A0A096MU87_PAPAN Loading...

Sorting nexin-24

May be involved in several stages of intracellular trafficking.

AlphaFold DB , UniProt , Accession A0A096MU87, Species PAPAN (Papio anubis, Olive baboon), Gene SNX24, Length 169 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
1M89.1Confident93.1Very high71 Ų7167.3 Ų67.335%0.3532%0.315SS..  0133.70176.4-178.7-173.900106.9V3 V26 I86 L92 L100 V102M1-V3 HydrophobicContact CE-CG2 3.87Å; M1-V3 HydrophobicContact CG-CG2 4.45Å; M1-V26 HydrophobicContact CE-CG1 3.48Å; M1-V26 VanDerWaalsContact CE-CG1 3.48Å; M1-I86 HydrophobicContact CB-CG2 4.39Å; M1-I86 HydrophobicContact CG-CD1 4.28Å; M1-I86 HydrophobicContact SD-CD1 4.22Å; M1-L92 HydrophobicContact SD-CD1 3.75Å; M1-L100 HydrophobicContact CE-CB 4.26Å; M1-L100 HydrophobicContact CE-CD1 3.3Å; M1-L100 HydrophobicContact CE-CG 4.4Å; M1-V102 HydrophobicContact CE-CG2 3.8Å
2E94Very high92.1Very high106 Ų10674.8 Ų74.850%0.49535%0.35SS..EExtended strand (participates in β ladder)trans-122.3143.7178.6-63.7174.1-179.700109.7Y4 L27E2-Y4 HydrophobicContact CB-CE2 4.03Å; E2-L27 HydrophobicContact CB-CB 4.23Å; E2-L27 PolarHBondContact N-O 3.31Å; E2-L27 PolarHBondContact O-N 2.95Å
3V96.1Very high90.9Very high2 Ų272.6 Ų72.61%0.01235%0.348CS..EExtended strand (participates in β ladder)trans-139.6135.8-177.41780000110.1M1 I24 E25 V26 L82 Q83 I86 L100M1-V3 HydrophobicContact CE-CG2 3.87Å; M1-V3 HydrophobicContact CG-CG2 4.45Å; V3-I24 HydrophobicContact CG1-CG2 3.52Å; V3-E25 WeakPolarHBondContact CA-O 3.35Å; V3-V26 HydrophobicContact CG2-CG1 4.36Å; V3-V26 HydrophobicContact CG2-CG2 4.34Å; V3-L82 HydrophobicContact CG1-CB 4.15Å; V3-L82 HydrophobicContact CG1-CD1 3.69Å; V3-Q83 WeakPolarHBondContact O-CG 3.49Å; V3-Q83 PolarHBondContact O-NE2 2.86Å; V3-I86 HydrophobicContact CB-CD1 3.97Å; V3-I86 HydrophobicContact CG2-CD1 3.42Å; V3-I86 VanDerWaalsContact CG2-CD1 3.42Å; V3-L100 HydrophobicContact CG2-CD1 4.03Å
4Y96.8Very high89.6Confident90 Ų9079.8 Ų79.835%0.35339%0.389SS..EExtended strand (participates in β ladder)trans-134.1158176.9-56.2-81.2000110.1E2 I24 E25 L27 E79E2-Y4 HydrophobicContact CB-CE2 4.03Å; Y4-I24 CarbonylContact O-C 3.53Å; Y4-I24 WeakPolarHBondContact O-CA 3.38Å; Y4-E25 PolarHBondContact N-O 3.06Å; Y4-E25 PolarHBondContact O-N 3.32Å; Y4-L27 HydrophobicContact CD2-CD1 3.98Å; Y4-L27 HydrophobicContact CE2-CD1 4.12Å; Y4-E79 WeakPolarHBondContact CA-OE2 3.46Å
5I96.8Very high88.6Confident0 Ų085.6 Ų85.60%042%0.422CS..EExtended strand (participates in β ladder)trans-12278.4169.9-53.8-174.6000106.9S7 F22 K23 I24 F42 R75 L78 E79 L82I5-S7 PolarHBondContact O-N 3.21Å; I5-F22 HydrophobicContact CG2-CB 3.94Å; I5-F22 HydrophobicContact CG2-CD1 4.22Å; I5-K23 WeakPolarHBondContact CA-O 3.47Å; I5-K23 WeakPolarHBondContact CG2-O 3.28Å; I5-I24 HydrophobicContact CD1-CG1 4.43Å; I5-I24 HydrophobicContact CG1-CG1 4.26Å; I5-F42 HydrophobicContact CD1-CE1 4.1Å; I5-F42 HydrophobicContact CD1-CZ 4.02Å; I5-R75 HydrophobicContact CB-CG 4.1Å; I5-R75 HydrophobicContact CG2-CG 3.57Å; I5-R75 WeakPolarHBondContact O-CD 3.45Å; I5-R75 PolarHBondContact O-NH1 2.86Å; I5-L78 HydrophobicContact CD1-CB 3.67Å; I5-E79 HydrophobicContact CB-CB 4.18Å; I5-E79 HydrophobicContact CD1-CB 4.19Å; I5-E79 HydrophobicContact CG1-CB 3.98Å; I5-E79 PolarHBondContact N-OE2 3.05Å; I5-L82 HydrophobicContact CD1-CD1 4.26Å
6P96Very high87.8Confident70 Ų7087.6 Ų87.646%0.45543%0.429SS..EExtended strand (participates in β ladder)trans-64.5-24.2-171.924.1-36.7000114.1K23 E25P6-K23 VanDerWaalsContact CD-O 3.27Å; P6-K23 WeakPolarHBondContact CD-O 3.46Å; P6-E25 HydrophobicContact CG-CB 4.17Å
7S93.9Very high87.3Confident53 Ų5396.6 Ų96.637%0.37146%0.458SS..EExtended strand (participates in β ladder)trans-157.9166-176.861.30000113.6I5 K23I5-S7 PolarHBondContact O-N 3.21Å; S7-K23 PolarHBondContact O-N 3.44Å
8F94.3Very high87Confident60 Ų6092.2 Ų92.226%0.26344%0.442SS..EExtended strand (participates in β ladder)trans-135.5156.9167.965-89.1000109.6T20 V21 F22 L71 E72 R75F8-T20 HydrophobicContact CB-CG2 4.24Å; F8-T20 HydrophobicContact CD2-CG2 3.87Å; F8-T20 HydrophobicContact CG-CG2 4.41Å; F8-V21 CarbonylContact C-O 3.54Å; F8-V21 WeakPolarHBondContact CA-O 3.25Å; F8-V21 WeakPolarHBondContact CB-O 3.47Å; F8-F22 HydrophobicContact CB-CD1 3.65Å; F8-F22 HydrophobicContact CB-CE1 3.91Å; F8-F22 HydrophobicContact CB-CG 4.33Å; F8-F22 HydrophobicContact CG-CD1 4.46Å; F8-F22 HydrophobicContact CG-CE1 4.29Å; F8-L71 HydrophobicContact CD2-CB 4.45Å; F8-L71 HydrophobicContact CD2-CD1 4.35Å; F8-L71 HydrophobicContact CE1-CB 4.32Å; F8-L71 HydrophobicContact CE2-CB 3.76Å; F8-L71 HydrophobicContact CE2-CD1 3.76Å; F8-L71 HydrophobicContact CE2-CG 4.43Å; F8-L71 HydrophobicContact CZ-CB 3.69Å; F8-L71 HydrophobicContact CZ-CD1 4.45Å; F8-E72 HydrophobicContact CE1-CB 4.35Å; F8-E72 WeakPolarHBondContact CE1-OE2 3.18Å; F8-R75 HydrophobicContact CD1-CB 4.15Å; F8-R75 HydrophobicContact CD1-CG 4.25Å
9R91.8Very high87.1Confident87 Ų8790.3 Ų90.333%0.32843%0.43SS..EExtended strand (participates in β ladder)trans-132.9154173.467.4174.4-176.8-79.4-2.4111.2E11 T20 V21 E36R9-E11 IonicContact CZ-OE1 3.5Å; R9-E11 IonicContact NE-OE1 2.69Å; R9-E11 PolarHBondContact NE-OE1 3.34Å; R9-E11 IonicContact NE-OE2 3.37Å; R9-E11 IonicContact NH2-OE1 2.87Å; R9-E11 IonicContact NH2-OE2 3.51Å; R9-T20 WeakPolarHBondContact O-CA 3.36Å; R9-V21 HydrophobicContact CG-CB 4.37Å; R9-V21 PolarHBondContact N-O 2.98Å; R9-V21 PolarHBondContact O-N 2.67Å; R9-E36 IonicContact CZ-OE1 3.13Å; R9-E36 IonicContact CZ-OE2 3.39Å; R9-E36 IonicContact NH1-OE1 3.23Å; R9-E36 PolarHBondContact NH1-OE1 2.91Å; R9-E36 IonicContact NH1-OE2 3.56Å; R9-E36 PolarHBondContact NH1-OE2 3.15Å; R9-E36 IonicContact NH2-OE1 3.32Å; R9-E36 IonicContact NH2-OE2 2.62Å; R9-E36 PolarHBondContact NH2-OE2 3.43Å
10Y88.4Confident87.3Confident135 Ų13587.1 Ų87.153%0.52942%0.417SS..EExtended strand (participates in β ladder)trans-93.2127.8165.9-173.6-105.1000108.2E12 G18Y10-E12 HydrophobicContact CD1-CB 4.32Å; Y10-E12 HydrophobicContact CE1-CB 3.95Å; Y10-E12 HydrophobicContact CE1-CG 4.21Å; Y10-G18 VanDerWaalsContact CE2-C 3.43Å; Y10-G18 WeakPolarHBondContact CE2-O 3.45Å; Y10-G18 WeakPolarHBondContact OH-CA 3.28Å; Y10-G18 PolarHBondContact OH-O 3.38Å
11E86.8Confident87.6Confident66 Ų6683.2 Ų83.231%0.30840%0.399SS..EExtended strand (participates in β ladder)trans-111.6109.7178.9-160.8148.1-127.100107.1R9 G18 Y19R9-E11 IonicContact CZ-OE1 3.5Å; R9-E11 IonicContact NE-OE1 2.69Å; R9-E11 PolarHBondContact NE-OE1 3.34Å; R9-E11 IonicContact NE-OE2 3.37Å; R9-E11 IonicContact NH2-OE1 2.87Å; R9-E11 IonicContact NH2-OE2 3.51Å; E11-G18 CarbonylContact O-C 3.4Å; E11-G18 WeakPolarHBondContact O-CA 3.49Å; E11-Y19 HydrophobicContact CB-CD2 4.15Å; E11-Y19 HydrophobicContact CB-CE2 3.74Å; E11-Y19 HydrophobicContact CG-CE2 4.11Å; E11-Y19 PolarHBondContact N-O 3.5Å; E11-Y19 PolarHBondContact O-N 2.83Å; E11-Y19 VanDerWaalsContact OE2-CE2 3.27Å; E11-Y19 WeakPolarHBondContact OE2-CE2 3.23Å; E11-Y19 PolarHBondContact OE2-OH 2.96Å
12E80.8Confident87.8Confident158 Ų15879.9 Ų79.974%0.73838%0.382SS*.  trans-92.7129.8176.6-160.8160.7-145.500107.7Y10Y10-E12 HydrophobicContact CD1-CB 4.32Å; Y10-E12 HydrophobicContact CE1-CB 3.95Å; Y10-E12 HydrophobicContact CE1-CG 4.21Å
13S76.9Confident88Confident46 Ų4678 Ų7832%0.32237%0.373SS..  trans-119134.6177178.40000107.5L15 E16S13-L15 PolarHBondContact O-N 3.16Å; S13-E16 PolarHBondContact O-N 3.22Å
14D72.3Confident88Confident173 Ų17377.9 Ų77.993%0.92537%0.372SS*.SBendtrans-61.9-18.7-179.4-62.1-41.6000113
15L74.8Confident88.1Confident167 Ų16775 Ų7587%0.87436%0.362SS*.SBendtrans-109.2-18.5-176.3-60.7174.7000113.7S13S13-L15 PolarHBondContact O-N 3.16Å
16E76.3Confident88Confident117 Ų11775 Ų7555%0.54736%0.362SS..SBendtrans-129.1148.3-174.6-67.5-171.5174.700112.1S13 G18S13-E16 PolarHBondContact O-N 3.22Å; E16-G18 PolarHBondContact O-N 2.9Å
