-R173 WeakPolarHBondContact O-CB 3.29Å; E169-R173 PolarHBondContact O-N 3.34Å
170E54.5Low52.4Low112 Ų11295 Ų9552%0.52352%0.52SS..Hα-helixtrans-76.4-33.9-176.5-167.763.5-150.200111.7D168 R174D168-E170 PolarHBondContact O-N 2.96Å; D168-E170 VanDerWaalsContact O-N 3.11Å; D168-E170 PolarHBondContact OD1-N 3.42Å; E170-R174 WeakPolarHBondContact O-CB 3.4Å; E170-R174 PolarHBondContact O-N 2.85Å; E170-R174 PolarHBondContact O-NE 3.17Å
171G56.1Low54.6Low7 Ų787.9 Ų87.97%0.07248%0.484CS..Hα-helixtrans-64.5-46.3168.800000111.6D168 R174 V175D168-G171 PolarHBondContact O-N 2.85Å; D168-G171 VanDerWaalsContact O-N 3.09Å; D168-G171 PolarHBondContact OD1-N 2.67Å; G171-R174 PolarHBondContact O-N 3.46Å; G171-V175 WeakPolarHBondContact O-CG2 3.46Å; G171-V175 PolarHBondContact O-N 3.39Å; G171-V175 VanDerWaalsContact O-N 3.09Å
172I54.5Low56.7Low63 Ų6385.4 Ų85.432%0.32347%0.469SS..Hα-helixtrans-62.2-48.7176.3-63.6170.3000110.3P166 D168 E169 R174 V175 L176P166-I172 WeakPolarHBondContact O-CG1 3.5Å; D168-I172 WeakPolarHBondContact O-CG1 3.26Å; D168-I172 PolarHBondContact O-N 3.27Å; E169-I172 PolarHBondContact O-N 3.21Å; I172-R174 VanDerWaalsContact C-N 3.33Å; I172-R174 PolarHBondContact O-N 3.38Å; I172-V175 PolarHBondContact O-N 3.17Å; I172-V175 VanDerWaalsContact O-N 3.12Å; I172-L176 HydrophobicContact CG2-CD1 3.59Å; I172-L176 HydrophobicContact CG2-CG 4.16Å; I172-L176 WeakPolarHBondContact O-CB 3.34Å; I172-L176 VanDerWaalsContact O-CG 3.25Å; I172-L176 WeakPolarHBondContact O-CG 3.45Å; I172-L176 PolarHBondContact O-N 3.43Å
173R55.9Low59Low132 Ų13288.6 Ų88.650%0.49847%0.468SS..Hα-helixtrans-60.6-37.1177.8-88.8-175.5168.5-165.90.4114E169 L176 G177 E184E169-R173 WeakPolarHBondContact O-CB 3.29Å; E169-R173 PolarHBondContact O-N 3.34Å; R173-L176 PolarHBondContact O-N 3.12Å; R173-G177 PolarHBondContact O-N 2.86Å; R173-G177 VanDerWaalsContact O-N 3.17Å; R173-E184 IonicContact NH2-OE1 3.94Å; R173-E184 PolarHBondContact NH2-OE1 3.43Å; R173-E184 VanDerWaalsContact NH2-OE1 3.17Å
174R58Low60.8Low168 Ų16881.9 Ų81.963%0.63444%0.443SS*.Hα-helixtrans-66.1-39.8174.7-91.3-178.2-77.1-178.5-4.7112.1E170 G171 I172E170-R174 WeakPolarHBondContact O-CB 3.4Å; E170-R174 PolarHBondContact O-N 2.85Å; E170-R174 PolarHBondContact O-NE 3.17Å; G171-R174 PolarHBondContact O-N 3.46Å; I172-R174 VanDerWaalsContact C-N 3.33Å; I172-R174 PolarHBondContact O-N 3.38Å
175V55.9Low62.9Low76 Ų7673.8 Ų73.846%0.46141%0.406SS..Hα-helixtrans-67.1-40.1175.6173.10000110.9P166 G171 I172 G177 R272P166-V175 HydrophobicContact CG-CG2 4.37Å; G171-V175 WeakPolarHBondContact O-CG2 3.46Å; G171-V175 PolarHBondContact O-N 3.39Å; G171-V175 VanDerWaalsContact O-N 3.09Å; I172-V175 PolarHBondContact O-N 3.17Å; I172-V175 VanDerWaalsContact O-N 3.12Å; V175-G177 VanDerWaalsContact C-N 3.28Å; V175-G177 PolarHBondContact O-N 3.18Å; V175-R272 PolarHBondContact O-NH2 3Å
176L56Low64.4Low29 Ų2971.7 Ų71.715%0.15240%0.395CS..THydrogen-bonded Turntrans-77.2-4.3-178.9-66.1176.8000114.5I172 R173 G178 A179 E269I172-L176 HydrophobicContact CG2-CD1 3.59Å; I172-L176 HydrophobicContact CG2-CG 4.16Å; I172-L176 WeakPolarHBondContact O-CB 3.34Å; I172-L176 VanDerWaalsContact O-CG 3.25Å; I172-L176 WeakPolarHBondContact O-CG 3.45Å; I172-L176 PolarHBondContact O-N 3.43Å; R173-L176 PolarHBondContact O-N 3.12Å; L176-G178 PolarHBondContact O-N 3.35Å; L176-G178 VanDerWaalsContact O-N 3.1Å; L176-A179 HydrophobicContact CB-CB 4.46Å; L176-A179 WeakPolarHBondContact O-CB 3.46Å; L176-A179 PolarHBondContact O-N 3.01Å; L176-E269 HydrophobicContact CD2-CG 4.02Å
177G60.7Low66Low51 Ų5172 Ų7253%0.52640%0.402SS..THydrogen-bonded Turntrans59.227.8175.100000114.8R173 V175 A179R173-G177 PolarHBondContact O-N 2.86Å; R173-G177 VanDerWaalsContact O-N 3.17Å; V175-G177 VanDerWaalsContact C-N 3.28Å; V175-G177 PolarHBondContact O-N 3.18Å; G177-A179 VanDerWaalsContact C-N 3.33Å
178G62.3Low67.3Low71 Ų7167.6 Ų67.673%0.73237%0.372SS*.THydrogen-bonded Turntrans816.1-17500000115L176L176-G178 PolarHBondContact O-N 3.35Å; L176-G178 VanDerWaalsContact O-N 3.1Å
179A68.4Low68.5Low12 Ų1267.1 Ų67.110%0.09937%0.37CS..PPolyproline II helixtrans-68.8146.9164.900000110L176 G177 E269L176-A179 HydrophobicContact CB-CB 4.46Å; L176-A179 WeakPolarHBondContact O-CB 3.46Å; L176-A179 PolarHBondContact O-N 3.01Å; G177-A179 VanDerWaalsContact C-N 3.33Å; A179-E269 HydrophobicContact CB-CB 3.82Å; A179-E269 HydrophobicContact CB-CG 4.03Å
180P73Confident70Confident6 Ų665.4 Ų65.44%0.03936%0.361CS..PPolyproline II helixtrans-60.2144.2174.327.4-35.3000110.2E184 M185 R262 F266P180-E184 HydrophobicContact CB-CB 4.17Å; P180-M185 HydrophobicContact CB-CG 4.07Å; P180-M185 HydrophobicContact CB-SD 3.82Å; P180-M185 HydrophobicContact CG-CG 3.93Å; P180-M185 HydrophobicContact CG-SD 3.38Å; P180-M185 WeakPolarHBondContact CG-SD 3.46Å; P180-R262 HydrophobicContact CG-CB 3.91Å; P180-R262 HydrophobicContact CG-CG 4.12Å; P180-F266 HydrophobicContact CG-CB 4.29Å; P180-F266 WeakPolarHBondContact O-CD2 3.48Å
181S78Confident71.1Confident20 Ų2065.1 Ų65.114%0.1436%0.363CS..PPolyproline II helixtrans-68.1165.4171.786.30000110.9E183 E184 M185S181-E183 VanDerWaalsContact CB-OE2 3.22Å; S181-E183 WeakPolarHBondContact CB-OE2 3.3Å; S181-E183 PolarHBondContact O-N 3.23Å; S181-E183 PolarHBondContact OG-N 3.16Å; S181-E183 PolarHBondContact OG-OE2 3.49Å; S181-E184 PolarHBondContact O-N 3.36Å; S181-E184 PolarHBondContact OG-N 2.86Å; S181-M185 WeakPolarHBondContact O-CG 3.44Å; S181-M185 PolarHBondContact O-N 3.27Å
182A80.6Confident72.1Confident42 Ų4266.9 Ų66.935%0.34737%0.37SS..Hα-helixtrans-60.9-37.3175.400000111.2M185 L186 F266A182-M185 WeakPolarHBondContact O-CB 3.39Å; A182-M185 PolarHBondContact O-N 2.99Å; A182-L186 VanDerWaalsContact O-CG 3.31Å; A182-L186 WeakPolarHBondContact O-CG 3.46Å; A182-L186 PolarHBondContact O-N 3.24Å; A182-F266 HydrophobicContact CB-CE2 4.13Å; A182-F266 HydrophobicContact CB-CZ 4.25Å
183E78.7Confident73.3Confident128 Ų12871.1 Ų71.160%0.59839%0.389SS*.Hα-helixtrans-67.8-43.5176.9-55.274.2-159.300111.5S181 M185 L186 A187S181-E183 VanDerWaalsContact CB-OE2 3.22Å; S181-E183 WeakPolarHBondContact CB-OE2 3.3Å; S181-E183 PolarHBondContact O-N 3.23Å; S181-E183 PolarHBondContact OG-N 3.16Å; S181-E183 PolarHBondContact OG-OE2 3.49Å; E183-M185 VanDerWaalsContact C-N 3.26Å; E183-M185 PolarHBondContact O-N 3.47Å; E183-L186 PolarHBondContact O-N 2.89Å; E183-A187 WeakPolarHBondContact O-CB 3.3Å; E183-A187 PolarHBondContact O-N 3.39Å
184E78.3Confident74.2Confident53 Ų5371.9 Ų71.925%0.24840%0.403CS..Hα-helixtrans-60.1-39.3173.1-72.7-170.9-175.100111R173 P180 S181 M188 R262R173-E184 IonicContact NH2-OE1 3.94Å; R173-E184 PolarHBondContact NH2-OE1 3.43Å; R173-E184 VanDerWaalsContact NH2-OE1 3.17Å; P180-E184 HydrophobicContact CB-CB 4.17Å; S181-E184 PolarHBondContact O-N 3.36Å; S181-E184 PolarHBondContact OG-N 2.86Å; E184-M188 VanDerWaalsContact O-CG 3.31Å; E184-M188 WeakPolarHBondContact O-CG 3.48Å; E184-M188 PolarHBondContact O-N 3.11Å; E184-R262 IonicContact OE2-CZ 3.52Å; E184-R262 IonicContact OE2-NH1 2.66Å; E184-R262 PolarHBondContact OE2-NH1 3.13Å
185M83.6Confident75.1Confident8 Ų864.3 Ų64.34%0.03938%0.376CS..Hα-helixtrans-65.1-44.7176.2-73.7-55.4-47.200112.1P180 S181 A182 E183 M188 L189 R262 L263 F266P180-M185 HydrophobicContact CB-CG 4.07Å; P180-M185 HydrophobicContact CB-SD 3.82Å; P180-M185 HydrophobicContact CG-CG 3.93Å; P180-M185 HydrophobicContact CG-SD 3.38Å; P180-M185 WeakPolarHBondContact CG-SD 3.46Å; S181-M185 WeakPolarHBondContact O-CG 3.44Å; S181-M185 PolarHBondContact O-N 3.27Å; A182-M185 WeakPolarHBondContact O-CB 3.39Å; A182-M185 PolarHBondContact O-N 2.99Å; E183-M185 VanDerWaalsContact C-N 3.26Å; E183-M185 PolarHBondContact O-N 3.47Å; M185-M188 PolarHBondContact O-N 2.82Å; M185-L189 WeakPolarHBondContact O-CG 3.37Å; M185-L189 PolarHBondContact O-N 3.46Å; M185-R262 HydrophobicContact CE-CB 4.3Å; M185-R262 HydrophobicContact SD-CB 3.65Å; M185-L263 HydrophobicContact CE-CB 4.18Å; M185-L263 HydrophobicContact CE-CD2 3.55Å; M185-L263 HydrophobicContact CE-CG 3.46Å; M185-L263 VanDerWaalsContact CE-CG 3.46Å; M185-F266 HydrophobicContact CG-CB 4.17Å; M185-F266 HydrophobicContact CG-CD2 4.05Å; M185-F266 HydrophobicContact CG-CG 4.07Å; M185-F266 HydrophobicContact SD-CB 4.33Å
186L83.3Confident75.9Confident101 Ų10161.9 Ų61.953%0.52936%0.362SS..Hα-helixtrans-61.7-48.7178.3-74.9168.2000111.3A182 E183 M188 L189 E190A182-L186 VanDerWaalsContact O-CG 3.31Å; A182-L186 WeakPolarHBondContact O-CG 3.46Å; A182-L186 PolarHBondContact O-N 3.24Å; E183-L186 PolarHBondContact O-N 2.89Å; L186-M188 PolarHBondContact O-N 2.88Å; L186-L189 PolarHBondContact O-N 3.04Å; L186-E190 WeakPolarHBondContact O-CG 3.48Å; L186-E190 PolarHBondContact O-N 3.49Å
187A83.1Confident77.1Confident56 Ų5662.7 Ų62.746%0.46337%0.37SS..Hα-helixtrans-58.2-35.7178.500000112.5E183 L191E183-A187 WeakPolarHBondContact O-CB 3.3Å; E183-A187 PolarHBondContact O-N 3.39Å; A187-L191 PolarHBondContact O-N 3.14Å
188M82.2Confident78Confident45 Ų4563.4 Ų63.422%0.22237%0.371CS..Hα-helixtrans-73.5-33.8175.8-68.7-171176.100113.5E184 M185 L186 L191 E258 I259 R262E184-M188 VanDerWaalsContact O-CG 3.31Å; E184-M188 WeakPolarHBondContact O-CG 3.48Å; E184-M188 PolarHBondContact O-N 3.11Å; M185-M188 PolarHBondContact O-N 2.82Å; L186-M188 PolarHBondContact O-N 2.88Å; M188-L191 WeakPolarHBondContact O-CB 3.49Å; M188-L191 PolarHBondContact O-N 3.5Å; M188-E258 HydrophobicContact SD-CG 4.46Å; M188-I259 HydrophobicContact CB-CD1 4.14Å; M188-I259 HydrophobicContact CB-CG1 3.83Å; M188-I259 WeakPolarHBondContact O-CD1 3.17Å; M188-I259 HydrophobicContact SD-CG1 4.42Å; M188-R262 VanDerWaalsContact CE-CD 3.46Å; M188-R262 VanDerWaalsContact CE-NE 3.34Å; M188-R262 WeakPolarHBondContact SD-CD 3.28Å
189L83.5Confident79.1Confident72 Ų7262 Ų6238%0.37735%0.346SS..Hα-helixtrans-70.3-38.8175.4-69.5169.9000111.1M185 L186 L191 L192 I259M185-L189 WeakPolarHBondContact O-CG 3.37Å; M185-L189 PolarHBondContact O-N 3.46Å; L186-L189 PolarHBondContact O-N 3.04Å; L189-L191 VanDerWaalsContact C-N 3.27Å; L189-L191 PolarHBondContact O-N 3.03Å; L189-L192 WeakPolarHBondContact O-CB 3.33Å; L189-L192 PolarHBondContact O-N 3.25Å; L189-I259 HydrophobicContact CD2-CG2 3.95Å