17R78.5Confident88Confident241 Ų24174.2 Ų74.291%0.90935%0.353SS*.  trans-57.2117.4172.2-170.4174.6-173.6171.83.6109.2
18G83.3Confident87.8Confident17 Ų1774.4 Ų74.418%0.17535%0.349CS..  trans-56.4148.1-174.200000113.2Y10 E11 E16Y10-G18 VanDerWaalsContact CE2-C 3.43Å; Y10-G18 WeakPolarHBondContact CE2-O 3.45Å; Y10-G18 WeakPolarHBondContact OH-CA 3.28Å; Y10-G18 PolarHBondContact OH-O 3.38Å; E11-G18 CarbonylContact O-C 3.4Å; E11-G18 WeakPolarHBondContact O-CA 3.49Å; E16-G18 PolarHBondContact O-N 2.9Å
19Y87.9Confident87.4Confident56 Ų5678.5 Ų78.522%0.2237%0.374CS..EExtended strand (participates in β ladder)trans-131.8154.2-168.853.4-92000112E11 V21 R38E11-Y19 HydrophobicContact CB-CD2 4.15Å; E11-Y19 HydrophobicContact CB-CE2 3.74Å; E11-Y19 HydrophobicContact CG-CE2 4.11Å; E11-Y19 PolarHBondContact N-O 3.5Å; E11-Y19 PolarHBondContact O-N 2.83Å; E11-Y19 VanDerWaalsContact OE2-CE2 3.27Å; E11-Y19 WeakPolarHBondContact OE2-CE2 3.23Å; E11-Y19 PolarHBondContact OE2-OH 2.96Å; Y19-V21 HydrophobicContact CD2-CG2 3.55Å; Y19-V21 HydrophobicContact CE2-CG2 3.52Å; Y19-R38 HydrophobicContact CD2-CG 4.27Å; Y19-R38 PolarHBondContact OH-NH2 3.22Å
20T90.4Very high87.2Confident26 Ų2678.7 Ų78.716%0.1640%0.403CS..EExtended strand (participates in β ladder)trans-94.1131.3176.5-49.70000110.7F8 R9 F22 L71F8-T20 HydrophobicContact CB-CG2 4.24Å; F8-T20 HydrophobicContact CD2-CG2 3.87Å; F8-T20 HydrophobicContact CG-CG2 4.41Å; R9-T20 WeakPolarHBondContact O-CA 3.36Å; T20-F22 HydrophobicContact CG2-CE2 4.24Å; T20-F22 HydrophobicContact CG2-CZ 4.15Å; T20-L71 HydrophobicContact CG2-CD1 4.45Å; T20-L71 HydrophobicContact CG2-CD2 4.46Å
21V93.6Very high87.3Confident7 Ų782 Ų824%0.04241%0.414CS..EExtended strand (participates in β ladder)trans-115.8132.1176.4-176.20000109.2F8 R9 Y19 E36 R38F8-V21 CarbonylContact C-O 3.54Å; F8-V21 WeakPolarHBondContact CA-O 3.25Å; F8-V21 WeakPolarHBondContact CB-O 3.47Å; R9-V21 HydrophobicContact CG-CB 4.37Å; R9-V21 PolarHBondContact N-O 2.98Å; R9-V21 PolarHBondContact O-N 2.67Å; Y19-V21 HydrophobicContact CD2-CG2 3.55Å; Y19-V21 HydrophobicContact CE2-CG2 3.52Å; V21-E36 HydrophobicContact CG1-CB 3.7Å; V21-E36 HydrophobicContact CG1-CG 4.4Å; V21-R38 HydrophobicContact CG2-CG 4.4Å
22F95.3Very high87.6Confident1 Ų184.4 Ų84.40%0.00442%0.424CS..EExtended strand (participates in β ladder)trans-98.7129.3175.3-62.3-87.5000109.2I5 F8 T20 E36 K37 F42 R74 R75 L78I5-F22 HydrophobicContact CG2-CB 3.94Å; I5-F22 HydrophobicContact CG2-CD1 4.22Å; F8-F22 HydrophobicContact CB-CD1 3.65Å; F8-F22 HydrophobicContact CB-CE1 3.91Å; F8-F22 HydrophobicContact CB-CG 4.33Å; F8-F22 HydrophobicContact CG-CD1 4.46Å; F8-F22 HydrophobicContact CG-CE1 4.29Å; T20-F22 HydrophobicContact CG2-CE2 4.24Å; T20-F22 HydrophobicContact CG2-CZ 4.15Å; F22-E36 WeakPolarHBondContact O-CA 3.48Å; F22-K37 PolarHBondContact N-O 3.11Å; F22-K37 PolarHBondContact O-N 3.26Å; F22-F42 HydrophobicContact CB-CE2 4.21Å; F22-F42 HydrophobicContact CB-CZ 4.35Å; F22-F42 HydrophobicContact CD2-CE2 4.2Å; F22-F42 HydrophobicContact CG-CE2 4.47Å; F22-R74 HydrophobicContact CZ-CG 4.18Å; F22-R75 HydrophobicContact CD1-CB 4.18Å; F22-R75 HydrophobicContact CD1-CG 4.14Å; F22-R75 HydrophobicContact CE1-CB 3.96Å; F22-R75 HydrophobicContact CE1-CG 4.42Å; F22-L78 HydrophobicContact CD1-CD1 4.22Å; F22-L78 HydrophobicContact CD2-CD1 3.99Å; F22-L78 HydrophobicContact CE1-CD1 4.17Å; F22-L78 HydrophobicContact CE2-CD1 3.93Å; F22-L78 HydrophobicContact CG-CD1 4.15Å; F22-L78 HydrophobicContact CZ-CD1 4.02Å
23K96.8Very high88.3Confident66 Ų6679.6 Ų79.629%0.28740%0.401SS..EExtended strand (participates in β ladder)trans-90.2110.5175.2-177.9174.7178.1175.70108.3I5 P6 S7 F34I5-K23 WeakPolarHBondContact CA-O 3.47Å; I5-K23 WeakPolarHBondContact CG2-O 3.28Å; P6-K23 VanDerWaalsContact CD-O 3.27Å; P6-K23 WeakPolarHBondContact CD-O 3.46Å; S7-K23 PolarHBondContact O-N 3.44Å; K23-F34 HydrophobicContact CD-CD1 4.2Å; K23-F34 VanDerWaalsContact CE-CE1 3.42Å; K23-F34 VanDerWaalsContact CE-CG 3.43Å; K23-F34 HydrophobicContact CG-CD1 4Å
24I97.5Very high89.2Confident0 Ų081.9 Ų81.90%041%0.406CS..EExtended strand (participates in β ladder)trans-93.1129.2177.1-48.9171.7000107.8V3 Y4 I5 V26 F34 V35 K37 F42 L82 F99 L100V3-I24 HydrophobicContact CG1-CG2 3.52Å; Y4-I24 CarbonylContact O-C 3.53Å; Y4-I24 WeakPolarHBondContact O-CA 3.38Å; I5-I24 HydrophobicContact CD1-CG1 4.43Å; I5-I24 HydrophobicContact CG1-CG1 4.26Å; I24-V26 HydrophobicContact CG2-CG2 4.03Å; I24-F34 CarbonylContact O-C 3.48Å; I24-F34 VanDerWaalsContact O-CA 3.24Å; I24-F34 WeakPolarHBondContact O-CA 3.36Å; I24-V35 WeakPolarHBondContact CA-O 3.33Å; I24-V35 HydrophobicContact CB-CB 4.38Å; I24-V35 WeakPolarHBondContact CB-O 3.09Å; I24-V35 PolarHBondContact N-O 2.88Å; I24-V35 PolarHBondContact O-N 3.4Å; I24-K37 HydrophobicContact CD1-CB 4.02Å; I24-K37 HydrophobicContact CD1-CG 3.71Å; I24-F42 HydrophobicContact CD1-CE1 4.03Å; I24-F42 HydrophobicContact CD1-CE2 4.44Å; I24-F42 HydrophobicContact CD1-CZ 3.57Å; I24-F42 HydrophobicContact CG1-CZ 4.02Å; I24-L82 HydrophobicContact CD1-CD1 4.23Å; I24-L82 HydrophobicContact CG2-CD1 4.1Å; I24-F99 HydrophobicContact CD1-CE1 3.89Å; I24-F99 HydrophobicContact CD1-CZ 4.36Å; I24-L100 HydrophobicContact CD1-CD2 4.28Å; I24-L100 HydrophobicContact CG2-CD2 4.13Å
25E97.3Very high90.3Very high30 Ų3074 Ų7414%0.1436%0.364CS..EExtended strand (participates in β ladder)trans-101.7125.2171.1-176.5174.2147.100108.8V3 Y4 P6 L27 K32 F34V3-E25 WeakPolarHBondContact CA-O 3.35Å; Y4-E25 PolarHBondContact N-O 3.06Å; Y4-E25 PolarHBondContact O-N 3.32Å; P6-E25 HydrophobicContact CG-CB 4.17Å; E25-L27 HydrophobicContact CG-CD1 3.78Å; E25-L27 WeakPolarHBondContact OE1-CD1 3.42Å; E25-K32 HydrophobicContact CG-CD 4.19Å; E25-K32 HydrophobicContact CG-CG 4.16Å; E25-K32 WeakPolarHBondContact OE1-CD 3.5Å; E25-K32 WeakPolarHBondContact OE1-CE 3.49Å; E25-K32 IonicContact OE1-NZ 3.84Å; E25-K32 PolarHBondContact OE1-NZ 3.31Å; E25-K32 WeakPolarHBondContact OE2-CE 3.39Å; E25-K32 IonicContact OE2-NZ 2.74Å; E25-K32 PolarHBondContact OE2-NZ 3.48Å; E25-F34 HydrophobicContact CB-CD1 3.92Å; E25-F34 HydrophobicContact CB-CE1 3.72Å; E25-F34 HydrophobicContact CG-CD1 4.16Å; E25-F34 HydrophobicContact CG-CE1 3.67Å; E25-F34 HydrophobicContact CG-CZ 4.4Å; E25-F34 WeakPolarHBondContact OE2-CE1 3.43Å
26V96.3Very high91.3Very high0 Ų070.3 Ų70.30%034%0.342CS..EExtended strand (participates in β ladder)trans-118.9123.8-178.4-178.50000108.7M1 V3 I24 K32 H33 V35 L100 V102M1-V26 HydrophobicContact CE-CG1 3.48Å; M1-V26 VanDerWaalsContact CE-CG1 3.48Å; V3-V26 HydrophobicContact CG2-CG1 4.36Å; V3-V26 HydrophobicContact CG2-CG2 4.34Å; I24-V26 HydrophobicContact CG2-CG2 4.03Å; V26-K32 WeakPolarHBondContact O-CA 3.46Å; V26-H33 VanDerWaalsContact CB-CE1 3.48Å; V26-H33 WeakPolarHBondContact CB-CE1 3.31Å; V26-H33 VanDerWaalsContact CG1-CE1 3.42Å; V26-H33 WeakPolarHBondContact CG1-CE1 3.48Å; V26-H33 PolarHBondContact N-O 3.5Å; V26-H33 PolarHBondContact O-N 2.93Å; V26-V35 HydrophobicContact CG2-CG2 4.43Å; V26-L100 HydrophobicContact CG2-CB 4.3Å; V26-L100 HydrophobicContact CG2-CD2 4.16Å; V26-V102 HydrophobicContact CG1-CG2 4.25Å
27L94.6Very high92.3Very high53 Ų5366.3 Ų66.328%0.27732%0.323SS..EExtended strand (participates in β ladder)trans-112.2119.8174-68.482.2000109.3E2 Y4 E25 R31 K32E2-L27 HydrophobicContact CB-CB 4.23Å; E2-L27 PolarHBondContact N-O 3.31Å; E2-L27 PolarHBondContact O-N 2.95Å; Y4-L27 HydrophobicContact CD2-CD1 3.98Å; Y4-L27 HydrophobicContact CE2-CD1 4.12Å; E25-L27 HydrophobicContact CG-CD1 3.78Å; E25-L27 WeakPolarHBondContact OE1-CD1 3.42Å; L27-R31 WeakPolarHBondContact CA-O 3.48Å; L27-K32 HydrophobicContact CG-CB 4.39Å