190E83.9Confident80.1Confident121 Ų12164 Ų6457%0.56536%0.363SS*.Hα-helixtrans-59.4-37.8172.9-73.5173.9179.500111.8L186 L192 E193L186-E190 WeakPolarHBondContact O-CG 3.48Å; L186-E190 PolarHBondContact O-N 3.49Å; E190-L192 PolarHBondContact O-N 3.46Å; E190-L192 VanDerWaalsContact O-N 3.17Å; E190-E193 WeakPolarHBondContact O-CB 3.38Å; E190-E193 PolarHBondContact O-N 3.33Å
191L77.4Confident81Confident106 Ų10669.3 Ų69.356%0.55539%0.387SS*.Hα-helixtrans-60.1-27.3174.5-167.671.4000112.4A187 M188 L189A187-L191 PolarHBondContact O-N 3.14Å; M188-L191 WeakPolarHBondContact O-CB 3.49Å; M188-L191 PolarHBondContact O-N 3.5Å; L189-L191 VanDerWaalsContact C-N 3.27Å; L189-L191 PolarHBondContact O-N 3.03Å
192L77.9Confident81.7Confident44 Ų4468.7 Ų68.723%0.2338%0.383CS..Hα-helixtrans-76.9-23177.1-69.8177.8000113.5L189 E190 N194 S195 R256 I259L189-L192 WeakPolarHBondContact O-CB 3.33Å; L189-L192 PolarHBondContact O-N 3.25Å; E190-L192 PolarHBondContact O-N 3.46Å; E190-L192 VanDerWaalsContact O-N 3.17Å; L192-N194 PolarHBondContact O-N 3.44Å; L192-S195 VanDerWaalsContact CA-OG 3.28Å; L192-S195 WeakPolarHBondContact CA-OG 3.32Å; L192-S195 VanDerWaalsContact O-CB 3.29Å; L192-S195 WeakPolarHBondContact O-CB 3.4Å; L192-S195 PolarHBondContact O-N 3.12Å; L192-S195 PolarHBondContact O-OG 3.06Å; L192-R256 HydrophobicContact CD2-CG 3.65Å; L192-I259 HydrophobicContact CD1-CD1 3.39Å; L192-I259 HydrophobicContact CD1-CG2 4.33Å; L192-I259 HydrophobicContact CD2-CD1 3.83Å; L192-I259 HydrophobicContact CG-CD1 3.39Å
193E78.7Confident82.2Confident152 Ų15272.5 Ų72.571%0.7139%0.388SS*.Hα-helixtrans-63.8-33.5-180-67.8-168.4154.200111.7E190E190-E193 WeakPolarHBondContact O-CB 3.38Å; E190-E193 PolarHBondContact O-N 3.33Å
194N74.4Confident83Confident148 Ų14871.4 Ų71.479%0.79138%0.383SS*.THydrogen-bonded Turntrans-99.733.6178.2-63.3-56.2000113L192L192-N194 PolarHBondContact O-N 3.44Å
195S78.2Confident83.7Confident10 Ų1074.6 Ų74.67%0.0739%0.393CS..  trans-71.1147.6-176-69.30000113.4L192 S197 A198L192-S195 VanDerWaalsContact CA-OG 3.28Å; L192-S195 WeakPolarHBondContact CA-OG 3.32Å; L192-S195 VanDerWaalsContact O-CB 3.29Å; L192-S195 WeakPolarHBondContact O-CB 3.4Å; L192-S195 PolarHBondContact O-N 3.12Å; L192-S195 PolarHBondContact O-OG 3.06Å; S195-S197 PolarHBondContact O-N 2.98Å; S195-S197 VanDerWaalsContact O-N 3.15Å; S195-A198 WeakPolarHBondContact O-CA 3.46Å; S195-A198 VanDerWaalsContact O-CB 3.26Å; S195-A198 WeakPolarHBondContact O-CB 3.32Å; S195-A198 PolarHBondContact O-N 2.93Å
196P72.1Confident84.2Confident25 Ų2576.3 Ų76.316%0.16240%0.401CS..G310 helixtrans-52.4-33.7172.2-2734.6000114.7A198 D199 R248 E252P196-A198 PolarHBondContact O-N 3.01Å; P196-D199 WeakPolarHBondContact O-CB 3.38Å; P196-D199 PolarHBondContact O-N 3.08Å; P196-R248 HydrophobicContact CB-CB 3.8Å; P196-R248 HydrophobicContact CG-CB 3.64Å; P196-R248 HydrophobicContact CG-CG 4.46Å; P196-E252 WeakPolarHBondContact CD-OE2 3.14Å; P196-E252 HydrophobicContact CG-CB 4.36Å
197S79.9Confident84.6Confident46 Ų4675.3 Ų75.332%0.32241%0.408SS..G310 helixtrans-60.7-28.7173.2-176.70000113.1S195 D199 R203 E252S195-S197 PolarHBondContact O-N 2.98Å; S195-S197 VanDerWaalsContact O-N 3.15Å; S197-D199 VanDerWaalsContact C-N 3.33Å; S197-R203 PolarHBondContact O-NE 2.68Å; S197-R203 PolarHBondContact O-NH2 3.25Å; S197-E252 VanDerWaalsContact CB-OE1 3.26Å; S197-E252 WeakPolarHBondContact CB-OE1 3.44Å; S197-E252 WeakPolarHBondContact CB-OE2 3.45Å; S197-E252 PolarHBondContact N-OE2 2.92Å
198A80.6Confident85.2Confident66 Ų6679.7 Ų79.755%0.54542%0.417SS..G310 helixtrans-81.3-11174.600000113S195 P196 A200S195-A198 WeakPolarHBondContact O-CA 3.46Å; S195-A198 VanDerWaalsContact O-CB 3.26Å; S195-A198 WeakPolarHBondContact O-CB 3.32Å; S195-A198 PolarHBondContact O-N 2.93Å; P196-A198 PolarHBondContact O-N 3.01Å; A198-A200 PolarHBondContact O-N 3.44Å
199D85.6Confident85.7Confident40 Ų4080.1 Ų80.121%0.21442%0.417CS..  trans-72.678.9175.8-172.6-10.3000110.3P196 S197 E201 T202 R203 R248P196-D199 WeakPolarHBondContact O-CB 3.38Å; P196-D199 PolarHBondContact O-N 3.08Å; S197-D199 VanDerWaalsContact C-N 3.33Å; D199-E201 VanDerWaalsContact C-N 3.27Å; D199-E201 PolarHBondContact O-N 2.82Å; D199-E201 PolarHBondContact OD1-N 2.82Å; D199-T202 WeakPolarHBondContact OD1-CB 3.33Å; D199-T202 PolarHBondContact OD1-N 3.09Å; D199-T202 PolarHBondContact OD1-OG1 3.09Å; D199-T202 WeakPolarHBondContact OD2-CB 3.11Å; D199-T202 PolarHBondContact OD2-OG1 2.95Å; D199-R203 WeakPolarHBondContact O-CG 3.39Å; D199-R203 PolarHBondContact O-N 2.93Å; D199-R248 IonicContact OD2-CZ 2.62Å; D199-R248 IonicContact OD2-NH1 3.62Å; D199-R248 PolarHBondContact OD2-NH1 2.95Å; D199-R248 IonicContact OD2-NH2 2.65Å
200A90.2Very high86.1Confident55 Ų5578.5 Ų78.546%0.45541%0.411SS..Hα-helixtrans-63.7-34.5178.900000111.8A198 R203 E204A198-A200 PolarHBondContact O-N 3.44Å; A200-R203 PolarHBondContact O-N 3.34Å; A200-E204 WeakPolarHBondContact O-CB 3.38Å; A200-E204 PolarHBondContact O-N 3.35Å
201E91.2Very high86.3Confident117 Ų11778 Ų7855%0.54742%0.418SS..Hα-helixtrans-65.7-48.7-177.8-168.4-175.2176.200111.3D199 R203 E204 R205D199-E201 VanDerWaalsContact C-N 3.27Å; D199-E201 PolarHBondContact O-N 2.82Å; D199-E201 PolarHBondContact OD1-N 2.82Å; E201-R203 VanDerWaalsContact C-N 3.29Å; E201-R203 PolarHBondContact O-N 3.21Å; E201-E204 PolarHBondContact O-N 3Å; E201-R205 WeakPolarHBondContact O-CG 3.26Å; E201-R205 PolarHBondContact O-N 3.16Å; E201-R205 IonicContact OE1-CZ 3.54Å; E201-R205 IonicContact OE1-NE 3.86Å; E201-R205 IonicContact OE1-NH2 2.66Å; E201-R205 PolarHBondContact OE1-NH2 2.96Å; E201-R205 IonicContact OE2-NH2 3.53Å
202T91.5Very high86.8Confident8 Ų876.4 Ų76.45%0.04941%0.405CS..Hα-helixtrans-60.9-41.3175.4-630000111.1D199 E204 R205 I206 L241 Y245 R248D199-T202 WeakPolarHBondContact OD1-CB 3.33Å; D199-T202 PolarHBondContact OD1-N 3.09Å; D199-T202 PolarHBondContact OD1-OG1 3.09Å; D199-T202 WeakPolarHBondContact OD2-CB 3.11Å; D199-T202 PolarHBondContact OD2-OG1 2.95Å; T202-E204 VanDerWaalsContact C-N 3.31Å; T202-E204 PolarHBondContact O-N 3.46Å; T202-R205 PolarHBondContact O-N 3.27Å; T202-I206 HydrophobicContact CG2-CD1 3.86Å; T202-I206 HydrophobicContact CG2-CG1 4.34Å; T202-I206 WeakPolarHBondContact O-CG1 2.96Å; T202-I206 PolarHBondContact O-N 3.39Å; T202-L241 HydrophobicContact CG2-CD1 4.02Å; T202-L241 HydrophobicContact CG2-CG 4.27Å; T202-Y245 HydrophobicContact CG2-CD2 3.68Å; T202-Y245 HydrophobicContact CG2-CE2 4.45Å; T202-Y245 HydrophobicContact CG2-CG 4.26Å; T202-R248 PolarHBondContact OG1-NH2 3.16Å
203R92.4Very high87.4Confident122 Ų12274.8 Ų74.846%0.4640%0.397SS..Hα-helixtrans-61.8-39.9177.4-74-171.1-68.1149.7-3.4112.2S197 D199 A200 E201 I206 A207 Y245S197-R203 PolarHBondContact O-NE 2.68Å; S197-R203 PolarHBondContact O-NH2 3.25Å; D199-R203 WeakPolarHBondContact O-CG 3.39Å; D199-R203 PolarHBondContact O-N 2.93Å; A200-R203 PolarHBondContact O-N 3.34Å; E201-R203 VanDerWaalsContact C-N 3.29Å; E201-R203 PolarHBondContact O-N 3.21Å; R203-I206 PolarHBondContact O-N 3.49Å; R203-A207 WeakPolarHBondContact O-CB 3.32Å; R203-A207 PolarHBondContact O-N 3.05Å; R203-Y245 WeakPolarHBondContact CD-OH 3.48Å; R203-Y245 HydrophobicContact CG-CE2 3.91Å; R203-Y245 WeakPolarHBondContact CG-OH 3.25Å
204E94.2Very high87.8Confident105 Ų10575.2 Ų75.249%0.49140%0.403SS..Hα-helixtrans-66.1-42.4176.4-166.9-172.3159.600111.5A200 E201 T202 I206 A207 K208A200-E204 WeakPolarHBondContact O-CB 3.38Å; A200-E204 PolarHBondContact O-N 3.35Å; E201-E204 PolarHBondContact O-N 3Å; T202-E204 VanDerWaalsContact C-N 3.31Å; T202-E204 PolarHBondContact O-N 3.46Å; E204-I206 VanDerWaalsContact C-N 3.34Å; E204-I206 PolarHBondContact O-N 3.3Å; E204-A207 PolarHBondContact O-N 2.98Å; E204-K208 HydrophobicContact CG-CD 4.34Å; E204-K208 WeakPolarHBondContact O-CG 3.22Å; E204-K208 PolarHBondContact O-N 3.27Å; E204-K208 WeakPolarHBondContact OE1-CE 3.33Å; E204-K208 IonicContact OE1-NZ 3.63Å; E204-K208 PolarHBondContact OE1-NZ 3.41Å
205R93.8Very high88.5Confident120 Ų12071 Ų7145%0.45338%0.38SS..Hα-helixtrans-60.1-44.2174.3-67.8-178.9-155.7160.72.5111.6E201 T202 A207 K208 L241E201-R205 WeakPolarHBondContact O-CG 3.26Å; E201-R205 PolarHBondContact O-N 3.16Å; E201-R205 IonicContact OE1-CZ 3.54Å; E201-R205 IonicContact OE1-NE 3.86Å; E201-R205 IonicContact OE1-NH2 2.66Å; E201-R205 PolarHBondContact OE1-NH2 2.96Å; E201-R205 IonicContact OE2-NH2 3.53Å; T202-R205 PolarHBondContact O-N 3.27Å; R205-A207 VanDerWaalsContact C-N 3.33Å; R205-A207 PolarHBondContact O-N 2.82Å; R205-K208 PolarHBondContact O-N 3.06Å; R205-L241 HydrophobicContact CB-CD2 3.95Å
206I93.4Very high88.9Confident43 Ų4374.7 Ų74.722%0.22141%0.406CS..Hα-helixtrans-61.7-42.8175.7-67.3168.2000110.7T202 R203 E204 K208 F209 L241 V242 Y245T202-I206 HydrophobicContact CG2-CD1 3.86Å; T202-I206 HydrophobicContact CG2-CG1 4.34Å; T202-I206 WeakPolarHBondContact O-CG1 2.96Å; T202-I206 PolarHBondContact O-N 3.39Å; R203-I206 PolarHBondContact O-N 3.49Å; E204-I206 VanDerWaalsContact C-N 3.34Å; E204-I206 PolarHBondContact O-N 3.3Å; I206-K208 VanDerWaalsContact C-N 3.27Å; I206-K208 PolarHBondContact O-N 2.96Å; I206-F209 WeakPolarHBondContact O-CD2 3.34Å; I206-F209 PolarHBondContact O-N 3.25Å; I206-L241 HydrophobicContact CG1-CD2 3.82Å; I206-L241 HydrophobicContact CG1-CG 4.07Å; I206-V242 HydrophobicContact CD1-CG2 4.29Å; I206-V242 HydrophobicContact CG1-CG2 4.12Å; I206-V242 HydrophobicContact CG2-CG2 3.92Å; I206-Y245 HydrophobicContact CD1-CD1 3.91Å; I206-Y245 HydrophobicContact CD1-CD2 4.26Å; I206-Y245 HydrophobicContact CD1-CG 3.69Å
207A93.3Very high89.7Confident81 Ų8176.6 Ų76.667%0.66943%0.425SS*.Hα-helixtrans-68.2-24.2179.600000113.8R203 E204 R205 F209R203-A207 WeakPolarHBondContact O-CB 3.32Å; R203-A207 PolarHBondContact O-N 3.05Å; E204-A207 PolarHBondContact O-N 2.98Å; R205-A207 VanDerWaalsContact C-N 3.33Å; R205-A207 PolarHBondContact O-N 2.82Å; A207-F209 VanDerWaalsContact C-N 3.31Å
208K94.6Very high90Very high147 Ų14780.2 Ų80.264%0.63943%0.434SS*.THydrogen-bonded Turntrans-77.3-12.4177.1-79.4170.5171.91690113.6E204 R205 I206E204-K208 HydrophobicContact CG-CD 4.34Å; E204-K208 WeakPolarHBondContact O-CG 3.22Å; E204-K208 PolarHBondContact O-N 3.27Å; E204-K208 WeakPolarHBondContact OE1-CE 3.33Å; E204-K208 IonicContact OE1-NZ 3.63Å; E204-K208 PolarHBondContact OE1-NZ 3.41Å; R205-K208 PolarHBondContact O-N 3.06Å; I206-K208 VanDerWaalsContact C-N 3.27Å; I206-K208 PolarHBondContact O-N 2.96Å
209F93.4Very high90.4Very high55 Ų5577.2 Ų77.224%0.24141%0.409CS..SBendtrans-63.8133.5176.7-75.9-61.6000111.2I206 A207 L213 A238 L241I206-F209 WeakPolarHBondContact O-CD2 3.34Å; I206-F209 PolarHBondContact O-N 3.25Å; A207-F209 VanDerWaalsContact C-N 3.31Å; F209-L213 HydrophobicContact CB-CD1 4.46Å; F209-L213 HydrophobicContact CD1-CD1 4.2Å; F209-A238 HydrophobicContact CD1-CB 3.69Å; F209-A238 HydrophobicContact CD2-CB 3.69Å; F209-A238 HydrophobicContact CE1-CB 3.64Å; F209-A238 HydrophobicContact CE2-CB 3.63Å; F209-A238 HydrophobicContact CG-CB 3.74Å; F209-A238 HydrophobicContact CZ-CB 3.63Å; F209-L241 HydrophobicContact CE2-CD2 3.93Å; F209-L241 HydrophobicContact CZ-CD2 4.35Å
210P90.7Very high90.4Very high38 Ų3882 Ų8225%0.24743%0.432CS..  trans-60.2138.5-179.4-2430.3000113Y212 L213P210-Y212 HydrophobicContact CB-CD1 3.3Å; P210-Y212 HydrophobicContact CB-CE1 3.11Å; P210-Y212 HydrophobicContact CB-CG 4.29Å; P210-Y212 HydrophobicContact CG-CD1 4.31Å; P210-Y212 HydrophobicContact CG-CE1 3.62Å; P210-Y212 PolarHBondContact O-N 2.8Å; P210-Y212 VanDerWaalsContact O-N 3.16Å; P210-L213 HydrophobicContact CB-CG 4.33Å; P210-L213 HydrophobicContact CG-CD1 4.3Å; P210-L213 WeakPolarHBondContact O-CB 3.41Å; P210-L213 PolarHBondContact O-N 3.4Å; P210-L213 VanDerWaalsContact O-N 3.09Å
211P88.4Confident90.4Very high109 Ų10982.9 Ų82.971%0.70844%0.439SS*.G310 helixtrans-66.1-21.1-178.225.3-33.7000113.2L213 L214P211-L213 PolarHBondContact O-N 3.03Å; P211-L214 WeakPolarHBondContact O-CB 3.46Å; P211-L214 PolarHBondContact O-N 2.8Å
212Y89.2Confident90.4Very high74 Ų7478.8 Ų78.829%0.2942%0.42SS..G310 helixtrans-67.3-23176.676.7-99.2000112.4P210 L214 D215 M222 A231 E234P210-Y212 HydrophobicContact CB-CD1 3.3Å; P210-Y212 HydrophobicContact CB-CE1 3.11Å; P210-Y212 HydrophobicContact CB-CG 4.29Å; P210-Y212 HydrophobicContact CG-CD1 4.31Å; P210-Y212 HydrophobicContact CG-CE1 3.62Å; P210-Y212 PolarHBondContact O-N 2.8Å; P210-Y212 VanDerWaalsContact O-N 3.16Å; Y212-L214 PolarHBondContact O-N 2.75Å; Y212-D215 PolarHBondContact O-N 3.14Å; Y212-D215 VanDerWaalsContact O-N 3.1Å; Y212-M222 HydrophobicContact CE2-CE 4.47Å; Y212-A231 HydrophobicContact CE2-CB 4.02Å; Y212-E234 PolarHBondContact OH-OE2 3.05Å
213L90.1Very high90.3Very high10 Ų1087.2 Ų87.25%0.05246%0.46CS..G310 helixtrans-66.3-20.2177.1-64.9178.7000112.7F209 P210 P211 D215 I219 A231 E234 L235F209-L213 HydrophobicContact CB-CD1 4.46Å; F209-L213 HydrophobicContact CD1-CD1 4.2Å; P210-L213 HydrophobicContact CB-CG 4.33Å; P210-L213 HydrophobicContact CG-CD1 4.3Å; P210-L213 WeakPolarHBondContact O-CB 3.41Å; P210-L213 PolarHBondContact O-N 3.4Å; P210-L213 VanDerWaalsContact O-N 3.09Å; P211-L213 PolarHBondContact O-N 3.03Å; L213-D215 VanDerWaalsContact C-N 3.26Å; L213-D215 PolarHBondContact O-N 3.25Å; L213-I219 HydrophobicContact CD2-CD1 4.3Å; L213-A231 HydrophobicContact CD2-CB 4.31Å; L213-A231 WeakPolarHBondContact CD2-O 3.3Å; L213-E234 HydrophobicContact CD1-CB 4Å; L213-E234 HydrophobicContact CD2-CB 4.4Å; L213-L235 HydrophobicContact CB-CD1 4.29Å; L213-L235 HydrophobicContact CD2-CB 4.27Å; L213-L235 WeakPolarHBondContact O-CD1 3.48Å
214L85.8Confident90.3Very high160 Ų16085 Ų8584%0.83846%0.457SS*.G310 helixtrans-76.5-15.8176.1-60.9169.4000112.6P211 Y212P211-L214 WeakPolarHBondContact O-CB 3.46Å; P211-L214 PolarHBondContact O-N 2.8Å; Y212-L214 PolarHBondContact O-N 2.75Å
215D89Confident90.2Very high59 Ų5983.1 Ų83.132%0.31645%0.454SS..  trans-107.997.2-175.1-171.6-16.5000110.4Y212 L213 A217 K218 I219Y212-D215 PolarHBondContact O-N 3.14Å; Y212-D215 VanDerWaalsContact O-N 3.1Å; L213-D215 VanDerWaalsContact C-N 3.26Å; L213-D215 PolarHBondContact O-N 3.25Å; D215-A217 PolarHBondContact O-N 3.24Å; D215-A217 VanDerWaalsContact O-N 3.12Å; D215-A217 WeakPolarHBondContact OD1-CB 3.39Å; D215-A217 PolarHBondContact OD1-N 2.88Å; D215-K218 HydrophobicContact CB-CB 4.23Å; D215-K218 HydrophobicContact CB-CD 3.94Å; D215-K218 HydrophobicContact CB-CG 4.08Å; D215-K218 PolarHBondContact O-N 2.75Å; D215-K218 VanDerWaalsContact O-N 3.11Å; D215-K218 PolarHBondContact OD1-N 3.16Å; D215-K218 WeakPolarHBondContact OD2-CD 3.29Å; D215-K218 WeakPolarHBondContact OD2-CE 3.5Å; D215-K218 WeakPolarHBondContact OD2-CG 3.45Å; D215-K218 IonicContact OD2-NZ 3.96Å; D215-I219 PolarHBondContact O-N 2.94Å
216S86.9Confident90.2Very high88 Ų8884.1 Ų84.162%0.61546%0.463SS*.Hα-helixtrans-56.7-28.6178.4-175.70000112.8M220S216-M220 WeakPolarHBondContact O-CG 3.33Å; S216-M220 PolarHBondContact O-N 2.66Å
217A89.2Confident90.1Very high66 Ų6687.2 Ų87.255%0.54548%0.477SS..Hα-helixtrans-71.8-37.3-179.500000111.4D215 M220 A221D215-A217 PolarHBondContact O-N 3.24Å; D215-A217 VanDerWaalsContact O-N 3.12Å; D215-A217 WeakPolarHBondContact OD1-CB 3.39Å; D215-A217 PolarHBondContact OD1-N 2.88Å; A217-M220 PolarHBondContact O-N 3.03Å; A217-A221 VanDerWaalsContact O-CB 3.27Å; A217-A221 WeakPolarHBondContact O-CB 3.49Å; A217-A221 PolarHBondContact O-N 2.87Å
218K87Confident90Very high121 Ų12186.8 Ų86.853%0.52646%0.458SS..Hα-helixtrans-64.6-40.7177.5-73.1179.4-174.2170.40112.3D215 A221 M222D215-K218 HydrophobicContact CB-CB 4.23Å; D215-K218 HydrophobicContact CB-CD 3.94Å; D215-K218 HydrophobicContact CB-CG 4.08Å; D215-K218 PolarHBondContact O-N 2.75Å; D215-K218 VanDerWaalsContact O-N 3.11Å; D215-K218 PolarHBondContact OD1-N 3.16Å; D215-K218 WeakPolarHBondContact OD2-CD 3.29Å; D215-K218 WeakPolarHBondContact OD2-CE 3.5Å; D215-K218 WeakPolarHBondContact OD2-CG 3.45Å; D215-K218 IonicContact OD2-NZ 3.96Å; K218-A221 PolarHBondContact O-N 3.36Å; K218-M222 WeakPolarHBondContact O-CG 3.41Å; K218-M222 PolarHBondContact O-N 3.27Å
219I87.9Confident90Very high4 Ų484 Ų842%0.02145%0.45CS..Hα-helixtrans-66.4-42.7177.6-58.1175.4000110.7L213 D215 A221 M222 R228 A231 L232 L235L213-I219 HydrophobicContact CD2-CD1 4.3Å; D215-I219 PolarHBondContact O-N 2.94Å; I219-A221 VanDerWaalsContact C-N 3.29Å; I219-A221 PolarHBondContact O-N 3.1Å; I219-M222 WeakPolarHBondContact O-CB 3.39Å; I219-M222 PolarHBondContact O-N 2.91Å; I219-R228 HydrophobicContact CG2-CG 4.34Å; I219-A231 HydrophobicContact CG2-CB 4.35Å; I219-L232 HydrophobicContact CG2-CD2 3.94Å; I219-L232 HydrophobicContact CG2-CG 4.16Å; I219-L235 HydrophobicContact CD1-CD2 3.84Å
220M86.5Confident89.9Confident139 Ų13987.9 Ų87.969%0.68547%0.467SS*.Hα-helixtrans-71.1-25.7-179.8-65.2-63.2-74.600112.8S216 A217 M222S216-M220 WeakPolarHBondContact O-CG 3.33Å; S216-M220 PolarHBondContact O-N 2.66Å; A217-M220 PolarHBondContact O-N 3.03Å; M220-M222 VanDerWaalsContact C-N 3.29Å
221A90.5Very high90Very high74 Ų7486.1 Ų86.161%0.61246%0.455SS*.THydrogen-bonded Turntrans-79.7-5.1175.300000113.8A217 K218 I219 E223A217-A221 VanDerWaalsContact O-CB 3.27Å; A217-A221 WeakPolarHBondContact O-CB 3.49Å; A217-A221 PolarHBondContact O-N 2.87Å; K218-A221 PolarHBondContact O-N 3.36Å; I219-A221 VanDerWaalsContact C-N 3.29Å; I219-A221 PolarHBondContact O-N 3.1Å; A221-E223 PolarHBondContact O-N 3.44Å
222M90.1Very high90.2Very high31 Ų3184.5 Ų84.515%0.15344%0.441CS..  trans-68.4115.2177-67.5177.5126.100110.6Y212 K218 I219 M220 E227 R228 A231Y212-M222 HydrophobicContact CE2-CE 4.47Å; K218-M222 WeakPolarHBondContact O-CG 3.41Å; K218-M222 PolarHBondContact O-N 3.27Å; I219-M222 WeakPolarHBondContact O-CB 3.39Å; I219-M222 PolarHBondContact O-N 2.91Å; M220-M222 VanDerWaalsContact C-N 3.29Å; M222-E227 HydrophobicContact CE-CG 3.63Å; M222-R228 HydrophobicContact CB-CB 3.92Å; M222-R228 HydrophobicContact CB-CG 4.31Å; M222-R228 PolarHBondContact O-NH1 2.96Å; M222-R228 HydrophobicContact SD-CB 4.45Å; M222-A231 HydrophobicContact CE-CB 4.36Å; M222-A231 HydrophobicContact SD-CB 3.84Å
223E89.5Confident90.4Very high186 Ų18687.6 Ų87.687%0.86946%0.455SS*.  trans-70.7-41.5-179.6-63.9-174.9169.500111.7A221 P225A221-E223 PolarHBondContact O-N 3.44Å; E223-P225 VanDerWaalsContact O-CD 3.29Å; E223-P225 WeakPolarHBondContact O-CD 3.38Å
224D93.6Very high90.5Very high75 Ų7589.5 Ų89.540%0.40146%0.464SS..  trans-70.6117.8178.6-179.722.5000111.5E226 E227 R228D224-E226 VanDerWaalsContact C-N 3.3Å; D224-E226 PolarHBondContact O-N 2.92Å; D224-E226 PolarHBondContact OD1-N 3.18Å; D224-E227 HydrophobicContact CB-CB 3.97Å; D224-E227 WeakPolarHBondContact OD2-CB 3.35Å; D224-E227 PolarHBondContact OD2-N 3.41Å; D224-R228 WeakPolarHBondContact O-CB 3.34Å; D224-R228 PolarHBondContact O-N 3.25Å
225P91.9Very high90.9Very high66 Ų6684.9 Ų84.943%0.42944%0.44SS..Hα-helixtrans-60.7-34.1177.6-22.534.1000114.2E223 N229E223-P225 VanDerWaalsContact O-CD 3.29Å; E223-P225 WeakPolarHBondContact O-CD 3.38Å; P225-N229 WeakPolarHBondContact O-CB 3.12Å; P225-N229 VanDerWaalsContact O-CG 3.26Å; P225-N229 PolarHBondContact O-N 3.05Å; P225-N229 PolarHBondContact O-ND2 2.86Å
226E93.3Very high91.1Very high140 Ų14087.9 Ų87.965%0.65445%0.452SS*.Hα-helixtrans-71.9-47.8-178.9-70.8-62.114600111D224 R228 N229 K230D224-E226 VanDerWaalsContact C-N 3.3Å; D224-E226 PolarHBondContact O-N 2.92Å; D224-E226 PolarHBondContact OD1-N 3.18Å; E226-R228 VanDerWaalsContact C-N 3.33Å; E226-R228 PolarHBondContact O-N 3.41Å; E226-N229 PolarHBondContact O-N 2.9Å; E226-K230 WeakPolarHBondContact O-CB 3.24Å; E226-K230 PolarHBondContact O-N 3.4Å
227E90.9Very high91.4Very high108 Ų10888.3 Ų88.351%0.50544%0.444SS..Hα-helixtrans-59.7-42.8174.7-162179.9-168.100112M222 D224 K230 A231M222-E227 HydrophobicContact CE-CG 3.63Å; D224-E227 HydrophobicContact CB-CB 3.97Å; D224-E227 WeakPolarHBondContact OD2-CB 3.35Å; D224-E227 PolarHBondContact OD2-N 3.41Å; E227-K230 PolarHBondContact O-N 2.96Å; E227-A231 WeakPolarHBondContact O-CB 3.45Å; E227-A231 PolarHBondContact O-N 2.91Å