28M89.8Confident93Very high56 Ų5659 Ų5928%0.27630%0.295SS..EExtended strand (participates in β ladder)trans-146.2128.6179.1-164.9-17870.200109.9G30 R31 V102M28-G30 VanDerWaalsContact C-N 3.26Å; M28-G30 PolarHBondContact O-N 2.93Å; M28-R31 PolarHBondContact N-O 2.94Å; M28-R31 WeakPolarHBondContact O-CB 3.33Å; M28-R31 PolarHBondContact O-N 3.45Å; M28-V102 HydrophobicContact CE-CG1 3.49Å; M28-V102 VanDerWaalsContact CE-CG1 3.49Å; M28-V102 HydrophobicContact CE-CG2 4.47Å; M28-V102 HydrophobicContact SD-CG1 3.53Å; M28-V102 VanDerWaalsContact SD-CG1 3.53Å; M28-V102 HydrophobicContact SD-CG2 4.26Å
29N87.1Confident93.4Very high147 Ų14759.6 Ų59.679%0.78629%0.292SS*.THydrogen-bonded Turntrans52.941.4176.7-53.7-12.5000113.1R31N29-R31 PolarHBondContact O-N 3.11Å
30G87.7Confident93.5Very high91 Ų9160.7 Ų60.794%0.93831%0.308SS*.THydrogen-bonded Turntrans721.3-177.500000115.1M28M28-G30 VanDerWaalsContact C-N 3.26Å; M28-G30 PolarHBondContact O-N 2.93Å
31R90Very high93.7Very high203 Ų20362.6 Ų62.677%0.76632%0.315SS*.EExtended strand (participates in β ladder)trans-99.3140.6174.4-60.5-177.3-178.4-176.5-0.5109.9L27 M28 N29L27-R31 WeakPolarHBondContact CA-O 3.48Å; M28-R31 PolarHBondContact N-O 2.94Å; M28-R31 WeakPolarHBondContact O-CB 3.33Å; M28-R31 PolarHBondContact O-N 3.45Å; N29-R31 PolarHBondContact O-N 3.11Å
32K93.8Very high93.7Very high117 Ų11762.2 Ų62.251%0.50931%0.313SS..EExtended strand (participates in β ladder)trans-117.8130.1176.4172.6172.4164.5158.90109.4E25 V26 L27E25-K32 HydrophobicContact CG-CD 4.19Å; E25-K32 HydrophobicContact CG-CG 4.16Å; E25-K32 WeakPolarHBondContact OE1-CD 3.5Å; E25-K32 WeakPolarHBondContact OE1-CE 3.49Å; E25-K32 IonicContact OE1-NZ 3.84Å; E25-K32 PolarHBondContact OE1-NZ 3.31Å; E25-K32 WeakPolarHBondContact OE2-CE 3.39Å; E25-K32 IonicContact OE2-NZ 2.74Å; E25-K32 PolarHBondContact OE2-NZ 3.48Å; V26-K32 WeakPolarHBondContact O-CA 3.46Å; L27-K32 HydrophobicContact CG-CB 4.39Å
33H95.2Very high93.5Very high58 Ų5863.5 Ų63.527%0.26932%0.319SS..EExtended strand (participates in β ladder)trans-138.7166.3171.568-87.8000111.4V26 L100V26-H33 VanDerWaalsContact CB-CE1 3.48Å; V26-H33 WeakPolarHBondContact CB-CE1 3.31Å; V26-H33 VanDerWaalsContact CG1-CE1 3.42Å; V26-H33 WeakPolarHBondContact CG1-CE1 3.48Å; V26-H33 PolarHBondContact N-O 3.5Å; V26-H33 PolarHBondContact O-N 2.93Å; H33-L100 PolarHBondContact NE2-O 3.38Å
34F95.6Very high93.3Very high94 Ų9462.6 Ų62.641%0.41232%0.323SS..EExtended strand (participates in β ladder)trans-116.7141.2179.2-63.4-73.9000111.1K23 I24 E25K23-F34 HydrophobicContact CD-CD1 4.2Å; K23-F34 VanDerWaalsContact CE-CE1 3.42Å; K23-F34 VanDerWaalsContact CE-CG 3.43Å; K23-F34 HydrophobicContact CG-CD1 4Å; I24-F34 CarbonylContact O-C 3.48Å; I24-F34 VanDerWaalsContact O-CA 3.24Å; I24-F34 WeakPolarHBondContact O-CA 3.36Å; E25-F34 HydrophobicContact CB-CD1 3.92Å; E25-F34 HydrophobicContact CB-CE1 3.72Å; E25-F34 HydrophobicContact CG-CD1 4.16Å; E25-F34 HydrophobicContact CG-CE1 3.67Å; E25-F34 HydrophobicContact CG-CZ 4.4Å; E25-F34 WeakPolarHBondContact OE2-CE1 3.43Å
35V95.9Very high93Very high7 Ų763 Ų634%0.04233%0.326CS..EExtended strand (participates in β ladder)trans-128.8136.2174.6-172.80000108.2I24 V26 K37 L100 N101I24-V35 WeakPolarHBondContact CA-O 3.33Å; I24-V35 HydrophobicContact CB-CB 4.38Å; I24-V35 WeakPolarHBondContact CB-O 3.09Å; I24-V35 PolarHBondContact N-O 2.88Å; I24-V35 PolarHBondContact O-N 3.4Å; V26-V35 HydrophobicContact CG2-CG2 4.43Å; V35-K37 HydrophobicContact CG1-CD 4.37Å; V35-K37 HydrophobicContact CG1-CG 4.05Å; V35-L100 WeakPolarHBondContact CG2-O 3.38Å; V35-N101 HydrophobicContact CG2-CB 4.19Å
36E95.8Very high92.7Very high89 Ų8962.7 Ų62.742%0.41632%0.324SS..EExtended strand (participates in β ladder)trans-110.5127.9-179.5-64.8-169.2156.400110R9 V21 F22R9-E36 IonicContact CZ-OE1 3.13Å; R9-E36 IonicContact CZ-OE2 3.39Å; R9-E36 IonicContact NH1-OE1 3.23Å; R9-E36 PolarHBondContact NH1-OE1 2.91Å; R9-E36 IonicContact NH1-OE2 3.56Å; R9-E36 PolarHBondContact NH1-OE2 3.15Å; R9-E36 IonicContact NH2-OE1 3.32Å; R9-E36 IonicContact NH2-OE2 2.62Å; R9-E36 PolarHBondContact NH2-OE2 3.43Å; V21-E36 HydrophobicContact CG1-CB 3.7Å; V21-E36 HydrophobicContact CG1-CG 4.4Å; F22-E36 WeakPolarHBondContact O-CA 3.48Å
37K95.5Very high92.4Very high33 Ų3368.9 Ų68.914%0.14335%0.351CS..EExtended strand (participates in β ladder)trans-139.4138.3-174-66.2-65.2179.9-163.30112.2F22 I24 V35 E41 F42 F99F22-K37 PolarHBondContact N-O 3.11Å; F22-K37 PolarHBondContact O-N 3.26Å; I24-K37 HydrophobicContact CD1-CB 4.02Å; I24-K37 HydrophobicContact CD1-CG 3.71Å; V35-K37 HydrophobicContact CG1-CD 4.37Å; V35-K37 HydrophobicContact CG1-CG 4.05Å; K37-E41 WeakPolarHBondContact CA-OE2 3.35Å; K37-E41 HydrophobicContact CD-CB 4.19Å; K37-E41 VanDerWaalsContact CD-CD 3.49Å; K37-E41 WeakPolarHBondContact CD-OE1 3.26Å; K37-E41 IonicContact NZ-OE1 3.46Å; K37-E41 PolarHBondContact NZ-OE1 3.15Å; K37-F42 HydrophobicContact CB-CD2 4.08Å; K37-F42 HydrophobicContact CB-CE2 3.45Å; K37-F42 VanDerWaalsContact CB-CE2 3.45Å; K37-F42 HydrophobicContact CB-CZ 4.02Å; K37-F99 HydrophobicContact CB-CE2 4.42Å; K37-F99 HydrophobicContact CB-CZ 3.96Å; K37-F99 HydrophobicContact CD-CD2 4.24Å; K37-F99 HydrophobicContact CD-CE2 3.69Å; K37-F99 HydrophobicContact CD-CZ 3.93Å; K37-F99 VanDerWaalsContact CE-O 3.28Å; K37-F99 WeakPolarHBondContact CE-O 3.5Å; K37-F99 HydrophobicContact CG-CE1 4.07Å; K37-F99 HydrophobicContact CG-CE2 3.86Å; K37-F99 HydrophobicContact CG-CZ 3.53Å
38R93.7Very high92Very high88 Ų8871.9 Ų71.933%0.33236%0.362SS..EExtended strand (participates in β ladder)trans-81.2151.5168.3-60.9-174.9-173.7179.64.7109.8Y19 V21 S40 E41 F42Y19-R38 HydrophobicContact CD2-CG 4.27Å; Y19-R38 PolarHBondContact OH-NH2 3.22Å; V21-R38 HydrophobicContact CG2-CG 4.4Å; R38-S40 PolarHBondContact O-N 3.49Å; R38-S40 VanDerWaalsContact O-N 3.11Å; R38-E41 HydrophobicContact CB-CG 4.47Å; R38-E41 PolarHBondContact N-OE2 3.36Å; R38-E41 WeakPolarHBondContact O-CB 3.5Å; R38-E41 PolarHBondContact O-N 2.78Å; R38-F42 WeakPolarHBondContact O-CD2 3.46Å; R38-F42 PolarHBondContact O-N 2.86Å
39Y91.3Very high91.9Very high30 Ų3069.2 Ų69.212%0.11835%0.349CS..Hα-helixtrans-53.1-36177.2175.8-99.1000113.5E41 F42 H43 P59 S60 K61 R74 L78Y39-E41 PolarHBondContact O-N 3.1Å; Y39-F42 PolarHBondContact O-N 3.08Å; Y39-H43 PolarHBondContact O-N 3.47Å; Y39-P59 PolarHBondContact OH-O 2.98Å; Y39-S60 VanDerWaalsContact OH-C 3.25Å; Y39-S60 PolarHBondContact OH-O 2.87Å; Y39-K61 HydrophobicContact CE1-CB 4.13Å; Y39-K61 HydrophobicContact CE1-CG 3.89Å; Y39-K61 VanDerWaalsContact OH-CA 3.29Å; Y39-K61 WeakPolarHBondContact OH-CA 3.07Å; Y39-K61 VanDerWaalsContact OH-CG 3.28Å; Y39-K61 WeakPolarHBondContact OH-CG 3.45Å; Y39-K61 PolarHBondContact OH-N 3.12Å; Y39-K61 VanDerWaalsContact OH-N 3.13Å; Y39-R74 HydrophobicContact CD2-CG 4.32Å; Y39-L78 HydrophobicContact CD2-CD1 4.25Å; Y39-L78 HydrophobicContact CD2-CD2 4.21Å; Y39-L78 HydrophobicContact CE2-CD2 4.26Å
40S90.9Very high91.8Very high78 Ų7869.1 Ų69.155%0.54534%0.341SS..Hα-helixtrans-58.5-34.8176.446.30000112.7R38 H43 A44R38-S40 PolarHBondContact O-N 3.49Å; R38-S40 VanDerWaalsContact O-N 3.11Å; S40-H43 PolarHBondContact O-N 2.86Å; S40-A44 WeakPolarHBondContact O-CB 3.46Å; S40-A44 PolarHBondContact O-N 3.14Å
41E94.4Very high91.4Very high66 Ų6673.7 Ų73.731%0.30834%0.335SS..Hα-helixtrans-71.2-42.7178-60.7176.479.100111.5K37 R38 Y39 H43 A44 L45 F99K37-E41 WeakPolarHBondContact CA-OE2 3.35Å; K37-E41 HydrophobicContact CD-CB 4.19Å; K37-E41 VanDerWaalsContact CD-CD 3.49Å; K37-E41 WeakPolarHBondContact CD-OE1 3.26Å; K37-E41 IonicContact NZ-OE1 3.46Å; K37-E41 PolarHBondContact NZ-OE1 3.15Å; R38-E41 HydrophobicContact CB-CG 4.47Å; R38-E41 PolarHBondContact N-OE2 3.36Å; R38-E41 WeakPolarHBondContact O-CB 3.5Å; R38-E41 PolarHBondContact O-N 2.78Å; Y39-E41 PolarHBondContact O-N 3.1Å; E41-H43 VanDerWaalsContact C-N 3.27Å; E41-H43 PolarHBondContact O-N 3.46Å; E41-A44 WeakPolarHBondContact O-CB 3.47Å; E41-A44 PolarHBondContact O-N 2.72Å; E41-A44 VanDerWaalsContact O-N 3.14Å; E41-L45 PolarHBondContact O-N 3.21Å; E41-F99 HydrophobicContact CB-CE2 3.94Å
42F93.8Very high90.6Very high0 Ų067.8 Ų67.80%032%0.324CS..Hα-helixtrans-57.4-43.4172.1-71.1-96000111.2I5 F22 I24 K37 R38 Y39 A44 L45 H46 I58 L78 L82 F99I5-F42 HydrophobicContact CD1-CE1 4.1Å; I5-F42 HydrophobicContact CD1-CZ 4.02Å; F22-F42 HydrophobicContact CB-CE2 4.21Å; F22-F42 HydrophobicContact CB-CZ 4.35Å; F22-F42 HydrophobicContact CD2-CE2 4.2Å; F22-F42 HydrophobicContact CG-CE2 4.47Å; I24-F42 HydrophobicContact CD1-CE1 4.03Å; I24-F42 HydrophobicContact CD1-CE2 4.44Å; I24-F42 HydrophobicContact CD1-CZ 3.57Å; I24-F42 HydrophobicContact CG1-CZ 4.02Å; K37-F42 HydrophobicContact CB-CD2 4.08Å; K37-F42 HydrophobicContact CB-CE2 3.45Å; K37-F42 VanDerWaalsContact CB-CE2 3.45Å; K37-F42 HydrophobicContact CB-CZ 4.02Å; R38-F42 WeakPolarHBondContact O-CD2 3.46Å; R38-F42 PolarHBondContact O-N 2.86Å; Y39-F42 PolarHBondContact O-N 3.08Å; F42-A44 VanDerWaalsContact C-N 3.34Å; F42-A44 PolarHBondContact O-N 3.32Å; F42-L45 WeakPolarHBondContact O-CB 3.5Å; F42-L45 PolarHBondContact O-N 2.83Å; F42-H46 WeakPolarHBondContact O-CB 3.37Å; F42-H46 PolarHBondContact O-N 3.32Å; F42-I58 HydrophobicContact CB-CD1 4.36Å; F42-L78 HydrophobicContact CB-CD2 3.95Å; F42-L78 HydrophobicContact CD1-CB 4.44Å; F42-L78 HydrophobicContact CD1-CD1 4.44Å; F42-L78 HydrophobicContact CD1-CD2 3.78Å; F42-L78 HydrophobicContact CD1-CG 4.44Å; F42-L78 HydrophobicContact CD2-CD1 4.14Å; F42-L78 HydrophobicContact CD2-CD2 4.46Å; F42-L78 HydrophobicContact CE1-CB 4.16Å; F42-L78 HydrophobicContact CE1-CD1 4.35Å; F42-L78 HydrophobicContact CE1-CD2 4.32Å; F42-L78 HydrophobicContact CE2-CD1 4.07Å; F42-L78 HydrophobicContact CG-CD1 4.31Å; F42-L78 HydrophobicContact CG-CD2 3.84Å; F42-L78 HydrophobicContact CZ-CD1 4.17Å; F42-L82 HydrophobicContact CD1-CD2 4.49Å; F42-L82 HydrophobicContact CE1-CD1 3.92Å; F42-L82 HydrophobicContact CE1-CD2 4.36Å; F42-L82 HydrophobicContact CE1-CG 4.24Å; F42-F99 HydrophobicContact CD1-CE1 4.2Å; F42-F99 AromaticContact CD1-CZ 3.83Å; F42-F99 HydrophobicContact CD1-CZ 3.83Å; F42-F99 HydrophobicContact CD2-CZ 4.17Å; F42-F99 HydrophobicContact CE1-CE1 4.12Å; F42-F99 HydrophobicContact CE1-CZ 4.01Å; F42-F99 HydrophobicContact CE2-CZ 4.31Å; F42-F99 AromaticContact CG-CZ 3.93Å; F42-F99 HydrophobicContact CG-CZ 3.93Å; F42-F99 HydrophobicContact CZ-CZ 4.25Å
43H91.2Very high89.8Confident27 Ų2763.7 Ų63.713%0.12531%0.308CS..Hα-helixtrans-66.8-36.8177.8-168.7-64000112.3Y39 S40 E41 K47 K61Y39-H43 PolarHBondContact O-N 3.47Å; S40-H43 PolarHBondContact O-N 2.86Å; E41-H43 VanDerWaalsContact C-N 3.27Å; E41-H43 PolarHBondContact O-N 3.46Å; H43-K47 WeakPolarHBondContact CE1-CE 3.48Å; H43-K47 PolarHBondContact O-N 3.06Å; H43-K47 VanDerWaalsContact O-N 3.11Å; H43-K61 WeakPolarHBondContact CD2-CD 3.38Å; H43-K61 WeakPolarHBondContact CD2-CE 3.37Å; H43-K61 VanDerWaalsContact CD2-CG 3.5Å; H43-K61 WeakPolarHBondContact CD2-CG 3.35Å; H43-K61 PolarHBondContact CD2-NZ 2.83Å; H43-K61 PolarHBondContact CE1-NZ 3.08Å; H43-K61 PolarHBondContact ND1-NZ 3.3Å; H43-K61 VanDerWaalsContact ND1-NZ 3.13Å; H43-K61 VanDerWaalsContact NE2-CD 3.26Å; H43-K61 WeakPolarHBondContact NE2-CD 3.28Å; H43-K61 VanDerWaalsContact NE2-CE 3.29Å; H43-K61 WeakPolarHBondContact NE2-CE 3.28Å; H43-K61 PolarHBondContact NE2-NZ 3.09Å
44A92.1Very high88.7Confident47 Ų4770.1 Ų70.139%0.38834%0.335SS..Hα-helixtrans-65.2-42.1175.300000111.1S40 E41 F42 K47 K48S40-A44 WeakPolarHBondContact O-CB 3.46Å; S40-A44 PolarHBondContact O-N 3.14Å; E41-A44 WeakPolarHBondContact O-CB 3.47Å; E41-A44 PolarHBondContact O-N 2.72Å; E41-A44 VanDerWaalsContact O-N 3.14Å; F42-A44 VanDerWaalsContact C-N 3.34Å; F42-A44 PolarHBondContact O-N 3.32Å; A44-K47 PolarHBondContact O-N 3.12Å; A44-K48 WeakPolarHBondContact O-CG 3.44Å; A44-K48 PolarHBondContact O-N 3.11Å
45L92.1Very high87.3Confident9 Ų967.1 Ų67.15%0.04732%0.324CS..Hα-helixtrans-59-51.3173.2178.468.8000111.1E41 F42 K47 K48 L49 L95 F96 F99E41-L45 PolarHBondContact O-N 3.21Å; F42-L45 WeakPolarHBondContact O-CB 3.5Å; F42-L45 PolarHBondContact O-N 2.83Å; L45-K47 VanDerWaalsContact C-N 3.33Å; L45-K47 PolarHBondContact O-N 3.15Å; L45-K48 WeakPolarHBondContact O-CA 3.42Å; L45-K48 PolarHBondContact O-N 3.26Å; L45-L49 HydrophobicContact CD1-CD1 3.96Å; L45-L49 HydrophobicContact CD1-CG 4.07Å; L45-L49 HydrophobicContact CD2-CD1 4.09Å; L45-L49 HydrophobicContact CG-CD1 3.69Å; L45-L49 HydrophobicContact CG-CG 4.17Å; L45-L49 PolarHBondContact O-N 3.48Å; L45-L95 HydrophobicContact CD1-CB 4.44Å; L45-L95 WeakPolarHBondContact CD1-O 3.2Å; L45-F96 HydrophobicContact CD2-CD2 4.04Å; L45-F99 HydrophobicContact CB-CD2 4.13Å; L45-F99 HydrophobicContact CB-CE2 4.32Å; L45-F99 HydrophobicContact CD1-CB 3.98Å; L45-F99 HydrophobicContact CD1-CG 4.31Å; L45-F99 HydrophobicContact CD2-CB 4.04Å; L45-F99 HydrophobicContact CD2-CD1 3.6Å; L45-F99 HydrophobicContact CD2-CD2 3.94Å; L45-F99 HydrophobicContact CD2-CE1 3.96Å; L45-F99 HydrophobicContact CD2-CE2 4.25Å; L45-F99 HydrophobicContact CD2-CG 3.59Å; L45-F99 HydrophobicContact CD2-CZ 4.26Å; L45-F99 HydrophobicContact CG-CD2 4.41Å; L45-F99 HydrophobicContact CG-CG 4.35Å
46H89.5Confident86.3Confident23 Ų2367.9 Ų67.911%0.10633%0.329CS..Hα-helixtrans-57.1-43.9-180177.383.7000112.6F42 K48 L49 K50 T55 I58 Y81F42-H46 WeakPolarHBondContact O-CB 3.37Å; F42-H46 PolarHBondContact O-N 3.32Å; H46-K48 PolarHBondContact O-N 3.5Å; H46-L49 PolarHBondContact O-N 3.26Å; H46-K50 WeakPolarHBondContact O-CB 3.42Å; H46-K50 PolarHBondContact O-N 2.99Å; H46-T55 PolarHBondContact CE1-OG1 3.08Å; H46-I58 HydrophobicContact CB-CD1 3.71Å; H46-Y81 AromaticContact ND1-CE2 3.52Å; H46-Y81 AromaticContact ND1-CZ 3.59Å; H46-Y81 PolarHBondContact ND1-OH 2.84Å
47K89.9Confident85.2Confident130 Ų13072.6 Ų72.657%0.56535%0.352SS*.Hα-helixtrans-57.6-35.9175.6-80.9-173.2174.2-170.40112.8H43 A44 L45H43-K47 WeakPolarHBondContact CE1-CE 3.48Å; H43-K47 PolarHBondContact O-N 3.06Å; H43-K47 VanDerWaalsContact O-N 3.11Å; A44-K47 PolarHBondContact O-N 3.12Å; L45-K47 VanDerWaalsContact C-N 3.33Å; L45-K47 PolarHBondContact O-N 3.15Å
48K87.9Confident84.3Confident117 Ų11772.2 Ų72.251%0.50935%0.351SS..Hα-helixtrans-78.2-45.2177.9-65178.2-178.9-1790110.9A44 L45 H46 K50 K51 L95A44-K48 WeakPolarHBondContact O-CG 3.44Å; A44-K48 PolarHBondContact O-N 3.11Å; L45-K48 WeakPolarHBondContact O-CA 3.42Å; L45-K48 PolarHBondContact O-N 3.26Å; H46-K48 PolarHBondContact O-N 3.5Å; K48-K50 VanDerWaalsContact C-N 3.34Å; K48-K50 PolarHBondContact O-N 3.18Å; K48-K51 WeakPolarHBondContact O-CB 3.35Å; K48-K51 PolarHBondContact O-N 3.41Å; K48-L95 HydrophobicContact CB-CD1 3.91Å; K48-L95 HydrophobicContact CD-CD1 4.23Å
49L86.9Confident83.4Confident0 Ų069.4 Ų69.40%034%0.344CS..Hα-helixtrans-63.5-35.8-179.7-77.9176.4000113.5L45 H46 K51 C52 I53 T55 P93 F96L45-L49 HydrophobicContact CD1-CD1 3.96Å; L45-L49 HydrophobicContact CD1-CG 4.07Å; L45-L49 HydrophobicContact CD2-CD1 4.09Å; L45-L49 HydrophobicContact CG-CD1 3.69Å; L45-L49 HydrophobicContact CG-CG 4.17Å; L45-L49 PolarHBondContact O-N 3.48Å; H46-L49 PolarHBondContact O-N 3.26Å; L49-K51 PolarHBondContact O-N 2.91Å; L49-C52 PolarHBondContact O-N 2.94Å; L49-I53 HydrophobicContact CB-CG1 4.33Å; L49-I53 HydrophobicContact CD2-CD1 4.1Å; L49-I53 HydrophobicContact CD2-CG1 4.35Å; L49-I53 WeakPolarHBondContact O-CG1 3.33Å; L49-I53 PolarHBondContact O-N 2.84Å; L49-T55 HydrophobicContact CB-CG2 3.64Å; L49-P93 HydrophobicContact CD2-CB 3.88Å; L49-P93 HydrophobicContact CD2-CG 3.79Å; L49-F96 HydrophobicContact CD1-CD2 3.98Å; L49-F96 HydrophobicContact CD2-CB 4.39Å
50K84.6Confident82.5Confident144 Ų14471.5 Ų71.563%0.62636%0.363SS*.THydrogen-bonded Turntrans-57.6-19.9177.1-171.1172.3-178.4174.60113.2H46 K48 T55H46-K50 WeakPolarHBondContact O-CB 3.42Å; H46-K50 PolarHBondContact O-N 2.99Å; K48-K50 VanDerWaalsContact C-N 3.34Å; K48-K50 PolarHBondContact O-N 3.18Å; K50-T55 HydrophobicContact CB-CG2 4.35Å