228R92Very high91.7Very high72 Ų7285.8 Ų85.827%0.27242%0.423SS..Hα-helixtrans-62.5-44.7176-172.6176.160.9-114.4-4.1112.3I219 M222 D224 E226 K230 A231 L232I219-R228 HydrophobicContact CG2-CG 4.34Å; M222-R228 HydrophobicContact CB-CB 3.92Å; M222-R228 HydrophobicContact CB-CG 4.31Å; M222-R228 PolarHBondContact O-NH1 2.96Å; M222-R228 HydrophobicContact SD-CB 4.45Å; D224-R228 WeakPolarHBondContact O-CB 3.34Å; D224-R228 PolarHBondContact O-N 3.25Å; E226-R228 VanDerWaalsContact C-N 3.33Å; E226-R228 PolarHBondContact O-N 3.41Å; R228-K230 VanDerWaalsContact C-N 3.33Å; R228-K230 PolarHBondContact O-N 3.26Å; R228-A231 PolarHBondContact O-N 2.79Å; R228-L232 HydrophobicContact CG-CD1 4.36Å; R228-L232 WeakPolarHBondContact O-CG 3.48Å; R228-L232 PolarHBondContact O-N 3.23Å
229N93.1Very high92Very high89 Ų8985.7 Ų85.748%0.47642%0.423SS..Hα-helixtrans-64.7-38.6177.7-79.8-19.4000111.8P225 E226 L232 K233P225-N229 WeakPolarHBondContact O-CB 3.12Å; P225-N229 VanDerWaalsContact O-CG 3.26Å; P225-N229 PolarHBondContact O-N 3.05Å; P225-N229 PolarHBondContact O-ND2 2.86Å; E226-N229 PolarHBondContact O-N 2.9Å; N229-L232 PolarHBondContact O-N 3.22Å; N229-K233 PolarHBondContact O-N 3.31Å
230K92.4Very high92.4Very high136 Ų13688.2 Ų88.259%0.59144%0.438SS*.Hα-helixtrans-61.4-47.3173.2-174.5-175.6174.2-168.60111.4E226 E227 R228 L232 K233 E234E226-K230 WeakPolarHBondContact O-CB 3.24Å; E226-K230 PolarHBondContact O-N 3.4Å; E227-K230 PolarHBondContact O-N 2.96Å; R228-K230 VanDerWaalsContact C-N 3.33Å; R228-K230 PolarHBondContact O-N 3.26Å; K230-L232 VanDerWaalsContact C-N 3.35Å; K230-L232 PolarHBondContact O-N 3.46Å; K230-K233 WeakPolarHBondContact O-CB 3.32Å; K230-K233 PolarHBondContact O-N 2.91Å; K230-E234 VanDerWaalsContact CE-OE1 3.24Å; K230-E234 WeakPolarHBondContact CE-OE1 3.29Å; K230-E234 PolarHBondContact O-N 2.85Å
231A92.5Very high92.8Very high1 Ų183 Ų831%0.00841%0.413CS..Hα-helixtrans-60.8-41.2176.500000112.4Y212 L213 I219 M222 E227 R228 K233 E234 L235Y212-A231 HydrophobicContact CE2-CB 4.02Å; L213-A231 HydrophobicContact CD2-CB 4.31Å; L213-A231 WeakPolarHBondContact CD2-O 3.3Å; I219-A231 HydrophobicContact CG2-CB 4.35Å; M222-A231 HydrophobicContact CE-CB 4.36Å; M222-A231 HydrophobicContact SD-CB 3.84Å; E227-A231 WeakPolarHBondContact O-CB 3.45Å; E227-A231 PolarHBondContact O-N 2.91Å; R228-A231 PolarHBondContact O-N 2.79Å; A231-K233 VanDerWaalsContact C-N 3.32Å; A231-K233 PolarHBondContact O-N 2.92Å; A231-E234 PolarHBondContact O-N 3.42Å; A231-L235 VanDerWaalsContact O-CB 3.28Å; A231-L235 WeakPolarHBondContact O-CB 3.48Å; A231-L235 PolarHBondContact O-N 3.42Å
232L91.9Very high92.9Very high76 Ų7681.7 Ų81.740%0.39840%0.397SS..Hα-helixtrans-63.9-36.6175.6-73.4172.8000112.4I219 R228 N229 K230 H236I219-L232 HydrophobicContact CG2-CD2 3.94Å; I219-L232 HydrophobicContact CG2-CG 4.16Å; R228-L232 HydrophobicContact CG-CD1 4.36Å; R228-L232 WeakPolarHBondContact O-CG 3.48Å; R228-L232 PolarHBondContact O-N 3.23Å; N229-L232 PolarHBondContact O-N 3.22Å; K230-L232 VanDerWaalsContact C-N 3.35Å; K230-L232 PolarHBondContact O-N 3.46Å; L232-H236 WeakPolarHBondContact O-CB 3.14Å; L232-H236 PolarHBondContact O-N 3.06Å
233K93.2Very high93.2Very high138 Ų13883.9 Ų83.960%0.641%0.41SS*.Hα-helixtrans-67.9-48.3175.3-170.4-177.2176-171.30111.6N229 K230 A231 L235 H236 E237N229-K233 PolarHBondContact O-N 3.31Å; K230-K233 WeakPolarHBondContact O-CB 3.32Å; K230-K233 PolarHBondContact O-N 2.91Å; A231-K233 VanDerWaalsContact C-N 3.32Å; A231-K233 PolarHBondContact O-N 2.92Å; K233-L235 VanDerWaalsContact C-N 3.29Å; K233-L235 PolarHBondContact O-N 2.74Å; K233-H236 PolarHBondContact O-N 3.49Å; K233-H236 VanDerWaalsContact O-N 3.15Å; K233-E237 VanDerWaalsContact CE-OE1 3.27Å; K233-E237 WeakPolarHBondContact CE-OE1 3.28Å; K233-E237 WeakPolarHBondContact O-CG 3.09Å; K233-E237 PolarHBondContact O-N 3.47Å
234E93.4Very high93.4Very high50 Ų5080 Ų8023%0.23439%0.391CS..Hα-helixtrans-59.5-40175.1-72.3-179.7-170.800111.5Y212 L213 K230 A231 E237 A238Y212-E234 PolarHBondContact OH-OE2 3.05Å; L213-E234 HydrophobicContact CD1-CB 4Å; L213-E234 HydrophobicContact CD2-CB 4.4Å; K230-E234 VanDerWaalsContact CE-OE1 3.24Å; K230-E234 WeakPolarHBondContact CE-OE1 3.29Å; K230-E234 PolarHBondContact O-N 2.85Å; A231-E234 PolarHBondContact O-N 3.42Å; E234-E237 PolarHBondContact O-N 2.83Å; E234-A238 WeakPolarHBondContact O-CB 3.17Å; E234-A238 PolarHBondContact O-N 3.48Å
235L93.4Very high93.4Very high64 Ų6477.7 Ų77.734%0.33538%0.377SS..Hα-helixtrans-61.9-43.2174.8178.562.7000111.9L213 I219 A231 K233 A238 K239L213-L235 HydrophobicContact CB-CD1 4.29Å; L213-L235 HydrophobicContact CD2-CB 4.27Å; L213-L235 WeakPolarHBondContact O-CD1 3.48Å; I219-L235 HydrophobicContact CD1-CD2 3.84Å; A231-L235 VanDerWaalsContact O-CB 3.28Å; A231-L235 WeakPolarHBondContact O-CB 3.48Å; A231-L235 PolarHBondContact O-N 3.42Å; K233-L235 VanDerWaalsContact C-N 3.29Å; K233-L235 PolarHBondContact O-N 2.74Å; L235-A238 PolarHBondContact O-N 3.24Å; L235-K239 WeakPolarHBondContact O-CB 3.16Å; L235-K239 PolarHBondContact O-N 2.94Å
236H93.7Very high93.4Very high121 Ų12178.4 Ų78.456%0.5638%0.378SS*.Hα-helixtrans-64.3-45.1178.3-173.968000111.4L232 K233 A238 K239 V240L232-H236 WeakPolarHBondContact O-CB 3.14Å; L232-H236 PolarHBondContact O-N 3.06Å; K233-H236 PolarHBondContact O-N 3.49Å; K233-H236 VanDerWaalsContact O-N 3.15Å; H236-A238 VanDerWaalsContact C-N 3.35Å; H236-A238 PolarHBondContact O-N 2.66Å; H236-K239 PolarHBondContact O-N 3.47Å; H236-V240 WeakPolarHBondContact O-CG2 3.29Å; H236-V240 PolarHBondContact O-N 3.21Å
237E94.2Very high93.3Very high98 Ų9877 Ų7746%0.45837%0.371SS..Hα-helixtrans-59.9-44.2175.1-70173.1-168.400111.5K233 E234 K239 V240 L241K233-E237 VanDerWaalsContact CE-OE1 3.27Å; K233-E237 WeakPolarHBondContact CE-OE1 3.28Å; K233-E237 WeakPolarHBondContact O-CG 3.09Å; K233-E237 PolarHBondContact O-N 3.47Å; E234-E237 PolarHBondContact O-N 2.83Å; E237-K239 PolarHBondContact O-N 3.36Å; E237-V240 PolarHBondContact O-N 3.5Å; E237-L241 PolarHBondContact O-N 3.23Å
238A94.4Very high93.3Very high12 Ų1275.6 Ų75.610%0.09936%0.361CS..Hα-helixtrans-60.2-44.9175.500000112.2F209 E234 L235 H236 L241 V242F209-A238 HydrophobicContact CD1-CB 3.69Å; F209-A238 HydrophobicContact CD2-CB 3.69Å; F209-A238 HydrophobicContact CE1-CB 3.64Å; F209-A238 HydrophobicContact CE2-CB 3.63Å; F209-A238 HydrophobicContact CG-CB 3.74Å; F209-A238 HydrophobicContact CZ-CB 3.63Å; E234-A238 WeakPolarHBondContact O-CB 3.17Å; E234-A238 PolarHBondContact O-N 3.48Å; L235-A238 PolarHBondContact O-N 3.24Å; H236-A238 VanDerWaalsContact C-N 3.35Å; H236-A238 PolarHBondContact O-N 2.66Å; A238-L241 PolarHBondContact O-N 2.89Å; A238-V242 WeakPolarHBondContact O-CB 3.49Å; A238-V242 VanDerWaalsContact O-CG2 3.25Å; A238-V242 WeakPolarHBondContact O-CG2 3.09Å; A238-V242 PolarHBondContact O-N 3.01Å
239K94.2Very high93.2Very high119 Ų11974.6 Ų74.652%0.51736%0.361SS..Hα-helixtrans-60-49.8178.4-176.5-172.1178.4-58.30111.3L235 H236 E237 L241 V242 D243L235-K239 WeakPolarHBondContact O-CB 3.16Å; L235-K239 PolarHBondContact O-N 2.94Å; H236-K239 PolarHBondContact O-N 3.47Å; E237-K239 PolarHBondContact O-N 3.36Å; K239-L241 VanDerWaalsContact C-N 3.34Å; K239-L241 PolarHBondContact O-N 2.67Å; K239-V242 PolarHBondContact O-N 3.08Å; K239-D243 IonicContact NZ-OD2 2.67Å; K239-D243 PolarHBondContact NZ-OD2 2.93Å; K239-D243 WeakPolarHBondContact O-CB 3.5Å; K239-D243 VanDerWaalsContact O-CG 3.28Å; K239-D243 PolarHBondContact O-N 3.39Å
240V95.6Very high93Very high58 Ų5874.4 Ų74.435%0.35237%0.366SS..Hα-helixtrans-58.7-48.3179.9173.10000110.3H236 E237 V242 D243 E244H236-V240 WeakPolarHBondContact O-CG2 3.29Å; H236-V240 PolarHBondContact O-N 3.21Å; E237-V240 PolarHBondContact O-N 3.5Å; V240-V242 PolarHBondContact O-N 3.35Å; V240-D243 PolarHBondContact O-N 3.09Å; V240-E244 WeakPolarHBondContact O-CG 3.2Å; V240-E244 PolarHBondContact O-N 3.08Å
241L94.4Very high92.8Very high30 Ų3073.6 Ų73.616%0.15736%0.363CS..Hα-helixtrans-63.5-43.1-179-172.965.4000112.8T202 R205 I206 F209 E237 A238 K239 Y245T202-L241 HydrophobicContact CG2-CD1 4.02Å; T202-L241 HydrophobicContact CG2-CG 4.27Å; R205-L241 HydrophobicContact CB-CD2 3.95Å; I206-L241 HydrophobicContact CG1-CD2 3.82Å; I206-L241 HydrophobicContact CG1-CG 4.07Å; F209-L241 HydrophobicContact CE2-CD2 3.93Å; F209-L241 HydrophobicContact CZ-CD2 4.35Å; E237-L241 PolarHBondContact O-N 3.23Å; A238-L241 PolarHBondContact O-N 2.89Å; K239-L241 VanDerWaalsContact C-N 3.34Å; K239-L241 PolarHBondContact O-N 2.67Å; L241-Y245 WeakPolarHBondContact O-CB 3.48Å; L241-Y245 PolarHBondContact O-N 3.25Å
242V94.2Very high92.5Very high45 Ų4573.7 Ų73.727%0.27336%0.363SS..Hα-helixtrans-68.2-41.1-1801700000111.2I206 A238 K239 V240 Y245 N246I206-V242 HydrophobicContact CD1-CG2 4.29Å; I206-V242 HydrophobicContact CG1-CG2 4.12Å; I206-V242 HydrophobicContact CG2-CG2 3.92Å; A238-V242 WeakPolarHBondContact O-CB 3.49Å; A238-V242 VanDerWaalsContact O-CG2 3.25Å; A238-V242 WeakPolarHBondContact O-CG2 3.09Å; A238-V242 PolarHBondContact O-N 3.01Å; K239-V242 PolarHBondContact O-N 3.08Å; V240-V242 PolarHBondContact O-N 3.35Å; V242-Y245 PolarHBondContact O-N 3.4Å; V242-N246 WeakPolarHBondContact CG1-ND2 3.32Å; V242-N246 VanDerWaalsContact O-CB 3.31Å; V242-N246 WeakPolarHBondContact O-CB 3.41Å; V242-N246 PolarHBondContact O-N 3.35Å; V242-N246 PolarHBondContact O-ND2 2.88Å
243D95.2Very high92.3Very high78 Ų7874.4 Ų74.442%0.41737%0.366SS..Hα-helixtrans-62.3-46.8176.8-75.7-17.7000111.1K239 V240 Y245 N246 E247K239-D243 IonicContact NZ-OD2 2.67Å; K239-D243 PolarHBondContact NZ-OD2 2.93Å; K239-D243 WeakPolarHBondContact O-CB 3.5Å; K239-D243 VanDerWaalsContact O-CG 3.28Å; K239-D243 PolarHBondContact O-N 3.39Å; V240-D243 PolarHBondContact O-N 3.09Å; D243-Y245 PolarHBondContact O-N 2.86Å; D243-N246 PolarHBondContact O-N 2.63Å; D243-E247 PolarHBondContact O-N 2.82Å