51K79.9Confident81.1Confident187 Ų18772.5 Ų72.581%0.81336%0.357SS*.THydrogen-bonded Turntrans-85.5-21.9175.1-58.9-175.8178-173.20113.4K48 L49K48-K51 WeakPolarHBondContact O-CB 3.35Å; K48-K51 PolarHBondContact O-N 3.41Å; L49-K51 PolarHBondContact O-N 2.91Å
52C71.9Confident79.5Confident79 Ų7977.9 Ų77.953%0.53438%0.382SS..THydrogen-bonded Turntrans-102.5-35.1-172.8-59.60000112.1L49L49-C52 PolarHBondContact O-N 2.94Å
53I77.2Confident78Confident31 Ų3180.6 Ų80.616%0.15940%0.398CS..SBendtrans-142161-172.258.9167.8000110.8L49 T55 V85 N89 P93L49-I53 HydrophobicContact CB-CG1 4.33Å; L49-I53 HydrophobicContact CD2-CD1 4.1Å; L49-I53 HydrophobicContact CD2-CG1 4.35Å; L49-I53 WeakPolarHBondContact O-CG1 3.33Å; L49-I53 PolarHBondContact O-N 2.84Å; I53-T55 HydrophobicContact CD1-CG2 4.28Å; I53-T55 HydrophobicContact CG1-CG2 3.88Å; I53-T55 PolarHBondContact O-N 3.29Å; I53-T55 VanDerWaalsContact O-N 3.16Å; I53-V85 HydrophobicContact CD1-CG1 4.06Å; I53-N89 WeakPolarHBondContact CG2-OD1 3.29Å; I53-P93 HydrophobicContact CD1-CG 4.42Å; I53-P93 HydrophobicContact CG2-CG 3.91Å
54K72.4Confident77.1Confident193 Ų19386.6 Ų86.684%0.83942%0.42SS*.  trans-67.2111.9164.1-72.7-175.8-179.6177.90107.1
55T67.3Low76Confident31 Ų3188.1 Ų88.119%0.1942%0.421CS..PPolyproline II helixtrans-96.8136.5-177.4510000111.4H46 L49 K50 I53H46-T55 PolarHBondContact CE1-OG1 3.08Å; L49-T55 HydrophobicContact CB-CG2 3.64Å; K50-T55 HydrophobicContact CB-CG2 4.35Å; I53-T55 HydrophobicContact CD1-CG2 4.28Å; I53-T55 HydrophobicContact CG1-CG2 3.88Å; I53-T55 PolarHBondContact O-N 3.29Å; I53-T55 VanDerWaalsContact O-N 3.16Å
56P73.5Confident74.9Confident23 Ų2396.8 Ų96.815%0.14945%0.454CS..PPolyproline II helixtrans-63.3164.5169.622.4-28.6000111.7I58 Y81 A84 V85P56-I58 PolarHBondContact O-N 3.16Å; P56-Y81 HydrophobicContact CB-CD2 4.43Å; P56-Y81 HydrophobicContact CG-CD2 3.89Å; P56-Y81 HydrophobicContact CG-CE2 3.99Å; P56-Y81 WeakPolarHBondContact O-CE2 3.38Å; P56-A84 HydrophobicContact CB-CB 3.97Å; P56-A84 HydrophobicContact CG-CB 3.64Å; P56-V85 HydrophobicContact CG-CG2 3.9Å
57E72.7Confident74.5Confident189 Ų18997.9 Ų97.988%0.88346%0.462SS*.PPolyproline II helixtrans-70.6122-175.6-159.4173.8-168.800110.9
58I76.4Confident74.2Confident25 Ų2596.2 Ų96.213%0.12846%0.464CS..PPolyproline II helixtrans-84.2138.6177.8-168.3173.2000109.9F42 H46 P56 S60 L78 Y81F42-I58 HydrophobicContact CB-CD1 4.36Å; H46-I58 HydrophobicContact CB-CD1 3.71Å; P56-I58 PolarHBondContact O-N 3.16Å; I58-S60 PolarHBondContact O-N 2.91Å; I58-L78 HydrophobicContact CG1-CD2 4.41Å; I58-Y81 HydrophobicContact CB-CD2 4.23Å; I58-Y81 HydrophobicContact CB-CE2 4.32Å
59P75.5Confident74.1Confident29 Ų2999.1 Ų99.119%0.18848%0.477CS..PPolyproline II helixtrans-54.8139.1175.418.6-32.8000112.6Y39 L78Y39-P59 PolarHBondContact OH-O 2.98Å; P59-L78 HydrophobicContact CG-CD2 3.72Å; P59-L78 HydrophobicContact CG-CG 3.95Å
60S71.5Confident74Confident73 Ų73100.8 Ų100.851%0.5149%0.487SS..PPolyproline II helixtrans-58.5146.7-171-178.10000114.4Y39 I58 H62 R74Y39-S60 VanDerWaalsContact OH-C 3.25Å; Y39-S60 PolarHBondContact OH-O 2.87Å; I58-S60 PolarHBondContact O-N 2.91Å; S60-H62 PolarHBondContact OG-N 3.33Å; S60-R74 PolarHBondContact O-NH2 3.19Å
61K62.8Low74.1Confident100 Ų10094.6 Ų94.644%0.43546%0.461SS..SBendtrans-69.9-34.4174.9-54.6-174.4104.2153.20112.1Y39 H43 V63 R74Y39-K61 HydrophobicContact CE1-CB 4.13Å; Y39-K61 HydrophobicContact CE1-CG 3.89Å; Y39-K61 VanDerWaalsContact OH-CA 3.29Å; Y39-K61 WeakPolarHBondContact OH-CA 3.07Å; Y39-K61 VanDerWaalsContact OH-CG 3.28Å; Y39-K61 WeakPolarHBondContact OH-CG 3.45Å; Y39-K61 PolarHBondContact OH-N 3.12Å; Y39-K61 VanDerWaalsContact OH-N 3.13Å; H43-K61 WeakPolarHBondContact CD2-CD 3.38Å; H43-K61 WeakPolarHBondContact CD2-CE 3.37Å; H43-K61 VanDerWaalsContact CD2-CG 3.5Å; H43-K61 WeakPolarHBondContact CD2-CG 3.35Å; H43-K61 PolarHBondContact CD2-NZ 2.83Å; H43-K61 PolarHBondContact CE1-NZ 3.08Å; H43-K61 PolarHBondContact ND1-NZ 3.3Å; H43-K61 VanDerWaalsContact ND1-NZ 3.13Å; H43-K61 VanDerWaalsContact NE2-CD 3.26Å; H43-K61 WeakPolarHBondContact NE2-CD 3.28Å; H43-K61 VanDerWaalsContact NE2-CE 3.29Å; H43-K61 WeakPolarHBondContact NE2-CE 3.28Å; H43-K61 PolarHBondContact NE2-NZ 3.09Å; K61-V63 VanDerWaalsContact C-N 3.34Å; K61-V63 PolarHBondContact O-N 3.43Å; K61-V63 VanDerWaalsContact O-N 3.15Å; K61-R74 PolarHBondContact O-NH2 2.77Å; K61-R74 VanDerWaalsContact O-NH2 3.16Å
62H59.7Low74.6Confident179 Ų17989.5 Ų89.583%0.82944%0.44SS*.  trans-89.773.7-177.7-75.392.1000109.8S60S60-H62 PolarHBondContact OG-N 3.33Å
63V62.4Low75.5Confident56 Ų5692.8 Ų92.834%0.33945%0.447SS..SBendtrans-124.4159.4163.3-70.90000110.3K61 N65 V70K61-V63 VanDerWaalsContact C-N 3.34Å; K61-V63 PolarHBondContact O-N 3.43Å; K61-V63 VanDerWaalsContact O-N 3.15Å; V63-N65 PolarHBondContact O-N 3.37Å; V63-N65 PolarHBondContact O-OD1 2.89Å; V63-V70 HydrophobicContact CB-CG1 3.54Å; V63-V70 HydrophobicContact CG1-CG1 4.25Å; V63-V70 HydrophobicContact CG2-CG1 3.89Å
64R72.3Confident76.1Confident154 Ų15491.9 Ų91.958%0.58144%0.442SS*.  trans-76.889.4-175-163.4175.9-92.2-163.3-1.2110W66 V67R64-W66 VanDerWaalsContact CD-CE2 3.41Å; R64-W66 HydrophobicContact CG-CD2 3.57Å; R64-W66 HydrophobicContact CG-CE3 3.88Å; R64-W66 HydrophobicContact CG-CG 4.34Å; R64-W66 HydrophobicContact CG-CH2 3.5Å; R64-W66 HydrophobicContact CG-CZ2 3.15Å; R64-W66 HydrophobicContact CG-CZ3 3.84Å; R64-W66 PolarHBondContact O-N 3.11Å; R64-V67 HydrophobicContact CB-CG2 4.32Å; R64-V67 HydrophobicContact CG-CG2 3.94Å; R64-V67 PolarHBondContact O-N 2.94Å
65N69.4Low77.1Confident78 Ų7883.7 Ų83.742%0.41741%0.405SS..THydrogen-bonded Turntrans-63.4-8.7-168.4-62.7-14.5000116.3V63 L71 R74V63-N65 PolarHBondContact O-N 3.37Å; V63-N65 PolarHBondContact O-OD1 2.89Å; N65-L71 WeakPolarHBondContact O-CD1 3.4Å; N65-L71 WeakPolarHBondContact O-CG 3.29Å; N65-R74 PolarHBondContact OD1-NH1 3.14Å; N65-R74 PolarHBondContact OD1-NH2 3.12Å
66W70.1Confident78.4Confident192 Ų19285.9 Ų85.973%0.72741%0.414SS*.THydrogen-bonded Turntrans-96.8-8.8178.65988.8000113.7R64 P68R64-W66 VanDerWaalsContact CD-CE2 3.41Å; R64-W66 HydrophobicContact CG-CD2 3.57Å; R64-W66 HydrophobicContact CG-CE3 3.88Å; R64-W66 HydrophobicContact CG-CG 4.34Å; R64-W66 HydrophobicContact CG-CH2 3.5Å; R64-W66 HydrophobicContact CG-CZ2 3.15Å; R64-W66 HydrophobicContact CG-CZ3 3.84Å; R64-W66 PolarHBondContact O-N 3.11Å; W66-P68 WeakPolarHBondContact O-CD 3.36Å
67V81.1Confident79.3Confident46 Ų4685.9 Ų85.928%0.27942%0.418SS..  trans-89.1117.1-179.7179.60000108.7R64 K69 V70 L71R64-V67 HydrophobicContact CB-CG2 4.32Å; R64-V67 HydrophobicContact CG-CG2 3.94Å; R64-V67 PolarHBondContact O-N 2.94Å; V67-K69 VanDerWaalsContact C-N 3.3Å; V67-K69 HydrophobicContact CG1-CB 4.37Å; V67-K69 PolarHBondContact O-N 3.42Å; V67-V70 HydrophobicContact CB-CB 4.02Å; V67-V70 HydrophobicContact CB-CG2 3.75Å; V67-V70 HydrophobicContact CG1-CB 4.37Å; V67-V70 HydrophobicContact CG1-CG2 3.81Å; V67-V70 WeakPolarHBondContact O-CB 3.29Å; V67-V70 PolarHBondContact O-N 3.26Å; V67-L71 PolarHBondContact O-N 3.29Å; V67-L71 VanDerWaalsContact O-N 3.09Å
68P82.4Confident80.3Confident94 Ų9476.9 Ų76.961%0.6138%0.376SS*.Hα-helixtrans-56.9-40.3-175.1-27.935.6000113.6W66 V70 L71 E72W66-P68 WeakPolarHBondContact O-CD 3.36Å; P68-V70 VanDerWaalsContact C-N 3.28Å; P68-V70 PolarHBondContact O-N 3.08Å; P68-L71 PolarHBondContact O-N 2.9Å; P68-E72 PolarHBondContact O-N 2.99Å
69K85.9Confident81.2Confident179 Ų17976.6 Ų76.678%0.77837%0.374SS*.Hα-helixtrans-60.7-36.2176.4-66.4-174.4177.6-176.90112.9V67 Q73V67-K69 VanDerWaalsContact C-N 3.3Å; V67-K69 HydrophobicContact CG1-CB 4.37Å; V67-K69 PolarHBondContact O-N 3.42Å; K69-Q73 PolarHBondContact O-N 3.04Å
70V85.2Confident82.1Confident34 Ų3478.7 Ų78.721%0.20639%0.386CS..Hα-helixtrans-73.4-38179174.80000110.7V63 V67 P68 Q73 R74V63-V70 HydrophobicContact CB-CG1 3.54Å; V63-V70 HydrophobicContact CG1-CG1 4.25Å; V63-V70 HydrophobicContact CG2-CG1 3.89Å; V67-V70 HydrophobicContact CB-CB 4.02Å; V67-V70 HydrophobicContact CB-CG2 3.75Å; V67-V70 HydrophobicContact CG1-CB 4.37Å; V67-V70 HydrophobicContact CG1-CG2 3.81Å; V67-V70 WeakPolarHBondContact O-CB 3.29Å; V67-V70 PolarHBondContact O-N 3.26Å; P68-V70 VanDerWaalsContact C-N 3.28Å; P68-V70 PolarHBondContact O-N 3.08Å; V70-Q73 PolarHBondContact O-N 3.24Å; V70-R74 WeakPolarHBondContact O-CB 3.45Å; V70-R74 PolarHBondContact O-N 3.13Å
71L86.9Confident83.1Confident15 Ų1575.3 Ų75.38%0.07936%0.362CS..Hα-helixtrans-65.7-39.2173.3-72.5179.4000112F8 T20 N65 V67 P68 R74 R75F8-L71 HydrophobicContact CD2-CB 4.45Å; F8-L71 HydrophobicContact CD2-CD1 4.35Å; F8-L71 HydrophobicContact CE1-CB 4.32Å; F8-L71 HydrophobicContact CE2-CB 3.76Å; F8-L71 HydrophobicContact CE2-CD1 3.76Å; F8-L71 HydrophobicContact CE2-CG 4.43Å; F8-L71 HydrophobicContact CZ-CB 3.69Å; F8-L71 HydrophobicContact CZ-CD1 4.45Å; T20-L71 HydrophobicContact CG2-CD1 4.45Å; T20-L71 HydrophobicContact CG2-CD2 4.46Å; N65-L71 WeakPolarHBondContact O-CD1 3.4Å; N65-L71 WeakPolarHBondContact O-CG 3.29Å; V67-L71 PolarHBondContact O-N 3.29Å; V67-L71 VanDerWaalsContact O-N 3.09Å; P68-L71 PolarHBondContact O-N 2.9Å; L71-R74 CarbonylContact O-C 3.57Å; L71-R74 WeakPolarHBondContact O-CB 3.32Å; L71-R74 PolarHBondContact O-N 3.33Å; L71-R75 PolarHBondContact O-N 3.47Å
72E90.6Very high84.6Confident80 Ų8070.6 Ų70.637%0.37434%0.342SS..Hα-helixtrans-65.4-43.4175.3-178.854.5-153.200111.8F8 P68 R74 R75 Q76F8-E72 HydrophobicContact CE1-CB 4.35Å; F8-E72 WeakPolarHBondContact CE1-OE2 3.18Å; P68-E72 PolarHBondContact O-N 2.99Å; E72-R74 VanDerWaalsContact C-N 3.27Å; E72-R74 PolarHBondContact O-N 2.84Å; E72-R75 VanDerWaalsContact CD-NE 3.31Å; E72-R75 WeakPolarHBondContact O-CB 3.27Å; E72-R75 PolarHBondContact O-N 3.42Å; E72-R75 VanDerWaalsContact O-N 3.12Å; E72-R75 IonicContact OE1-CZ 3.59Å; E72-R75 VanDerWaalsContact OE1-CZ 3.23Å; E72-R75 IonicContact OE1-NE 3.47Å; E72-R75 PolarHBondContact OE1-NE 2.84Å; E72-R75 IonicContact OE1-NH2 3.98Å; E72-R75 PolarHBondContact OE1-NH2 3.24Å; E72-R75 WeakPolarHBondContact OE2-CD 3.43Å; E72-R75 IonicContact OE2-NE 2.81Å; E72-R75 PolarHBondContact OE2-NE 3.34Å; E72-R75 VanDerWaalsContact OE2-NE 3.13Å; E72-Q76 PolarHBondContact O-N 3.17Å
73Q90Very high86.2Confident147 Ų14765.3 Ų65.369%0.68732%0.317SS*.Hα-helixtrans-59.7-40.4172.7-174.5-177.3-6.600111.5K69 V70 Q76 G77K69-Q73 PolarHBondContact O-N 3.04Å; V70-Q73 PolarHBondContact O-N 3.24Å; Q73-Q76 PolarHBondContact O-N 3.3Å; Q73-G77 PolarHBondContact O-N 3.11Å
74R90.1Very high87.6Confident13 Ų1363.6 Ų63.65%0.04931%0.309CS..Hα-helixtrans-64.7-42.6174.2177.1-178.5-85168.7-10.7111.3F22 Y39 S60 K61 N65 V70 L71 E72 Q76 G77 L78F22-R74 HydrophobicContact CZ-CG 4.18Å; Y39-R74 HydrophobicContact CD2-CG 4.32Å; S60-R74 PolarHBondContact O-NH2 3.19Å; K61-R74 PolarHBondContact O-NH2 2.77Å; K61-R74 VanDerWaalsContact O-NH2 3.16Å; N65-R74 PolarHBondContact OD1-NH1 3.14Å; N65-R74 PolarHBondContact OD1-NH2 3.12Å; V70-R74 WeakPolarHBondContact O-CB 3.45Å; V70-R74 PolarHBondContact O-N 3.13Å; L71-R74 CarbonylContact O-C 3.57Å; L71-R74 WeakPolarHBondContact O-CB 3.32Å; L71-R74 PolarHBondContact O-N 3.33Å; E72-R74 VanDerWaalsContact C-N 3.27Å; E72-R74 PolarHBondContact O-N 2.84Å; R74-Q76 VanDerWaalsContact C-N 3.34Å; R74-Q76 PolarHBondContact O-N 2.91Å; R74-G77 PolarHBondContact O-N 3.48Å; R74-L78 HydrophobicContact CG-CD1 4.09Å; R74-L78 HydrophobicContact CG-CG 4.25Å; R74-L78 WeakPolarHBondContact O-CB 3.18Å; R74-L78 VanDerWaalsContact O-CG 3.29Å; R74-L78 WeakPolarHBondContact O-CG 3.44Å; R74-L78 PolarHBondContact O-N 3.11Å
75R93.8Very high88.5Confident20 Ų2056.3 Ų56.38%0.07528%0.282CS..Hα-helixtrans-55.1-51.6175.8-173.8-153.96763.14.1110I5 F8 F22 L71 E72 G77 L78 E79I5-R75 HydrophobicContact CB-CG 4.1Å; I5-R75 HydrophobicContact CG2-CG 3.57Å; I5-R75 WeakPolarHBondContact O-CD 3.45Å; I5-R75 PolarHBondContact O-NH1 2.86Å; F8-R75 HydrophobicContact CD1-CB 4.15Å; F8-R75 HydrophobicContact CD1-CG 4.25Å; F22-R75 HydrophobicContact CD1-CB 4.18Å; F22-R75 HydrophobicContact CD1-CG 4.14Å; F22-R75 HydrophobicContact CE1-CB 3.96Å; F22-R75 HydrophobicContact CE1-CG 4.42Å; L71-R75 PolarHBondContact O-N 3.47Å; E72-R75 VanDerWaalsContact CD-NE 3.31Å; E72-R75 WeakPolarHBondContact O-CB 3.27Å; E72-R75 PolarHBondContact O-N 3.42Å; E72-R75 VanDerWaalsContact O-N 3.12Å; E72-R75 IonicContact OE1-CZ 3.59Å; E72-R75 VanDerWaalsContact OE1-CZ 3.23Å; E72-R75 IonicContact OE1-NE 3.47Å; E72-R75 PolarHBondContact OE1-NE 2.84Å; E72-R75 IonicContact OE1-NH2 3.98Å; E72-R75 PolarHBondContact OE1-NH2 3.24Å; E72-R75 WeakPolarHBondContact OE2-CD 3.43Å; E72-R75 IonicContact OE2-NE 2.81Å; E72-R75 PolarHBondContact OE2-NE 3.34Å; E72-R75 VanDerWaalsContact OE2-NE 3.13Å; R75-G77 PolarHBondContact O-N 3.27Å; R75-L78 PolarHBondContact O-N 2.76Å; R75-E79 IonicContact NH1-OE1 3.95Å; R75-E79 IonicContact NH1-OE2 2.91Å; R75-E79 PolarHBondContact NH1-OE2 2.91Å; R75-E79 PolarHBondContact O-N 3.13Å
76Q93.3Very high89.5Confident77 Ų7754 Ų5436%0.3627%0.269SS..Hα-helixtrans-61.3-44178.2-16959.258.800111.9E72 Q73 R74 L78 E79 T80E72-Q76 PolarHBondContact O-N 3.17Å; Q73-Q76 PolarHBondContact O-N 3.3Å; R74-Q76 VanDerWaalsContact C-N 3.34Å; R74-Q76 PolarHBondContact O-N 2.91Å; Q76-L78 VanDerWaalsContact C-N 3.34Å; Q76-L78 PolarHBondContact O-N 3.46Å; Q76-E79 PolarHBondContact NE2-OE1 2.69Å; Q76-E79 WeakPolarHBondContact O-CB 3.35Å; Q76-E79 PolarHBondContact O-N 3.41Å; Q76-T80 PolarHBondContact O-N 3.15Å; Q76-T80 PolarHBondContact O-OG1 3.45Å; Q76-T80 VanDerWaalsContact O-OG1 3.08Å
77G93.1Very high90.4Very high23 Ų2352.3 Ų52.324%0.23727%0.273CS..Hα-helixtrans-64.2-35.7177.500000113.6Q73 R74 R75 Y81Q73-G77 PolarHBondContact O-N 3.11Å; R74-G77 PolarHBondContact O-N 3.48Å; R75-G77 PolarHBondContact O-N 3.27Å; G77-Y81 VanDerWaalsContact O-CB 3.29Å; G77-Y81 WeakPolarHBondContact O-CB 3.37Å; G77-Y81 PolarHBondContact O-N 3.07Å
78L94.3Very high90.7Very high0 Ų055.6 Ų55.60%029%0.286CS..Hα-helixtrans-69.9-39.5174.8-70.8175000111.5I5 F22 Y39 F42 I58 P59 R74 R75 Q76 Y81 L82I5-L78 HydrophobicContact CD1-CB 3.67Å; F22-L78 HydrophobicContact CD1-CD1 4.22Å; F22-L78 HydrophobicContact CD2-CD1 3.99Å; F22-L78 HydrophobicContact CE1-CD1 4.17Å; F22-L78 HydrophobicContact CE2-CD1 3.93Å; F22-L78 HydrophobicContact CG-CD1 4.15Å; F22-L78 HydrophobicContact CZ-CD1 4.02Å; Y39-L78 HydrophobicContact CD2-CD1 4.25Å; Y39-L78 HydrophobicContact CD2-CD2 4.21Å; Y39-L78 HydrophobicContact CE2-CD2 4.26Å; F42-L78 HydrophobicContact CB-CD2 3.95Å; F42-L78 HydrophobicContact CD1-CB 4.44Å; F42-L78 HydrophobicContact CD1-CD1 4.44Å; F42-L78 HydrophobicContact CD1-CD2 3.78Å; F42-L78 HydrophobicContact CD1-CG 4.44Å; F42-L78 HydrophobicContact CD2-CD1 4.14Å; F42-L78 HydrophobicContact CD2-CD2 4.46Å; F42-L78 HydrophobicContact CE1-CB 4.16Å; F42-L78 HydrophobicContact CE1-CD1 4.35Å; F42-L78 HydrophobicContact CE1-CD2 4.32Å; F42-L78 HydrophobicContact CE2-CD1 4.07Å; F42-L78 HydrophobicContact CG-CD1 4.31Å; F42-L78 HydrophobicContact CG-CD2 3.84Å; F42-L78 HydrophobicContact CZ-CD1 4.17Å; I58-L78 HydrophobicContact CG1-CD2 4.41Å; P59-L78 HydrophobicContact CG-CD2 3.72Å; P59-L78 HydrophobicContact CG-CG 3.95Å; R74-L78 HydrophobicContact CG-CD1 4.09Å; R74-L78 HydrophobicContact CG-CG 4.25Å; R74-L78 WeakPolarHBondContact O-CB 3.18Å; R74-L78 VanDerWaalsContact O-CG 3.29Å; R74-L78 WeakPolarHBondContact O-CG 3.44Å; R74-L78 PolarHBondContact O-N 3.11Å; R75-L78 PolarHBondContact O-N 2.76Å; Q76-L78 VanDerWaalsContact C-N 3.34Å; Q76-L78 PolarHBondContact O-N 3.46Å; L78-Y81 WeakPolarHBondContact O-CB 3.37Å; L78-Y81 PolarHBondContact O-N 3.03Å; L78-L82 WeakPolarHBondContact O-CG 3.35Å; L78-L82 PolarHBondContact O-N 3.26Å