244E93.2Very high91.9Very high104 Ų10469.9 Ų69.949%0.48636%0.358SS..Hα-helixtrans-61.8-42.7176.1-73.3178.2-178.400112.2V240 E247 R248V240-E244 WeakPolarHBondContact O-CG 3.2Å; V240-E244 PolarHBondContact O-N 3.08Å; E244-E247 PolarHBondContact O-N 3.37Å; E244-R248 WeakPolarHBondContact O-CB 3.33Å; E244-R248 WeakPolarHBondContact O-CG 3.34Å; E244-R248 PolarHBondContact O-N 2.9Å
245Y93.5Very high91.5Very high26 Ų2670.8 Ų70.810%0.10236%0.364CS..Hα-helixtrans-64.6-42.4176.9-178.9-97.1000111.9T202 R203 I206 L241 V242 D243 R248 L249T202-Y245 HydrophobicContact CG2-CD2 3.68Å; T202-Y245 HydrophobicContact CG2-CE2 4.45Å; T202-Y245 HydrophobicContact CG2-CG 4.26Å; R203-Y245 WeakPolarHBondContact CD-OH 3.48Å; R203-Y245 HydrophobicContact CG-CE2 3.91Å; R203-Y245 WeakPolarHBondContact CG-OH 3.25Å; I206-Y245 HydrophobicContact CD1-CD1 3.91Å; I206-Y245 HydrophobicContact CD1-CD2 4.26Å; I206-Y245 HydrophobicContact CD1-CG 3.69Å; L241-Y245 WeakPolarHBondContact O-CB 3.48Å; L241-Y245 PolarHBondContact O-N 3.25Å; V242-Y245 PolarHBondContact O-N 3.4Å; D243-Y245 PolarHBondContact O-N 2.86Å; Y245-R248 PolarHBondContact O-N 3.14Å; Y245-L249 HydrophobicContact CE1-CD2 4.3Å; Y245-L249 WeakPolarHBondContact O-CB 3.41Å; Y245-L249 PolarHBondContact O-N 3.13Å
246N92.4Very high91.3Very high82 Ų8273.1 Ų73.144%0.43937%0.369SS..Hα-helixtrans-65.7-39.1178-74.8-25.4000112.2V242 D243 L249 S250V242-N246 WeakPolarHBondContact CG1-ND2 3.32Å; V242-N246 VanDerWaalsContact O-CB 3.31Å; V242-N246 WeakPolarHBondContact O-CB 3.41Å; V242-N246 PolarHBondContact O-N 3.35Å; V242-N246 PolarHBondContact O-ND2 2.88Å; D243-N246 PolarHBondContact O-N 2.63Å; N246-L249 PolarHBondContact O-N 2.69Å; N246-S250 WeakPolarHBondContact O-CB 3.43Å; N246-S250 PolarHBondContact O-N 2.84Å
247E91.6Very high90.9Very high110 Ų11070.1 Ų70.151%0.51437%0.365SS..Hα-helixtrans-63.1-46.1174.3-168.6-171158.200111D243 E244 L249 S250 K251D243-E247 PolarHBondContact O-N 2.82Å; E244-E247 PolarHBondContact O-N 3.37Å; E247-L249 PolarHBondContact O-N 2.98Å; E247-S250 PolarHBondContact O-N 3.34Å; E247-K251 WeakPolarHBondContact O-CG 3.45Å; E247-K251 PolarHBondContact O-N 3.42Å; E247-K251 WeakPolarHBondContact OE1-CE 3.33Å; E247-K251 IonicContact OE1-NZ 2.79Å; E247-K251 PolarHBondContact OE1-NZ 3.47Å
248R89.9Confident90.3Very high79 Ų7968.2 Ų68.230%0.29836%0.356SS..Hα-helixtrans-58.1-46.9175.1-77.3-167.1-69.1154.5-6.9111.5P196 D199 T202 E244 Y245 S250 K251 E252P196-R248 HydrophobicContact CB-CB 3.8Å; P196-R248 HydrophobicContact CG-CB 3.64Å; P196-R248 HydrophobicContact CG-CG 4.46Å; D199-R248 IonicContact OD2-CZ 2.62Å; D199-R248 IonicContact OD2-NH1 3.62Å; D199-R248 PolarHBondContact OD2-NH1 2.95Å; D199-R248 IonicContact OD2-NH2 2.65Å; T202-R248 PolarHBondContact OG1-NH2 3.16Å; E244-R248 WeakPolarHBondContact O-CB 3.33Å; E244-R248 WeakPolarHBondContact O-CG 3.34Å; E244-R248 PolarHBondContact O-N 2.9Å; Y245-R248 PolarHBondContact O-N 3.14Å; R248-S250 PolarHBondContact O-N 3.06Å; R248-K251 PolarHBondContact O-N 2.92Å; R248-E252 PolarHBondContact O-N 3.4Å
249L90.4Very high89.9Confident51 Ų5168 Ų6827%0.26735%0.353SS..Hα-helixtrans-63.5-39.4178.4-174.463000112.2Y245 N246 E247 E252 M253Y245-L249 HydrophobicContact CE1-CD2 4.3Å; Y245-L249 WeakPolarHBondContact O-CB 3.41Å; Y245-L249 PolarHBondContact O-N 3.13Å; N246-L249 PolarHBondContact O-N 2.69Å; E247-L249 PolarHBondContact O-N 2.98Å; L249-E252 WeakPolarHBondContact O-CB 3.3Å; L249-E252 PolarHBondContact O-N 2.87Å; L249-M253 HydrophobicContact CD1-CE 4.46Å; L249-M253 WeakPolarHBondContact O-CG 3.36Å; L249-M253 PolarHBondContact O-N 3.1Å
250S90.2Very high89.5Confident84 Ų8464.1 Ų64.159%0.58734%0.343SS*.Hα-helixtrans-62.2-43.1175.8-172.80000111.9N246 E247 R248 M253 G254N246-S250 WeakPolarHBondContact O-CB 3.43Å; N246-S250 PolarHBondContact O-N 2.84Å; E247-S250 PolarHBondContact O-N 3.34Å; R248-S250 PolarHBondContact O-N 3.06Å; S250-M253 PolarHBondContact O-N 2.98Å; S250-G254 PolarHBondContact O-N 3.4Å
251K86.3Confident89Confident119 Ų11966.2 Ų66.252%0.51735%0.345SS..Hα-helixtrans-61-44173.4-70.9173.1-175.81670111.5E247 R248 M253 G254 N255E247-K251 WeakPolarHBondContact O-CG 3.45Å; E247-K251 PolarHBondContact O-N 3.42Å; E247-K251 WeakPolarHBondContact OE1-CE 3.33Å; E247-K251 IonicContact OE1-NZ 2.79Å; E247-K251 PolarHBondContact OE1-NZ 3.47Å; R248-K251 PolarHBondContact O-N 2.92Å; K251-M253 PolarHBondContact O-N 3.08Å; K251-G254 PolarHBondContact O-N 3.29Å; K251-N255 PolarHBondContact O-N 3.47Å
252E87.3Confident88.5Confident4 Ų467.9 Ų67.92%0.01935%0.349CS..Hα-helixtrans-58.7-45.8175.4-171.4-164.7143.400112P196 S197 R248 L249 G254 N255 R256P196-E252 WeakPolarHBondContact CD-OE2 3.14Å; P196-E252 HydrophobicContact CG-CB 4.36Å; S197-E252 VanDerWaalsContact CB-OE1 3.26Å; S197-E252 WeakPolarHBondContact CB-OE1 3.44Å; S197-E252 WeakPolarHBondContact CB-OE2 3.45Å; S197-E252 PolarHBondContact N-OE2 2.92Å; R248-E252 PolarHBondContact O-N 3.4Å; L249-E252 WeakPolarHBondContact O-CB 3.3Å; L249-E252 PolarHBondContact O-N 2.87Å; E252-G254 VanDerWaalsContact C-N 3.29Å; E252-G254 PolarHBondContact O-N 2.89Å; E252-N255 PolarHBondContact O-N 2.89Å; E252-N255 VanDerWaalsContact O-N 3.14Å; E252-R256 WeakPolarHBondContact O-CG 3.17Å; E252-R256 PolarHBondContact O-N 3.2Å; E252-R256 IonicContact OE1-CZ 3Å; E252-R256 IonicContact OE1-NE 3.97Å; E252-R256 PolarHBondContact OE1-NE 3.27Å; E252-R256 IonicContact OE1-NH2 2.92Å; E252-R256 PolarHBondContact OE1-NH2 2.89Å
253M87.6Confident88.2Confident91 Ų9169.1 Ų69.145%0.44835%0.353SS..Hα-helixtrans-60.5-39.3177.1-69.2-57.993.100112.2L249 S250 K251 R256 A257L249-M253 HydrophobicContact CD1-CE 4.46Å; L249-M253 WeakPolarHBondContact O-CG 3.36Å; L249-M253 PolarHBondContact O-N 3.1Å; S250-M253 PolarHBondContact O-N 2.98Å; K251-M253 PolarHBondContact O-N 3.08Å; M253-R256 VanDerWaalsContact CE-CD 3.49Å; M253-R256 HydrophobicContact CE-CG 4.35Å; M253-A257 PolarHBondContact O-N 3.5Å; M253-A257 VanDerWaalsContact O-N 3.07Å
254G84.8Confident87.6Confident42 Ų4271.8 Ų71.843%0.43336%0.358SS..Hα-helixtrans-59.3-48.2171.400000112.6S250 K251 E252 A257 E258S250-G254 PolarHBondContact O-N 3.4Å; K251-G254 PolarHBondContact O-N 3.29Å; E252-G254 VanDerWaalsContact C-N 3.29Å; E252-G254 PolarHBondContact O-N 2.89Å; G254-A257 PolarHBondContact O-N 3.3Å; G254-E258 PolarHBondContact O-N 2.95Å
255N84.3Confident87Confident69 Ų6968.9 Ų68.937%0.36935%0.351SS..Hα-helixtrans-62.6-44178.6-68.7-11.4000111.9K251 E252 A257 E258 I259K251-N255 PolarHBondContact O-N 3.47Å; E252-N255 PolarHBondContact O-N 2.89Å; E252-N255 VanDerWaalsContact O-N 3.14Å; N255-A257 VanDerWaalsContact C-N 3.29Å; N255-A257 PolarHBondContact O-N 2.94Å; N255-E258 WeakPolarHBondContact O-CB 3.2Å; N255-E258 PolarHBondContact O-N 3.17Å; N255-I259 VanDerWaalsContact O-CG1 3.31Å; N255-I259 WeakPolarHBondContact O-CG1 3.24Å; N255-I259 PolarHBondContact O-N 2.95Å
256R89.4Confident86.6Confident113 Ų11370.4 Ų70.443%0.42636%0.359SS..Hα-helixtrans-60.1-38.9175.4-72.1-171.9-172.8-1270.2112.2L192 E252 M253 I259 A260L192-R256 HydrophobicContact CD2-CG 3.65Å; E252-R256 WeakPolarHBondContact O-CG 3.17Å; E252-R256 PolarHBondContact O-N 3.2Å; E252-R256 IonicContact OE1-CZ 3Å; E252-R256 IonicContact OE1-NE 3.97Å; E252-R256 PolarHBondContact OE1-NE 3.27Å; E252-R256 IonicContact OE1-NH2 2.92Å; E252-R256 PolarHBondContact OE1-NH2 2.89Å; M253-R256 VanDerWaalsContact CE-CD 3.49Å; M253-R256 HydrophobicContact CE-CG 4.35Å; R256-I259 PolarHBondContact O-N 3.36Å; R256-A260 WeakPolarHBondContact O-CB 3.44Å; R256-A260 PolarHBondContact O-N 3.41Å
257A84.9Confident86.3Confident59 Ų5969.1 Ų69.149%0.48835%0.354SS..Hα-helixtrans-67.5-37.7176.600000112.6M253 G254 N255 R261M253-A257 PolarHBondContact O-N 3.5Å; M253-A257 VanDerWaalsContact O-N 3.07Å; G254-A257 PolarHBondContact O-N 3.3Å; N255-A257 VanDerWaalsContact C-N 3.29Å; N255-A257 PolarHBondContact O-N 2.94Å; A257-R261 PolarHBondContact O-N 3.32Å; A257-R261 VanDerWaalsContact O-N 3.16Å
258E81.9Confident85.9Confident57 Ų5769.4 Ų69.427%0.26636%0.355SS..Hα-helixtrans-61.4-51.5171.7179.569.6-14200111.1M188 G254 N255 A260 R261 R262M188-E258 HydrophobicContact SD-CG 4.46Å; G254-E258 PolarHBondContact O-N 2.95Å; N255-E258 WeakPolarHBondContact O-CB 3.2Å; N255-E258 PolarHBondContact O-N 3.17Å; E258-A260 PolarHBondContact O-N 2.65Å; E258-R261 WeakPolarHBondContact O-CB 3.43Å; E258-R261 PolarHBondContact O-N 3.36Å; E258-R261 IonicContact OE1-CZ 2.68Å; E258-R261 IonicContact OE1-NH1 2.66Å; E258-R261 PolarHBondContact OE1-NH1 3.21Å; E258-R261 IonicContact OE1-NH2 2.63Å; E258-R261 IonicContact OE2-CZ 2.69Å; E258-R261 IonicContact OE2-NH1 3.47Å; E258-R261 PolarHBondContact OE2-NH1 2.87Å; E258-R261 IonicContact OE2-NH2 3.35Å; E258-R261 PolarHBondContact OE2-NH2 3.34Å; E258-R262 WeakPolarHBondContact O-CB 3.38Å; E258-R262 PolarHBondContact O-N 3.06Å; E258-R262 WeakPolarHBondContact OE1-CD 3.44Å; E258-R262 IonicContact OE1-CZ 3.85Å; E258-R262 IonicContact OE1-NE 3.15Å; E258-R262 PolarHBondContact OE1-NE 2.9Å
259I86.6Confident85.4Confident9 Ų966.5 Ų66.55%0.04635%0.345CS..Hα-helixtrans-58.5-46.9179.4-70.7166.6000110.9M188 L189 L192 N255 R256 R261 R262 L263M188-I259 HydrophobicContact CB-CD1 4.14Å; M188-I259 HydrophobicContact CB-CG1 3.83Å; M188-I259 WeakPolarHBondContact O-CD1 3.17Å; M188-I259 HydrophobicContact SD-CG1 4.42Å; L189-I259 HydrophobicContact CD2-CG2 3.95Å; L192-I259 HydrophobicContact CD1-CD1 3.39Å; L192-I259 HydrophobicContact CD1-CG2 4.33Å; L192-I259 HydrophobicContact CD2-CD1 3.83Å; L192-I259 HydrophobicContact CG-CD1 3.39Å; N255-I259 VanDerWaalsContact O-CG1 3.31Å; N255-I259 WeakPolarHBondContact O-CG1 3.24Å; N255-I259 PolarHBondContact O-N 2.95Å; R256-I259 PolarHBondContact O-N 3.36Å; I259-R261 PolarHBondContact O-N 2.9Å; I259-R262 PolarHBondContact O-N 3.12Å; I259-L263 HydrophobicContact CG2-CD1 3.92Å; I259-L263 HydrophobicContact CG2-CG 4.34Å; I259-L263 WeakPolarHBondContact O-CB 3.23Å; I259-L263 PolarHBondContact O-N 3.37Å