79E95.2Very high90.8Very high20 Ų2052.5 Ų52.59%0.09326%0.264CS..Hα-helixtrans-61.6-51.9175178.7176.577.100110.8Y4 I5 R75 Q76 Y81 L82 Q83Y4-E79 WeakPolarHBondContact CA-OE2 3.46Å; I5-E79 HydrophobicContact CB-CB 4.18Å; I5-E79 HydrophobicContact CD1-CB 4.19Å; I5-E79 HydrophobicContact CG1-CB 3.98Å; I5-E79 PolarHBondContact N-OE2 3.05Å; R75-E79 IonicContact NH1-OE1 3.95Å; R75-E79 IonicContact NH1-OE2 2.91Å; R75-E79 PolarHBondContact NH1-OE2 2.91Å; R75-E79 PolarHBondContact O-N 3.13Å; Q76-E79 PolarHBondContact NE2-OE1 2.69Å; Q76-E79 WeakPolarHBondContact O-CB 3.35Å; Q76-E79 PolarHBondContact O-N 3.41Å; E79-Y81 VanDerWaalsContact C-N 3.26Å; E79-Y81 PolarHBondContact O-N 3.19Å; E79-L82 PolarHBondContact O-N 3.38Å; E79-L82 VanDerWaalsContact O-N 3.15Å; E79-Q83 WeakPolarHBondContact O-CG 3.49Å; E79-Q83 PolarHBondContact O-N 2.91Å
80T94.1Very high90.6Very high72 Ų7253.8 Ų53.844%0.44227%0.273SS..Hα-helixtrans-59.2-38.3176.4-57.50000111.6Q76 Q83 A84Q76-T80 PolarHBondContact O-N 3.15Å; Q76-T80 PolarHBondContact O-OG1 3.45Å; Q76-T80 VanDerWaalsContact O-OG1 3.08Å; T80-Q83 PolarHBondContact O-N 3.25Å; T80-A84 VanDerWaalsContact O-CB 3.24Å; T80-A84 WeakPolarHBondContact O-CB 3.24Å; T80-A84 PolarHBondContact O-N 2.93Å
81Y93.2Very high90.5Very high3 Ų360.5 Ų60.51%0.01230%0.302CS..Hα-helixtrans-60.4-48174.7172.1-100000112.4H46 P56 I58 G77 L78 E79 A84 V85H46-Y81 AromaticContact ND1-CE2 3.52Å; H46-Y81 AromaticContact ND1-CZ 3.59Å; H46-Y81 PolarHBondContact ND1-OH 2.84Å; P56-Y81 HydrophobicContact CB-CD2 4.43Å; P56-Y81 HydrophobicContact CG-CD2 3.89Å; P56-Y81 HydrophobicContact CG-CE2 3.99Å; P56-Y81 WeakPolarHBondContact O-CE2 3.38Å; I58-Y81 HydrophobicContact CB-CD2 4.23Å; I58-Y81 HydrophobicContact CB-CE2 4.32Å; G77-Y81 VanDerWaalsContact O-CB 3.29Å; G77-Y81 WeakPolarHBondContact O-CB 3.37Å; G77-Y81 PolarHBondContact O-N 3.07Å; L78-Y81 WeakPolarHBondContact O-CB 3.37Å; L78-Y81 PolarHBondContact O-N 3.03Å; E79-Y81 VanDerWaalsContact C-N 3.26Å; E79-Y81 PolarHBondContact O-N 3.19Å; Y81-A84 PolarHBondContact O-N 3.14Å; Y81-V85 HydrophobicContact CE1-CG2 4.33Å; Y81-V85 HydrophobicContact CE2-CG2 4.11Å; Y81-V85 WeakPolarHBondContact O-CG2 3.37Å; Y81-V85 PolarHBondContact O-N 3.36Å; Y81-V85 VanDerWaalsContact O-N 3.07Å
82L93.6Very high90.5Very high0 Ų061.6 Ų61.60%031%0.308CS..Hα-helixtrans-64.1-42.8178.3-67.1-177.4000111.6V3 I5 I24 F42 L78 E79 V85 I86 F96 F99 L100V3-L82 HydrophobicContact CG1-CB 4.15Å; V3-L82 HydrophobicContact CG1-CD1 3.69Å; I5-L82 HydrophobicContact CD1-CD1 4.26Å; I24-L82 HydrophobicContact CD1-CD1 4.23Å; I24-L82 HydrophobicContact CG2-CD1 4.1Å; F42-L82 HydrophobicContact CD1-CD2 4.49Å; F42-L82 HydrophobicContact CE1-CD1 3.92Å; F42-L82 HydrophobicContact CE1-CD2 4.36Å; F42-L82 HydrophobicContact CE1-CG 4.24Å; L78-L82 WeakPolarHBondContact O-CG 3.35Å; L78-L82 PolarHBondContact O-N 3.26Å; E79-L82 PolarHBondContact O-N 3.38Å; E79-L82 VanDerWaalsContact O-N 3.15Å; L82-V85 PolarHBondContact O-N 3.05Å; L82-I86 WeakPolarHBondContact O-CG1 3.43Å; L82-I86 PolarHBondContact O-N 3.39Å; L82-I86 VanDerWaalsContact O-N 3.14Å; L82-F96 HydrophobicContact CD2-CE2 3.61Å; L82-F96 HydrophobicContact CD2-CZ 4.09Å; L82-F99 HydrophobicContact CD2-CE1 4.37Å; L82-L100 HydrophobicContact CD1-CD2 4.37Å
83Q94.3Very high90.4Very high68 Ų6859 Ų5932%0.31830%0.298SS..Hα-helixtrans-63.9-41.9178.2-70.5173.9-12.400111.9V3 E79 T80 I86 L87V3-Q83 WeakPolarHBondContact O-CG 3.49Å; V3-Q83 PolarHBondContact O-NE2 2.86Å; E79-Q83 WeakPolarHBondContact O-CG 3.49Å; E79-Q83 PolarHBondContact O-N 2.91Å; T80-Q83 PolarHBondContact O-N 3.25Å; Q83-I86 PolarHBondContact O-N 3.47Å; Q83-L87 WeakPolarHBondContact O-CB 3.29Å; Q83-L87 PolarHBondContact O-N 3.36Å
84A91.3Very high90.3Very high21 Ų2157.9 Ų57.917%0.17429%0.291CS..Hα-helixtrans-64.3-40.8176.800000111.9P56 T80 Y81 I86 L87 E88P56-A84 HydrophobicContact CB-CB 3.97Å; P56-A84 HydrophobicContact CG-CB 3.64Å; T80-A84 VanDerWaalsContact O-CB 3.24Å; T80-A84 WeakPolarHBondContact O-CB 3.24Å; T80-A84 PolarHBondContact O-N 2.93Å; Y81-A84 PolarHBondContact O-N 3.14Å; A84-I86 VanDerWaalsContact C-N 3.27Å; A84-I86 PolarHBondContact O-N 2.69Å; A84-L87 PolarHBondContact O-N 3.37Å; A84-E88 WeakPolarHBondContact O-CB 3.37Å; A84-E88 WeakPolarHBondContact O-CG 3.24Å; A84-E88 PolarHBondContact O-N 3.06Å
85V90.4Very high90.3Very high0 Ų060.6 Ų60.60%031%0.306CS..Hα-helixtrans-60-38.8173.5172.40000111.4I53 P56 Y81 L82 N89 L92 F96I53-V85 HydrophobicContact CD1-CG1 4.06Å; P56-V85 HydrophobicContact CG-CG2 3.9Å; Y81-V85 HydrophobicContact CE1-CG2 4.33Å; Y81-V85 HydrophobicContact CE2-CG2 4.11Å; Y81-V85 WeakPolarHBondContact O-CG2 3.37Å; Y81-V85 PolarHBondContact O-N 3.36Å; Y81-V85 VanDerWaalsContact O-N 3.07Å; L82-V85 PolarHBondContact O-N 3.05Å; V85-N89 WeakPolarHBondContact O-CB 3.48Å; V85-N89 PolarHBondContact O-N 3.33Å; V85-N89 PolarHBondContact O-ND2 2.69Å; V85-L92 HydrophobicContact CG1-CD2 4.19Å; V85-F96 HydrophobicContact CB-CE2 4Å; V85-F96 HydrophobicContact CB-CZ 4.32Å; V85-F96 HydrophobicContact CG1-CD2 3.81Å; V85-F96 HydrophobicContact CG1-CE2 3.66Å; V85-F96 HydrophobicContact CG1-CG 4.31Å; V85-F96 HydrophobicContact CG1-CZ 4.06Å
86I91.1Very high90.2Very high31 Ų3159.6 Ų59.616%0.15930%0.302CS..Hα-helixtrans-70.5-39.4177.7-65.2164.2000111.9M1 V3 L82 Q83 A84 L92 F96M1-I86 HydrophobicContact CB-CG2 4.39Å; M1-I86 HydrophobicContact CG-CD1 4.28Å; M1-I86 HydrophobicContact SD-CD1 4.22Å; V3-I86 HydrophobicContact CB-CD1 3.97Å; V3-I86 HydrophobicContact CG2-CD1 3.42Å; V3-I86 VanDerWaalsContact CG2-CD1 3.42Å; L82-I86 WeakPolarHBondContact O-CG1 3.43Å; L82-I86 PolarHBondContact O-N 3.39Å; L82-I86 VanDerWaalsContact O-N 3.14Å; Q83-I86 PolarHBondContact O-N 3.47Å; A84-I86 VanDerWaalsContact C-N 3.27Å; A84-I86 PolarHBondContact O-N 2.69Å; I86-L92 HydrophobicContact CG1-CD1 4.27Å; I86-L92 HydrophobicContact CG1-CD2 4.35Å; I86-F96 HydrophobicContact CD1-CE1 4.07Å; I86-F96 HydrophobicContact CD1-CZ 4.06Å; I86-F96 HydrophobicContact CG1-CE1 3.66Å; I86-F96 HydrophobicContact CG1-CZ 3.76Å
87L89.4Confident90.2Very high155 Ų15557.2 Ų57.281%0.81229%0.291SS*.Hα-helixtrans-72.9-38.1-177.4-172.867.1000112.6Q83 A84Q83-L87 WeakPolarHBondContact O-CB 3.29Å; Q83-L87 PolarHBondContact O-N 3.36Å; A84-L87 PolarHBondContact O-N 3.37Å
88E86.9Confident90.1Very high115 Ų11560.1 Ų60.154%0.53730%0.302SS..Hα-helixtrans-81-16.7-175.2-70177.1-164.700113.8A84A84-E88 WeakPolarHBondContact O-CB 3.37Å; A84-E88 WeakPolarHBondContact O-CG 3.24Å; A84-E88 PolarHBondContact O-N 3.06Å
89N84.6Confident90.1Very high30 Ų3061 Ų6116%0.1631%0.306CS..  trans-120.7113.8-173.1-59.9-88.9000110.6I53 V85 E91 L92I53-N89 WeakPolarHBondContact CG2-OD1 3.29Å; V85-N89 WeakPolarHBondContact O-CB 3.48Å; V85-N89 PolarHBondContact O-N 3.33Å; V85-N89 PolarHBondContact O-ND2 2.69Å; N89-E91 VanDerWaalsContact C-N 3.33Å; N89-L92 HydrophobicContact CB-CD2 4.37Å
90E80.9Confident90.1Very high205 Ų20560 Ų6096%0.95830%0.301SS*.SBendtrans-64.6-38.9175.9-166.9171.6-166.200111.5
91E83.6Confident89.9Confident176 Ų17661.7 Ų61.782%0.82231%0.307SS*.SBendtrans-112.6119.1170.4-65.6-167156.600111.3N89N89-E91 VanDerWaalsContact C-N 3.33Å
92L86.1Confident89.6Confident37 Ų3761.9 Ų61.919%0.19431%0.309CS..  trans-79.1129.7-179.6-74.1172.5000111.8M1 V85 I86 N89 K94 F96 L97M1-L92 HydrophobicContact SD-CD1 3.75Å; V85-L92 HydrophobicContact CG1-CD2 4.19Å; I86-L92 HydrophobicContact CG1-CD1 4.27Å; I86-L92 HydrophobicContact CG1-CD2 4.35Å; N89-L92 HydrophobicContact CB-CD2 4.37Å; L92-K94 PolarHBondContact O-N 3.29Å; L92-F96 HydrophobicContact CB-CD1 4.42Å; L92-F96 HydrophobicContact CD1-CD1 4.01Å; L92-F96 HydrophobicContact CD1-CE1 4.04Å; L92-F96 HydrophobicContact CD2-CD1 3.79Å; L92-F96 HydrophobicContact CD2-CE1 3.96Å; L92-F96 HydrophobicContact CD2-CG 4.47Å; L92-F96 HydrophobicContact CG-CD1 4.31Å; L92-L97 HydrophobicContact CB-CD1 4.48Å; L92-L97 HydrophobicContact CB-CD2 3.93Å; L92-L97 HydrophobicContact CB-CG 4.15Å; L92-L97 HydrophobicContact CD1-CD2 3.92Å