260A85.8Confident85.1Confident36 Ų3667.6 Ų67.630%0.29835%0.354SS..Hα-helixtrans-60.1-36.4177.400000112.2R256 E258 R264R256-A260 WeakPolarHBondContact O-CB 3.44Å; R256-A260 PolarHBondContact O-N 3.41Å; E258-A260 PolarHBondContact O-N 2.65Å; A260-R264 WeakPolarHBondContact O-CG 3.47Å; A260-R264 PolarHBondContact O-N 3.2Å; A260-R264 PolarHBondContact O-NE 3.35Å; A260-R264 PolarHBondContact O-NH1 3.45Å
261R84.9Confident84.9Confident103 Ų10370.3 Ų70.339%0.38935%0.351SS..Hα-helixtrans-69.7-44.3176-165.8-168.9-19.999.44.3111.4A257 E258 I259 R264 A265A257-R261 PolarHBondContact O-N 3.32Å; A257-R261 VanDerWaalsContact O-N 3.16Å; E258-R261 WeakPolarHBondContact O-CB 3.43Å; E258-R261 PolarHBondContact O-N 3.36Å; E258-R261 IonicContact OE1-CZ 2.68Å; E258-R261 IonicContact OE1-NH1 2.66Å; E258-R261 PolarHBondContact OE1-NH1 3.21Å; E258-R261 IonicContact OE1-NH2 2.63Å; E258-R261 IonicContact OE2-CZ 2.69Å; E258-R261 IonicContact OE2-NH1 3.47Å; E258-R261 PolarHBondContact OE2-NH1 2.87Å; E258-R261 IonicContact OE2-NH2 3.35Å; E258-R261 PolarHBondContact OE2-NH2 3.34Å; I259-R261 PolarHBondContact O-N 2.9Å; R261-R264 PolarHBondContact O-N 2.9Å; R261-A265 PolarHBondContact O-N 3.19Å; R261-A265 VanDerWaalsContact O-N 3.15Å
262R83.3Confident84.7Confident65 Ų6569.4 Ų69.425%0.24534%0.344CS..Hα-helixtrans-67.9-40.8-179.2-83.5-174.9174.1-122.14.6112.6P180 E184 M185 M188 E258 I259 R264 A265 F266P180-R262 HydrophobicContact CG-CB 3.91Å; P180-R262 HydrophobicContact CG-CG 4.12Å; E184-R262 IonicContact OE2-CZ 3.52Å; E184-R262 IonicContact OE2-NH1 2.66Å; E184-R262 PolarHBondContact OE2-NH1 3.13Å; M185-R262 HydrophobicContact CE-CB 4.3Å; M185-R262 HydrophobicContact SD-CB 3.65Å; M188-R262 VanDerWaalsContact CE-CD 3.46Å; M188-R262 VanDerWaalsContact CE-NE 3.34Å; M188-R262 WeakPolarHBondContact SD-CD 3.28Å; E258-R262 WeakPolarHBondContact O-CB 3.38Å; E258-R262 PolarHBondContact O-N 3.06Å; E258-R262 WeakPolarHBondContact OE1-CD 3.44Å; E258-R262 IonicContact OE1-CZ 3.85Å; E258-R262 IonicContact OE1-NE 3.15Å; E258-R262 PolarHBondContact OE1-NE 2.9Å; I259-R262 PolarHBondContact O-N 3.12Å; R262-R264 VanDerWaalsContact C-N 3.31Å; R262-R264 PolarHBondContact O-N 3.46Å; R262-A265 PolarHBondContact O-N 3.44Å; R262-A265 VanDerWaalsContact O-N 3.16Å; R262-F266 WeakPolarHBondContact O-CB 3.44Å; R262-F266 PolarHBondContact O-N 3.21Å
263L87.8Confident84.4Confident70 Ų7071.8 Ų71.837%0.36636%0.359SS..Hα-helixtrans-55.7-44170.7-86.4169.5000112.1M185 I259 F266 T267M185-L263 HydrophobicContact CE-CB 4.18Å; M185-L263 HydrophobicContact CE-CD2 3.55Å; M185-L263 HydrophobicContact CE-CG 3.46Å; M185-L263 VanDerWaalsContact CE-CG 3.46Å; I259-L263 HydrophobicContact CG2-CD1 3.92Å; I259-L263 HydrophobicContact CG2-CG 4.34Å; I259-L263 WeakPolarHBondContact O-CB 3.23Å; I259-L263 PolarHBondContact O-N 3.37Å; L263-F266 PolarHBondContact O-N 3.47Å; L263-T267 WeakPolarHBondContact O-CB 3.38Å; L263-T267 PolarHBondContact O-N 3.15Å; L263-T267 PolarHBondContact O-OG1 3.26Å
264R84.4Confident84.1Confident135 Ų13570.4 Ų70.451%0.50936%0.362SS..Hα-helixtrans-63.2-44.8177-76.1-174.3-68.1-89.60.6111.7A260 R261 R262 T267 E268A260-R264 WeakPolarHBondContact O-CG 3.47Å; A260-R264 PolarHBondContact O-N 3.2Å; A260-R264 PolarHBondContact O-NE 3.35Å; A260-R264 PolarHBondContact O-NH1 3.45Å; R261-R264 PolarHBondContact O-N 2.9Å; R262-R264 VanDerWaalsContact C-N 3.31Å; R262-R264 PolarHBondContact O-N 3.46Å; R264-T267 PolarHBondContact O-N 3.07Å; R264-E268 WeakPolarHBondContact O-CG 3.34Å; R264-E268 PolarHBondContact O-N 3.09Å
265A79.6Confident84Confident42 Ų4273.9 Ų73.935%0.34737%0.367SS..Hα-helixtrans-62.3-45177.400000111.8R261 R262 T267 E268 E269R261-A265 PolarHBondContact O-N 3.19Å; R261-A265 VanDerWaalsContact O-N 3.15Å; R262-A265 PolarHBondContact O-N 3.44Å; R262-A265 VanDerWaalsContact O-N 3.16Å; A265-T267 VanDerWaalsContact C-N 3.34Å; A265-T267 PolarHBondContact O-N 3.49Å; A265-E268 PolarHBondContact O-N 2.91Å; A265-E269 PolarHBondContact O-N 2.84Å; A265-E269 VanDerWaalsContact O-N 3.07Å
266F85.9Confident83.9Confident59 Ų5974.4 Ų74.426%0.25937%0.369SS..Hα-helixtrans-59.3-44.1174.8-177.1-100.9000112P180 A182 M185 R262 L263 E268 E269 V270P180-F266 HydrophobicContact CG-CB 4.29Å; P180-F266 WeakPolarHBondContact O-CD2 3.48Å; A182-F266 HydrophobicContact CB-CE2 4.13Å; A182-F266 HydrophobicContact CB-CZ 4.25Å; M185-F266 HydrophobicContact CG-CB 4.17Å; M185-F266 HydrophobicContact CG-CD2 4.05Å; M185-F266 HydrophobicContact CG-CG 4.07Å; M185-F266 HydrophobicContact SD-CB 4.33Å; R262-F266 WeakPolarHBondContact O-CB 3.44Å; R262-F266 PolarHBondContact O-N 3.21Å; L263-F266 PolarHBondContact O-N 3.47Å; F266-E268 PolarHBondContact O-N 2.89Å; F266-E269 PolarHBondContact O-N 3.28Å; F266-V270 HydrophobicContact CD1-CG2 4.08Å; F266-V270 HydrophobicContact CE1-CG2 3.69Å; F266-V270 HydrophobicContact CE2-CG2 4.33Å; F266-V270 HydrophobicContact CZ-CG2 3.83Å; F266-V270 WeakPolarHBondContact O-CG2 3.27Å; F266-V270 PolarHBondContact O-N 3.05Å
267T86.1Confident83.4Confident54 Ų5473.1 Ų73.133%0.33137%0.368SS..Hα-helixtrans-62.9-43.7179.6-54.80000112.2L263 R264 A265 E269 V270 R271L263-T267 WeakPolarHBondContact O-CB 3.38Å; L263-T267 PolarHBondContact O-N 3.15Å; L263-T267 PolarHBondContact O-OG1 3.26Å; R264-T267 PolarHBondContact O-N 3.07Å; A265-T267 VanDerWaalsContact C-N 3.34Å; A265-T267 PolarHBondContact O-N 3.49Å; T267-E269 VanDerWaalsContact C-N 3.29Å; T267-E269 PolarHBondContact O-N 3.37Å; T267-V270 PolarHBondContact O-N 3.06Å; T267-R271 WeakPolarHBondContact O-CG 3.47Å; T267-R271 PolarHBondContact O-N 3.31Å; T267-R271 VanDerWaalsContact O-N 3.09Å
268E82.4Confident83.4Confident116 Ų11672.2 Ų72.254%0.54236%0.364SS..Hα-helixtrans-62.3-39.2175.6-69.3-53.9134.200111.6R264 A265 F266 R271 R272R264-E268 WeakPolarHBondContact O-CG 3.34Å; R264-E268 PolarHBondContact O-N 3.09Å; A265-E268 PolarHBondContact O-N 2.91Å; F266-E268 PolarHBondContact O-N 2.89Å; E268-R271 PolarHBondContact O-N 3.19Å; E268-R271 IonicContact OE1-CZ 3.17Å; E268-R271 IonicContact OE1-NH1 2.65Å; E268-R271 PolarHBondContact OE1-NH1 2.63Å; E268-R271 IonicContact OE2-NH1 3.65Å; E268-R272 PolarHBondContact O-N 3.32Å
269E79.6Confident83.6Confident18 Ų1875.7 Ų75.78%0.08438%0.378CS..Hα-helixtrans-67.1-43.9178.6-175.553.4-152.700112.1L176 A179 A265 F266 T267 R271 R272 V273L176-E269 HydrophobicContact CD2-CG 4.02Å; A179-E269 HydrophobicContact CB-CB 3.82Å; A179-E269 HydrophobicContact CB-CG 4.03Å; A265-E269 PolarHBondContact O-N 2.84Å; A265-E269 VanDerWaalsContact O-N 3.07Å; F266-E269 PolarHBondContact O-N 3.28Å; T267-E269 VanDerWaalsContact C-N 3.29Å; T267-E269 PolarHBondContact O-N 3.37Å; E269-R271 VanDerWaalsContact C-N 3.27Å; E269-R271 PolarHBondContact O-N 2.92Å; E269-R272 VanDerWaalsContact CD-NE 3.34Å; E269-R272 WeakPolarHBondContact O-CB 3.41Å; E269-R272 PolarHBondContact O-N 3.14Å; E269-R272 VanDerWaalsContact O-N 3.12Å; E269-R272 IonicContact OE1-CZ 3.17Å; E269-R272 IonicContact OE1-NE 2.84Å; E269-R272 PolarHBondContact OE1-NE 3.15Å; E269-R272 IonicContact OE1-NH2 3.87Å; E269-R272 PolarHBondContact OE1-NH2 3.19Å; E269-R272 IonicContact OE2-CZ 3.95Å; E269-R272 IonicContact OE2-NE 3.7Å; E269-R272 PolarHBondContact OE2-NE 3.44Å; E269-R272 IonicContact OE2-NH2 2.79Å; E269-V273 WeakPolarHBondContact O-CG2 3.3Å; E269-V273 PolarHBondContact O-N 3.31Å; E269-V273 WeakPolarHBondContact OE1-CG2 3.3Å
270V83.6Confident83.5Confident75 Ų7580.5 Ų80.546%0.45540%0.396SS..Hα-helixtrans-57.8-41.5173.7170.30000111.1F266 T267 A274F266-V270 HydrophobicContact CD1-CG2 4.08Å; F266-V270 HydrophobicContact CE1-CG2 3.69Å; F266-V270 HydrophobicContact CE2-CG2 4.33Å; F266-V270 HydrophobicContact CZ-CG2 3.83Å; F266-V270 WeakPolarHBondContact O-CG2 3.27Å; F266-V270 PolarHBondContact O-N 3.05Å; T267-V270 PolarHBondContact O-N 3.06Å; V270-A274 VanDerWaalsContact O-CB 3.29Å; V270-A274 WeakPolarHBondContact O-CB 3.32Å; V270-A274 PolarHBondContact O-N 3.25Å
271R85.6Confident83.6Confident141 Ų14185.1 Ų85.153%0.53241%0.411SS..Hα-helixtrans-62.7-44.7175.1-72.6179.8-173125.84.9112T267 E268 E269 A274 E275T267-R271 WeakPolarHBondContact O-CG 3.47Å; T267-R271 PolarHBondContact O-N 3.31Å; T267-R271 VanDerWaalsContact O-N 3.09Å; E268-R271 PolarHBondContact O-N 3.19Å; E268-R271 IonicContact OE1-CZ 3.17Å; E268-R271 IonicContact OE1-NH1 2.65Å; E268-R271 PolarHBondContact OE1-NH1 2.63Å; E268-R271 IonicContact OE2-NH1 3.65Å; E269-R271 VanDerWaalsContact C-N 3.27Å; E269-R271 PolarHBondContact O-N 2.92Å; R271-A274 PolarHBondContact O-N 2.84Å; R271-E275 PolarHBondContact O-N 3.18Å
272R82.8Confident83.7Confident99 Ų9986.1 Ų86.137%0.37442%0.422SS..Hα-helixtrans-61-47.7179-171.7-163.472.580.91.9111.6V175 E268 E269 E275 I276V175-R272 PolarHBondContact O-NH2 3Å; E268-R272 PolarHBondContact O-N 3.32Å; E269-R272 VanDerWaalsContact CD-NE 3.34Å; E269-R272 WeakPolarHBondContact O-CB 3.41Å; E269-R272 PolarHBondContact O-N 3.14Å; E269-R272 VanDerWaalsContact O-N 3.12Å; E269-R272 IonicContact OE1-CZ 3.17Å; E269-R272 IonicContact OE1-NE 2.84Å; E269-R272 PolarHBondContact OE1-NE 3.15Å; E269-R272 IonicContact OE1-NH2 3.87Å; E269-R272 PolarHBondContact OE1-NH2 3.19Å; E269-R272 IonicContact OE2-CZ 3.95Å; E269-R272 IonicContact OE2-NE 3.7Å; E269-R272 PolarHBondContact OE2-NE 3.44Å; E269-R272 IonicContact OE2-NH2 2.79Å; R272-E275 PolarHBondContact O-N 3.26Å; R272-I276 HydrophobicContact CG-CD1 4.37Å; R272-I276 WeakPolarHBondContact O-CG1 3.1Å; R272-I276 PolarHBondContact O-N 3.03Å; R272-I276 VanDerWaalsContact O-N 3.15Å
273V80.6Confident84.1Confident55 Ų5589.9 Ų89.933%0.33344%0.44SS..Hα-helixtrans-62.2-45177.71730000110.5E269 E275 I276 E277E269-V273 WeakPolarHBondContact O-CG2 3.3Å; E269-V273 PolarHBondContact O-N 3.31Å; E269-V273 WeakPolarHBondContact OE1-CG2 3.3Å; V273-E275 VanDerWaalsContact C-N 3.31Å; V273-E275 PolarHBondContact O-N 2.99Å; V273-I276 PolarHBondContact O-N 3.38Å; V273-E277 HydrophobicContact CG1-CG 4.34Å; V273-E277 PolarHBondContact O-N 3.46Å
274A82.5Confident84.2Confident62 Ų6291.6 Ų91.651%0.51245%0.447SS..Hα-helixtrans-59.5-39177.300000112.7V270 R271 G278V270-A274 VanDerWaalsContact O-CB 3.29Å; V270-A274 WeakPolarHBondContact O-CB 3.32Å; V270-A274 PolarHBondContact O-N 3.25Å; R271-A274 PolarHBondContact O-N 2.84Å; A274-G278 PolarHBondContact O-N 3.31Å
275E81.8Confident84.5Confident114 Ų11493.5 Ų93.553%0.53346%0.455SS..Hα-helixtrans-67.4-42177.4-164.5-171.5158.900112.3R271 R272 V273 G278 K279R271-E275 PolarHBondContact O-N 3.18Å; R272-E275 PolarHBondContact O-N 3.26Å; V273-E275 VanDerWaalsContact C-N 3.31Å; V273-E275 PolarHBondContact O-N 2.99Å; E275-G278 PolarHBondContact O-N 3.46Å; E275-K279 WeakPolarHBondContact O-CG 3.39Å; E275-K279 PolarHBondContact O-N 3.01Å; E275-K279 VanDerWaalsContact OE1-CE 3.3Å; E275-K279 WeakPolarHBondContact OE1-CE 3.4Å; E275-K279 IonicContact OE1-NZ 2.83Å; E275-K279 PolarHBondContact OE1-NZ 3.01Å
276I81.7Confident85.1Confident81 Ų8198.3 Ų98.342%0.41547%0.467SS..Hα-helixtrans-65.5-49.2178.4-69.8171.1000110.7R272 V273 G278 K279 R280R272-I276 HydrophobicContact CG-CD1 4.37Å; R272-I276 WeakPolarHBondContact O-CG1 3.1Å; R272-I276 PolarHBondContact O-N 3.03Å; R272-I276 VanDerWaalsContact O-N 3.15Å; V273-I276 PolarHBondContact O-N 3.38Å; I276-G278 VanDerWaalsContact C-N 3.29Å; I276-G278 PolarHBondContact O-N 2.93Å; I276-K279 PolarHBondContact O-N 3.42Å; I276-R280 PolarHBondContact O-N 3.41Å
277E80.3Confident85.3Confident86 Ų8697.8 Ų97.840%0.40247%0.467SS..Hα-helixtrans-64.6-35.6177.4-72.3-56.9136.600111.3V273 K279 R280 H281V273-E277 HydrophobicContact CG1-CG 4.34Å; V273-E277 PolarHBondContact O-N 3.46Å; E277-K279 PolarHBondContact O-N 3.31Å; E277-R280 WeakPolarHBondContact O-CB 3.49Å; E277-R280 PolarHBondContact O-N 3.37Å; E277-R280 IonicContact OE1-NH1 2.8Å; E277-R280 WeakPolarHBondContact OE2-CD 3.42Å; E277-R280 IonicContact OE2-NH1 2.7Å; E277-H281 WeakPolarHBondContact O-CB 3.39Å; E277-H281 PolarHBondContact O-N 2.93Å
278G84.2Confident85.6Confident40 Ų40100.1 Ų100.141%0.41248%0.478SS..Hα-helixtrans-59.5-46171.900000113A274 E275 I276 H281 M282A274-G278 PolarHBondContact O-N 3.31Å; E275-G278 PolarHBondContact O-N 3.46Å; I276-G278 VanDerWaalsContact C-N 3.29Å; I276-G278 PolarHBondContact O-N 2.93Å; G278-H281 PolarHBondContact O-N 2.92Å; G278-M282 PolarHBondContact O-N 3.49Å
279K86Confident86.2Confident129 Ų12999.3 Ų99.356%0.56148%0.48SS*.Hα-helixtrans-63.3-41174.9-73.2171.1-173.81650111.7E275 I276 E277 M282 K283E275-K279 WeakPolarHBondContact O-CG 3.39Å; E275-K279 PolarHBondContact O-N 3.01Å; E275-K279 VanDerWaalsContact OE1-CE 3.3Å; E275-K279 WeakPolarHBondContact OE1-CE 3.4Å; E275-K279 IonicContact OE1-NZ 2.83Å; E275-K279 PolarHBondContact OE1-NZ 3.01Å; I276-K279 PolarHBondContact O-N 3.42Å; E277-K279 PolarHBondContact O-N 3.31Å; K279-M282 PolarHBondContact O-N 3.48Å; K279-K283 PolarHBondContact O-N 3.3Å
280R85.1Confident86.8Confident111 Ų111104.6 Ų104.642%0.41950%0.503SS..Hα-helixtrans-61.5-47.7176.3-173.9-175.4179.9177-0.2111.2I276 E277 M282 K283 M284I276-R280 PolarHBondContact O-N 3.41Å; E277-R280 WeakPolarHBondContact O-CB 3.49Å; E277-R280 PolarHBondContact O-N 3.37Å; E277-R280 IonicContact OE1-NH1 2.8Å; E277-R280 WeakPolarHBondContact OE2-CD 3.42Å; E277-R280 IonicContact OE2-NH1 2.7Å; R280-M282 VanDerWaalsContact C-N 3.34Å; R280-M282 PolarHBondContact O-N 3.22Å; R280-K283 PolarHBondContact O-N 3.33Å; R280-M284 PolarHBondContact O-N 3.39Å
281H87.2Confident87.2Confident133 Ų133106.6 Ų106.662%0.61651%0.509SS*.Hα-helixtrans-61.5-41.7177.3-174.6-99000111.7E277 G278 K283 M284 R285E277-H281 WeakPolarHBondContact O-CB 3.39Å; E277-H281 PolarHBondContact O-N 2.93Å; G278-H281 PolarHBondContact O-N 2.92Å; H281-K283 VanDerWaalsContact C-N 3.33Å; H281-K283 PolarHBondContact O-N 3.31Å; H281-M284 PolarHBondContact O-N 2.84Å; H281-R285 WeakPolarHBondContact O-CB 3.43Å; H281-R285 PolarHBondContact O-N 3.42Å
282M88.4Confident87.6Confident124 Ų124102.8 Ų102.861%0.61151%0.507SS*.Hα-helixtrans-63-39.5176.1-161.3-175.9-149.500112.3G278 K279 R280 R285 K286G278-M282 PolarHBondContact O-N 3.49Å; K279-M282 PolarHBondContact O-N 3.48Å; R280-M282 VanDerWaalsContact C-N 3.34Å; R280-M282 PolarHBondContact O-N 3.22Å; M282-R285 PolarHBondContact O-N 3.47Å; M282-K286 WeakPolarHBondContact O-CG 3.11Å; M282-K286 PolarHBondContact O-N 2.99Å
283K90.2Very high88.1Confident143 Ų143103.8 Ų103.862%0.62251%0.514SS*.Hα-helixtrans-65.4-45.9175-173.5-179.9177.8-173.10111.5K279 R280 H281 R285 K286 N287K279-K283 PolarHBondContact O-N 3.3Å; R280-K283 PolarHBondContact O-N 3.33Å; H281-K283 VanDerWaalsContact C-N 3.33Å; H281-K283 PolarHBondContact O-N 3.31Å; K283-R285 VanDerWaalsContact C-N 3.28Å; K283-R285 PolarHBondContact O-N 2.91Å; K283-K286 PolarHBondContact O-N 3.27Å; K283-K286 VanDerWaalsContact O-N 3.16Å; K283-N287 PolarHBondContact O-N 3.38Å
284M89.7Confident88.6Confident107 Ų107104.7 Ų104.753%0.52752%0.517SS..Hα-helixtrans-57-44.4175.6-174.362.276.500111.1R280 H281 K286 N287 L288R280-M284 PolarHBondContact O-N 3.39Å; H281-M284 PolarHBondContact O-N 2.84Å; M284-K286 PolarHBondContact O-N 3.18Å; M284-N287 WeakPolarHBondContact O-CB 3.09Å; M284-N287 PolarHBondContact O-N 3.28Å; M284-L288 WeakPolarHBondContact O-CG 3.35Å; M284-L288 PolarHBondContact O-N 3.2Å
285R91.7Very high89.1Confident175 Ų175110.6 Ų110.666%0.6653%0.526SS*.Hα-helixtrans-62.7-39.7177.2-168.1176171.9-151.8-2.5112.7H281 M282 K283 L288 V289H281-R285 WeakPolarHBondContact O-CB 3.43Å; H281-R285 PolarHBondContact O-N 3.42Å; M282-R285 PolarHBondContact O-N 3.47Å; K283-R285 VanDerWaalsContact C-N 3.28Å; K283-R285 PolarHBondContact O-N 2.91Å; R285-L288 PolarHBondContact O-N 3.25Å; R285-V289 WeakPolarHBondContact O-CG2 3.49Å; R285-V289 PolarHBondContact O-N 2.69Å; R285-V289 VanDerWaalsContact O-N 3.12Å
286K91.6Very high89.6Confident142 Ų142111.1 Ų111.162%0.61753%0.529SS*.Hα-helixtrans-63.7-41.9173.4-73.7-179.9-179-177.50111.9M282 K283 M284 V289 K290M282-K286 WeakPolarHBondContact O-CG 3.11Å; M282-K286 PolarHBondContact O-N 2.99Å; K283-K286 PolarHBondContact O-N 3.27Å; K283-K286 VanDerWaalsContact O-N 3.16Å; M284-K286 PolarHBondContact O-N 3.18Å; K286-V289 PolarHBondContact O-N 3.31Å; K286-K290 PolarHBondContact O-N 2.87Å
287N91Very high90.1Very high48 Ų48111.6 Ų111.626%0.25753%0.529SS..Hα-helixtrans-62.2-43.3176.1-75.37.6000111.2E158 K283 M284 V289 K290 M291E158-N287 PolarHBondContact OE1-ND2 3.36Å; K283-N287 PolarHBondContact O-N 3.38Å; M284-N287 WeakPolarHBondContact O-CB 3.09Å; M284-N287 PolarHBondContact O-N 3.28Å; N287-V289 PolarHBondContact O-N 3.38Å; N287-K290 PolarHBondContact O-N 2.81Å; N287-M291 WeakPolarHBondContact O-CB 3.48Å; N287-M291 WeakPolarHBondContact O-CG 3.48Å; N287-M291 PolarHBondContact O-N 2.97Å
288L92.2Very high90.6Very high104 Ų104112.4 Ų112.455%0.54554%0.536SS..Hα-helixtrans-59.9-44.3176.3-74.9172.2000112.6M284 R285 K290 M291 A292M284-L288 WeakPolarHBondContact O-CG 3.35Å; M284-L288 PolarHBondContact O-N 3.2Å; R285-L288 PolarHBondContact O-N 3.25Å; L288-K290 VanDerWaalsContact C-N 3.34Å; L288-K290 PolarHBondContact O-N 3.17Å; L288-M291 PolarHBondContact O-N 3.39Å; L288-A292 WeakPolarHBondContact O-CB 3.25Å; L288-A292 PolarHBondContact O-N 3.05Å
289V93.9Very high91Very high99 Ų99113.7 Ų113.760%0.654%0.535SS*.Hα-helixtrans-62.8-42.8176.1172.90000110.9R285 K286 N287 A292 K293R285-V289 WeakPolarHBondContact O-CG2 3.49Å; R285-V289 PolarHBondContact O-N 2.69Å; R285-V289 VanDerWaalsContact O-N 3.12Å; K286-V289 PolarHBondContact O-N 3.31Å; N287-V289 PolarHBondContact O-N 3.38Å; V289-A292 PolarHBondContact O-N 3.17Å; V289-K293 PolarHBondContact O-N 3.05Å; V289-K293 VanDerWaalsContact O-N 3.09Å
290K93.2Very high91.1Very high129 Ų129113.4 Ų113.456%0.56154%0.536SS*.Hα-helixtrans-62.4-47.8176.4-173.5-173.9172.7-170.80111.4K286 N287 L288 A292 K293 D294K286-K290 PolarHBondContact O-N 2.87Å; N287-K290 PolarHBondContact O-N 2.81Å; L288-K290 VanDerWaalsContact C-N 3.34Å; L288-K290 PolarHBondContact O-N 3.17Å; K290-A292 VanDerWaalsContact C-N 3.26Å; K290-A292 PolarHBondContact O-N 3.43Å; K290-K293 WeakPolarHBondContact O-CB 3.48Å; K290-K293 PolarHBondContact O-N 3.31Å; K290-K293 VanDerWaalsContact O-N 3.09Å; K290-D294 WeakPolarHBondContact CE-OD2 3.4Å; K290-D294 VanDerWaalsContact O-CG 3.3Å; K290-D294 PolarHBondContact O-N 3.01Å
291M92.5Very high91.2Very high117 Ų117112.8 Ų112.858%0.57654%0.538SS*.Hα-helixtrans-60.9-36.1177.9-72.7176.670.100112.2N287 L288 R295N287-M291 WeakPolarHBondContact O-CB 3.48Å; N287-M291 WeakPolarHBondContact O-CG 3.48Å; N287-M291 PolarHBondContact O-N 2.97Å; L288-M291 PolarHBondContact O-N 3.39Å; M291-R295 VanDerWaalsContact O-CB 3.26Å; M291-R295 WeakPolarHBondContact O-CB 3.49Å; M291-R295 PolarHBondContact O-N 3.03Å
292A93Very high91.1Very high60 Ų60111.7 Ų111.750%0.49654%0.536SS..Hα-helixtrans-63.6-42.2174.200000111.6L288 V289 K290 R295 E296L288-A292 WeakPolarHBondContact O-CB 3.25Å; L288-A292 PolarHBondContact O-N 3.05Å; V289-A292 PolarHBondContact O-N 3.17Å; K290-A292 VanDerWaalsContact C-N 3.26Å; K290-A292 PolarHBondContact O-N 3.43Å; A292-R295 WeakPolarHBondContact O-CB 3.33Å; A292-R295 PolarHBondContact O-N 3.41Å; A292-E296 PolarHBondContact O-N 3.42Å; A292-E296 VanDerWaalsContact O-N 3.08Å
293K93Very high90.9Very high121 Ų121113.1 Ų113.153%0.52654%0.541SS..Hα-helixtrans-66.5-48.3175.3-169-175.1-175.1-120.40112.2V289 K290 R295 E296 E297V289-K293 PolarHBondContact O-N 3.05Å; V289-K293 VanDerWaalsContact O-N 3.09Å; K290-K293 WeakPolarHBondContact O-CB 3.48Å; K290-K293 PolarHBondContact O-N 3.31Å; K290-K293 VanDerWaalsContact O-N 3.09Å; K293-R295 PolarHBondContact O-N 2.8Å; K293-E296 WeakPolarHBondContact O-CB 3.47Å; K293-E296 PolarHBondContact O-N 2.69Å; K293-E297 WeakPolarHBondContact CE-OE1 3.46Å; K293-E297 IonicContact NZ-OE1 3.38Å; K293-E297 PolarHBondContact NZ-OE1 3.1Å; K293-E297 PolarHBondContact O-N 3.49Å
294D92.3Very high90.6Very high73 Ų73110.3 Ų110.339%0.3954%0.54SS..Hα-helixtrans-58.6-35.6177.7-66.1-6.8000110.2K290 L298K290-D294 WeakPolarHBondContact CE-OD2 3.4Å; K290-D294 VanDerWaalsContact O-CG 3.3Å; K290-D294 PolarHBondContact O-N 3.01Å; D294-L298 VanDerWaalsContact O-CB 3.26Å; D294-L298 WeakPolarHBondContact O-CB 3.49Å; D294-L298 PolarHBondContact O-N 3.33Å
295R93.1Very high90.2Very high187 Ų187108.8 Ų108.871%0.70653%0.533SS*.Hα-helixtrans-66.4-42.1173.3177.6-177.5172.3-125.1-1.7112.5M291 A292 K293 L298 V299M291-R295 VanDerWaalsContact O-CB 3.26Å; M291-R295 WeakPolarHBondContact O-CB 3.49Å; M291-R295 PolarHBondContact O-N 3.03Å; A292-R295 WeakPolarHBondContact O-CB 3.33Å; A292-R295 PolarHBondContact O-N 3.41Å; K293-R295 PolarHBondContact O-N 2.8Å; R295-L298 PolarHBondContact O-N 2.75Å; R295-V299 WeakPolarHBondContact O-CG2 3.43Å; R295-V299 PolarHBondContact O-N 3.36Å
296E92.1Very high89.3Confident125 Ų125105.7 Ų105.758%0.58454%0.535SS*.Hα-helixtrans-63.7-49.1177.5-172.7171.4-155.400110.9A292 K293 L298 V299 E300A292-E296 PolarHBondContact O-N 3.42Å; A292-E296 VanDerWaalsContact O-N 3.08Å; K293-E296 WeakPolarHBondContact O-CB 3.47Å; K293-E296 PolarHBondContact O-N 2.69Å; E296-L298 VanDerWaalsContact C-N 3.29Å; E296-L298 PolarHBondContact O-N 2.68Å; E296-V299 PolarHBondContact O-N 3.04Å; E296-V299 VanDerWaalsContact O-N 3.12Å; E296-E300 PolarHBondContact O-N 2.88Å
297E91.3Very high88.1Confident90 Ų90106.8 Ų106.842%0.42154%0.543SS..Hα-helixtrans-59.6-38.5175.5-68.8178.8-171.900111.9K293 E300 H301K293-E297 WeakPolarHBondContact CE-OE1 3.46Å; K293-E297 IonicContact NZ-OE1 3.38Å; K293-E297 PolarHBondContact NZ-OE1 3.1Å; K293-E297 PolarHBondContact O-N 3.49Å; E297-E300 PolarHBondContact O-N 2.94Å; E297-H301 VanDerWaalsContact O-CB 3.3Å; E297-H301 WeakPolarHBondContact O-CB 3.34Å; E297-H301 PolarHBondContact O-N 3.3Å
298L92Very high86.6Confident104 Ų104109.7 Ų109.755%0.54556%0.562SS.*Hα-helixtrans-66.7-37.8177-169.473.3000112D294 R295 E296 H301 L302D294-L298 VanDerWaalsContact O-CB 3.26Å; D294-L298 WeakPolarHBondContact O-CB 3.49Å; D294-L298 PolarHBondContact O-N 3.33Å; R295-L298 PolarHBondContact O-N 2.75Å; E296-L298 VanDerWaalsContact C-N 3.29Å; E296-L298 PolarHBondContact O-N 2.68Å; L298-H301 PolarHBondContact O-N 3.17Å; L298-L302 HydrophobicContact CG-CD1 4.12Å; L298-L302 WeakPolarHBondContact O-CB 3.45Å; L298-L302 WeakPolarHBondContact O-CD1 3.33Å; L298-L302 WeakPolarHBondContact O-CG 3.5Å; L298-L302 PolarHBondContact O-N 3.26Å
299V91.2Very high84.5Confident67 Ų67110 Ų11041%0.40657%0.569SS.*Hα-helixtrans-66-45176.3169.60000110.6R295 E296 H301 L302 Q303R295-V299 WeakPolarHBondContact O-CG2 3.43Å; R295-V299 PolarHBondContact O-N 3.36Å; E296-V299 PolarHBondContact O-N 3.04Å; E296-V299 VanDerWaalsContact O-N 3.12Å; V299-H301 VanDerWaalsContact C-N 3.34Å; V299-H301 PolarHBondContact O-N 3.35Å; V299-L302 PolarHBondContact O-N 3.37Å; V299-Q303 WeakPolarHBondContact O-CG 3.24Å; V299-Q303 PolarHBondContact O-N 3.35Å
300E88.6Confident82.3Confident122 Ų122110.5 Ų110.557%0.5758%0.576SS**Hα-helixtrans-60.8-44174.2-69.8-176.3169.500111.5E296 E297 L302 Q303 S304E296-E300 PolarHBondContact O-N 2.88Å; E297-E300 PolarHBondContact O-N 2.94Å; E300-L302 PolarHBondContact O-N 2.92Å; E300-Q303 PolarHBondContact O-N 3.01Å; E300-S304 PolarHBondContact O-N 3.12Å
301H87Confident80Confident99 Ų99108.6 Ų108.646%0.45859%0.585SS.*Hα-helixtrans-62.5-44.5177.7-172.958.8000111.7E297 L298 V299 Q303 S304 L305E297-H301 VanDerWaalsContact O-CB 3.3Å; E297-H301 WeakPolarHBondContact O-CB 3.34Å; E297-H301 PolarHBondContact O-N 3.3Å; L298-H301 PolarHBondContact O-N 3.17Å; V299-H301 VanDerWaalsContact C-N 3.34Å; V299-H301 PolarHBondContact O-N 3.35Å; H301-Q303 VanDerWaalsContact C-N 3.31Å; H301-Q303 PolarHBondContact O-N 3.18Å; H301-S304 PolarHBondContact O-N 3.23Å; H301-S304 VanDerWaalsContact O-N 3.08Å; H301-S304 PolarHBondContact O-OG 3.41Å; H301-L305 WeakPolarHBondContact O-CG 3.41Å; H301-L305 PolarHBondContact O-N 3.49Å
302L85.2Confident77.8Confident109 Ų109107.3 Ų107.357%0.57159%0.593SS**Hα-helixtrans-58.1-41.1175-88.9155000112.3L298 V299 E300 S304 L305L298-L302 HydrophobicContact CG-CD1 4.12Å; L298-L302 WeakPolarHBondContact O-CB 3.45Å; L298-L302 WeakPolarHBondContact O-CD1 3.33Å; L298-L302 WeakPolarHBondContact O-CG 3.5Å; L298-L302 PolarHBondContact O-N 3.26Å; V299-L302 PolarHBondContact O-N 3.37Å; E300-L302 PolarHBondContact O-N 2.92Å; L302-S304 VanDerWaalsContact C-N 3.29Å; L302-S304 PolarHBondContact O-N 3.3Å; L302-L305 PolarHBondContact O-N 3.03Å
303Q84.4Confident75.3Confident154 Ų154111.8 Ų111.872%0.7261%0.609SS**Hα-helixtrans-69.6-26.6176.6-70.7174.6-2.300113.1V299 E300 H301 L305V299-Q303 WeakPolarHBondContact O-CG 3.24Å; V299-Q303 PolarHBondContact O-N 3.35Å; E300-Q303 PolarHBondContact O-N 3.01Å; H301-Q303 VanDerWaalsContact C-N 3.31Å; H301-Q303 PolarHBondContact O-N 3.18Å; Q303-L305 VanDerWaalsContact C-N 3.34Å
304S82.6Confident72.9Confident85 Ų85109.7 Ų109.759%0.59462%0.621SS**Hα-helixtrans-79.6-15.7177.876.70000113.9E300 H301 L302E300-S304 PolarHBondContact O-N 3.12Å; H301-S304 PolarHBondContact O-N 3.23Å; H301-S304 VanDerWaalsContact O-N 3.08Å; H301-S304 PolarHBondContact O-OG 3.41Å; L302-S304 VanDerWaalsContact C-N 3.29Å; L302-S304 PolarHBondContact O-N 3.3Å
305L81.7Confident70.6Confident75 Ų75113.5 Ų113.539%0.39364%0.642SS.*SBendtrans-79.2135.4179.2-69.9171.5000110H301 L302 Q303 E307H301-L305 WeakPolarHBondContact O-CG 3.41Å; H301-L305 PolarHBondContact O-N 3.49Å; L302-L305 PolarHBondContact O-N 3.03Å; Q303-L305 VanDerWaalsContact C-N 3.34Å; L305-E307 PolarHBondContact O-N 2.85Å
306P74.3Confident68.5Low109 Ų109113.9 Ų113.971%0.70865%0.652SS**  trans-63124.9176.324.6-30.9000109.2T308P306-T308 PolarHBondContact O-N 3.16Å
307E64.6Low66.6Low166 Ų166114 Ų11478%0.77666%0.661SS**  trans-59111.9172.7-67.9-168.1168.300108.6L305 T309L305-E307 PolarHBondContact O-N 2.85Å; E307-T309 PolarHBondContact O-N 2.77Å
308T59.7Low64.9Low108 Ų108119 Ų11966%0.66368%0.681SS**G310 helixtrans-74.413.7179.646.50000113P306 S310 A311P306-T308 PolarHBondContact O-N 3.16Å; T308-S310 PolarHBondContact O-N 3.26Å; T308-S310 VanDerWaalsContact O-N 3.16Å; T308-A311 PolarHBondContact O-N 2.63Å
309T49.7Very low63.1Low112 Ų112121.3 Ų121.369%0.68769%0.691SS**G310 helixtrans-75.36178.746.20000114.2E307E307-T309 PolarHBondContact O-N 2.77Å
310S46.4Very low61.6Low108 Ų108121.8 Ų121.876%0.75570%0.695SS**G310 helixtrans-109.217.9168.3-92.20000115.4T308 A312T308-S310 PolarHBondContact O-N 3.26Å; T308-S310 VanDerWaalsContact O-N 3.16Å; S310-A312 PolarHBondContact O-N 3.41Å
311A45.5Very low60.5Low90 Ų90120.4 Ų120.474%0.74470%0.695SS**THydrogen-bonded Turntrans-79.619169.900000114T308 N313T308-A311 PolarHBondContact O-N 2.63Å; A311-N313 VanDerWaalsContact C-N 3.28Å
312A46.1Very low59.2Low90 Ų90118.8 Ų118.874%0.74470%0.699SS**THydrogen-bonded Turntrans-78.7-8.4171.300000113.3S310S310-A312 PolarHBondContact O-N 3.41Å
313N40.4Very low58.1Low154 Ų154120.7 Ų120.782%0.82471%0.705SS**SBendtrans-130.789176.4-79.1-22.5000111.7A311 D315A311-N313 VanDerWaalsContact C-N 3.28Å; N313-D315 PolarHBondContact O-N 2.97Å
314G42.9Very low57.3Low77 Ų77119 Ų11979%0.79470%0.697SS**SBend74.816.9120.500000121.5
315D44.5Very low56.3Low152 Ų152120 Ų12081%0.81370%0.695SS**  trans-147.9127.3162.7-108.7-25.3000113.3N313 V317N313-D315 PolarHBondContact O-N 2.97Å; D315-V317 VanDerWaalsContact C-N 3.3Å; D315-V317 PolarHBondContact O-N 3.13Å
316Q48Very low55.3Low196 Ų196125 Ų12592%0.91671%0.714SS**  trans-69.181.8178.3-80.5179.6-42.200110.6K318Q316-K318 PolarHBondContact O-N 2.89Å
317V53.6Low54.5Low128 Ų128127.8 Ų127.878%0.77672%0.715SS**  trans-72.4107.5162.1-177.20000107.3D315 M319D315-V317 VanDerWaalsContact C-N 3.3Å; D315-V317 PolarHBondContact O-N 3.13Å; V317-M319 PolarHBondContact O-N 2.83Å; V317-M319 VanDerWaalsContact O-N 3.12Å
318K54.1Low53.7Low194 Ų194134.9 Ų134.984%0.84374%0.735SS**PPolyproline II helixtrans-56.1116.4173-84.3-179.9175.4177.30108.8Q316Q316-K318 PolarHBondContact O-N 2.89Å
319M54.8Low53.4Low153 Ų153136.3 Ų136.375%0.75474%0.738SS**PPolyproline II helixtrans-61.5139.5174-72.7-127.6-67.800110.3V317V317-M319 PolarHBondContact O-N 2.83Å; V317-M319 VanDerWaalsContact O-N 3.12Å
320P60Low53.6Low76 Ų76137.5 Ų137.549%0.49474%0.741SS.*PPolyproline II helixtrans-58.3141.8174.4-20.331000110.8E324P320-E324 WeakPolarHBondContact CA-OE2 3.38Å; P320-E324 HydrophobicContact CB-CB 4.12Å; P320-E324 WeakPolarHBondContact CB-OE2 3.46Å
321T64.5Low54Low93 Ų93139.2 Ų139.257%0.57174%0.74SS**PPolyproline II helixtrans-71.7152.2-179.3-31.40000109.1E323 E324T321-E323 PolarHBondContact O-N 3.27Å; T321-E324 PolarHBondContact N-OE2 3.3Å; T321-E324 WeakPolarHBondContact O-CB 3.43Å; T321-E324 PolarHBondContact O-N 2.83Å
322A61.1Low54.5Low66 Ų66142.1 Ų142.155%0.54574%0.74SS.*Hα-helixtrans-51.5-30.9-178.600000113.4E324 L325 F326A322-E324 VanDerWaalsContact C-N 3.34Å; A322-E324 PolarHBondContact O-N 3.39Å; A322-L325 PolarHBondContact O-N 3.32Å; A322-F326 WeakPolarHBondContact O-CD2 3.22Å
323E60.8Low55.1Low148 Ų148145.3 Ų145.369%0.69274%0.74SS**Hα-helixtrans-67.8-25.7175-68.1-172.6156.200114.8T321T321-E323 PolarHBondContact O-N 3.27Å
324E68.5Low56Low120 Ų120144.7 Ų144.756%0.56173%0.734SS**Hα-helixtrans-79.1-27.3178.5-67.3174.3142.400111.7P320 T321 A322P320-E324 WeakPolarHBondContact CA-OE2 3.38Å; P320-E324 HydrophobicContact CB-CB 4.12Å; P320-E324 WeakPolarHBondContact CB-OE2 3.46Å; T321-E324 PolarHBondContact N-OE2 3.3Å; T321-E324 WeakPolarHBondContact O-CB 3.43Å; T321-E324 PolarHBondContact O-N 2.83Å; A322-E324 VanDerWaalsContact C-N 3.34Å; A322-E324 PolarHBondContact O-N 3.39Å
325L60.4Low57Low106 Ų106149.6 Ų149.656%0.55573%0.73SS**Hα-helixtrans-75-24.2178.7-81158.4000113.6A322A322-L325 PolarHBondContact O-N 3.32Å
326F62.6Low57.9Low179 Ų179149.4 Ų149.479%0.78572%0.724SS**THydrogen-bonded Turntrans-103.88.1-177.5-67-71000114.6A322 R328A322-F326 WeakPolarHBondContact O-CD2 3.22Å; F326-R328 PolarHBondContact O-N 2.97Å
327K57Low58.8Low167 Ų167145.5 Ų145.573%0.72671%0.708SS**  trans-93.581.6171.6-78.9178.7-179.4171.50110.5
328R48.1Very low59.3Low316 Ų316147.1 Ų147.1100%1.19270%0.702SS**  trans-145.40158.4-109.9-174.7-178.2-173.31.2111.4F326F326-R328 PolarHBondContact O-N 2.97Å

Retrieved 328 of 328 residues in 839.9 ms (Link to these results)

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