93P88.3Confident88.9Confident25 Ų2573.4 Ų73.416%0.16235%0.352CS..  trans-57.7140.4174.8-26.435.3000112.4L49 I53 L95 F96 L97L49-P93 HydrophobicContact CD2-CB 3.88Å; L49-P93 HydrophobicContact CD2-CG 3.79Å; I53-P93 HydrophobicContact CD1-CG 4.42Å; I53-P93 HydrophobicContact CG2-CG 3.91Å; P93-L95 PolarHBondContact O-N 2.76Å; P93-L95 VanDerWaalsContact O-N 3.08Å; P93-F96 WeakPolarHBondContact O-CA 3.11Å; P93-F96 VanDerWaalsContact O-CB 3.31Å; P93-F96 WeakPolarHBondContact O-CB 3.4Å; P93-F96 PolarHBondContact O-N 2.92Å; P93-L97 PolarHBondContact O-N 3.02Å
94K88.8Confident87.8Confident125 Ų12573 Ų7354%0.54335%0.35SS..Hα-helixtrans-49.2-40.4179.1-64.2-178.1174.4-173.30113.4L92 F96 L97 D98 H104L92-K94 PolarHBondContact O-N 3.29Å; K94-F96 VanDerWaalsContact C-N 3.25Å; K94-F96 PolarHBondContact O-N 2.92Å; K94-L97 PolarHBondContact O-N 2.84Å; K94-L97 VanDerWaalsContact O-N 3.15Å; K94-D98 WeakPolarHBondContact O-CB 3.34Å; K94-D98 PolarHBondContact O-N 3.02Å; K94-H104 WeakPolarHBondContact CD-NE2 3.33Å; K94-H104 WeakPolarHBondContact CG-NE2 3.47Å
95L90.3Very high86Confident69 Ų6979.3 Ų79.336%0.36138%0.38SS..Hα-helixtrans-59.7-32.9177.6-65.4172.2000113.6L45 K48 P93 F99L45-L95 HydrophobicContact CD1-CB 4.44Å; L45-L95 WeakPolarHBondContact CD1-O 3.2Å; K48-L95 HydrophobicContact CB-CD1 3.91Å; K48-L95 HydrophobicContact CD-CD1 4.23Å; P93-L95 PolarHBondContact O-N 2.76Å; P93-L95 VanDerWaalsContact O-N 3.08Å; L95-F99 WeakPolarHBondContact O-CB 3.37Å; L95-F99 PolarHBondContact O-N 2.86Å; L95-F99 VanDerWaalsContact O-N 3.11Å
96F92.1Very high84.1Confident0 Ų083.8 Ų83.80%041%0.409CS..Hα-helixtrans-74.7-42.8176.1-175.6-96000110.9L45 L49 L82 V85 I86 L92 P93 K94 F99 L100L45-F96 HydrophobicContact CD2-CD2 4.04Å; L49-F96 HydrophobicContact CD1-CD2 3.98Å; L49-F96 HydrophobicContact CD2-CB 4.39Å; L82-F96 HydrophobicContact CD2-CE2 3.61Å; L82-F96 HydrophobicContact CD2-CZ 4.09Å; V85-F96 HydrophobicContact CB-CE2 4Å; V85-F96 HydrophobicContact CB-CZ 4.32Å; V85-F96 HydrophobicContact CG1-CD2 3.81Å; V85-F96 HydrophobicContact CG1-CE2 3.66Å; V85-F96 HydrophobicContact CG1-CG 4.31Å; V85-F96 HydrophobicContact CG1-CZ 4.06Å; I86-F96 HydrophobicContact CD1-CE1 4.07Å; I86-F96 HydrophobicContact CD1-CZ 4.06Å; I86-F96 HydrophobicContact CG1-CE1 3.66Å; I86-F96 HydrophobicContact CG1-CZ 3.76Å; L92-F96 HydrophobicContact CB-CD1 4.42Å; L92-F96 HydrophobicContact CD1-CD1 4.01Å; L92-F96 HydrophobicContact CD1-CE1 4.04Å; L92-F96 HydrophobicContact CD2-CD1 3.79Å; L92-F96 HydrophobicContact CD2-CE1 3.96Å; L92-F96 HydrophobicContact CD2-CG 4.47Å; L92-F96 HydrophobicContact CG-CD1 4.31Å; P93-F96 WeakPolarHBondContact O-CA 3.11Å; P93-F96 VanDerWaalsContact O-CB 3.31Å; P93-F96 WeakPolarHBondContact O-CB 3.4Å; P93-F96 PolarHBondContact O-N 2.92Å; K94-F96 VanDerWaalsContact C-N 3.25Å; K94-F96 PolarHBondContact O-N 2.92Å; F96-F99 WeakPolarHBondContact O-CB 3.04Å; F96-F99 PolarHBondContact O-N 2.75Å; F96-L100 HydrophobicContact CD1-CD1 3.9Å; F96-L100 HydrophobicContact CE1-CD1 3.3Å; F96-L100 HydrophobicContact CE1-CG 4.37Å; F96-L100 HydrophobicContact CE2-CD1 4.38Å; F96-L100 HydrophobicContact CZ-CD1 3.59Å; F96-L100 PolarHBondContact O-N 2.91Å; F96-L100 VanDerWaalsContact O-N 3.11Å
97L92.3Very high81.9Confident26 Ų2687.2 Ų87.214%0.13644%0.436CS..Hα-helixtrans-62.1-45.1175.8-60.4176.9000111L92 P93 K94 F99 L100 N101 V102 H104L92-L97 HydrophobicContact CB-CD1 4.48Å; L92-L97 HydrophobicContact CB-CD2 3.93Å; L92-L97 HydrophobicContact CB-CG 4.15Å; L92-L97 HydrophobicContact CD1-CD2 3.92Å; P93-L97 PolarHBondContact O-N 3.02Å; K94-L97 PolarHBondContact O-N 2.84Å; K94-L97 VanDerWaalsContact O-N 3.15Å; L97-F99 VanDerWaalsContact C-N 3.32Å; L97-F99 PolarHBondContact O-N 2.85Å; L97-L100 CarbonylContact O-C 3.52Å; L97-L100 PolarHBondContact O-N 2.9Å; L97-L100 VanDerWaalsContact O-N 3.12Å; L97-N101 PolarHBondContact O-N 2.73Å; L97-N101 VanDerWaalsContact O-N 3.09Å; L97-V102 HydrophobicContact CB-CB 4.18Å; L97-V102 HydrophobicContact CB-CG1 4.47Å; L97-V102 HydrophobicContact CD2-CB 4.2Å; L97-V102 HydrophobicContact CD2-CG1 4.02Å; L97-V102 PolarHBondContact O-N 2.97Å; L97-H104 HydrophobicContact CD1-CB 3.69Å
98D92.3Very high79.5Confident84 Ų8486.7 Ų86.745%0.44943%0.433SS..Hα-helixtrans-60.9-40.9174.9-68-22.7000111.9K94 L100 N101 H104K94-D98 WeakPolarHBondContact O-CB 3.34Å; K94-D98 PolarHBondContact O-N 3.02Å; D98-L100 PolarHBondContact O-N 2.91Å; D98-N101 PolarHBondContact O-N 3.17Å; D98-N101 VanDerWaalsContact O-N 3.08Å; D98-N101 PolarHBondContact O-OD1 3.16Å; D98-H104 IonicContact OD1-CE1 3.53Å; D98-H104 PolarHBondContact OD1-CE1 2.9Å; D98-H104 IonicContact OD1-ND1 2.69Å; D98-H104 PolarHBondContact OD1-ND1 2.89Å; D98-H104 IonicContact OD2-CE1 3.06Å
99F93.8Very high77.3Confident19 Ų1986.2 Ų86.28%0.08344%0.44CS..Hα-helixtrans-61.7-33.4176.9177.4-93.4000112.5I24 K37 E41 F42 L45 L82 L95 F96 L97 N101I24-F99 HydrophobicContact CD1-CE1 3.89Å; I24-F99 HydrophobicContact CD1-CZ 4.36Å; K37-F99 HydrophobicContact CB-CE2 4.42Å; K37-F99 HydrophobicContact CB-CZ 3.96Å; K37-F99 HydrophobicContact CD-CD2 4.24Å; K37-F99 HydrophobicContact CD-CE2 3.69Å; K37-F99 HydrophobicContact CD-CZ 3.93Å; K37-F99 VanDerWaalsContact CE-O 3.28Å; K37-F99 WeakPolarHBondContact CE-O 3.5Å; K37-F99 HydrophobicContact CG-CE1 4.07Å; K37-F99 HydrophobicContact CG-CE2 3.86Å; K37-F99 HydrophobicContact CG-CZ 3.53Å; E41-F99 HydrophobicContact CB-CE2 3.94Å; F42-F99 HydrophobicContact CD1-CE1 4.2Å; F42-F99 AromaticContact CD1-CZ 3.83Å; F42-F99 HydrophobicContact CD1-CZ 3.83Å; F42-F99 HydrophobicContact CD2-CZ 4.17Å; F42-F99 HydrophobicContact CE1-CE1 4.12Å; F42-F99 HydrophobicContact CE1-CZ 4.01Å; F42-F99 HydrophobicContact CE2-CZ 4.31Å; F42-F99 AromaticContact CG-CZ 3.93Å; F42-F99 HydrophobicContact CG-CZ 3.93Å; F42-F99 HydrophobicContact CZ-CZ 4.25Å; L45-F99 HydrophobicContact CB-CD2 4.13Å; L45-F99 HydrophobicContact CB-CE2 4.32Å; L45-F99 HydrophobicContact CD1-CB 3.98Å; L45-F99 HydrophobicContact CD1-CG 4.31Å; L45-F99 HydrophobicContact CD2-CB 4.04Å; L45-F99 HydrophobicContact CD2-CD1 3.6Å; L45-F99 HydrophobicContact CD2-CD2 3.94Å; L45-F99 HydrophobicContact CD2-CE1 3.96Å; L45-F99 HydrophobicContact CD2-CE2 4.25Å; L45-F99 HydrophobicContact CD2-CG 3.59Å; L45-F99 HydrophobicContact CD2-CZ 4.26Å; L45-F99 HydrophobicContact CG-CD2 4.41Å; L45-F99 HydrophobicContact CG-CG 4.35Å; L82-F99 HydrophobicContact CD2-CE1 4.37Å; L95-F99 WeakPolarHBondContact O-CB 3.37Å; L95-F99 PolarHBondContact O-N 2.86Å; L95-F99 VanDerWaalsContact O-N 3.11Å; F96-F99 WeakPolarHBondContact O-CB 3.04Å; F96-F99 PolarHBondContact O-N 2.75Å; L97-F99 VanDerWaalsContact C-N 3.32Å; L97-F99 PolarHBondContact O-N 2.85Å; F99-N101 VanDerWaalsContact C-N 3.34Å
100L94.1Very high75.3Confident0 Ų094.8 Ų94.80%048%0.476CS..THydrogen-bonded Turntrans-92.810.4177.2-62.5-178.9000113.1M1 V3 I24 V26 H33 V35 L82 F96 L97 D98 V102M1-L100 HydrophobicContact CE-CB 4.26Å; M1-L100 HydrophobicContact CE-CD1 3.3Å; M1-L100 HydrophobicContact CE-CG 4.4Å; V3-L100 HydrophobicContact CG2-CD1 4.03Å; I24-L100 HydrophobicContact CD1-CD2 4.28Å; I24-L100 HydrophobicContact CG2-CD2 4.13Å; V26-L100 HydrophobicContact CG2-CB 4.3Å; V26-L100 HydrophobicContact CG2-CD2 4.16Å; H33-L100 PolarHBondContact NE2-O 3.38Å; V35-L100 WeakPolarHBondContact CG2-O 3.38Å; L82-L100 HydrophobicContact CD1-CD2 4.37Å; F96-L100 HydrophobicContact CD1-CD1 3.9Å; F96-L100 HydrophobicContact CE1-CD1 3.3Å; F96-L100 HydrophobicContact CE1-CG 4.37Å; F96-L100 HydrophobicContact CE2-CD1 4.38Å; F96-L100 HydrophobicContact CZ-CD1 3.59Å; F96-L100 PolarHBondContact O-N 2.91Å; F96-L100 VanDerWaalsContact O-N 3.11Å; L97-L100 CarbonylContact O-C 3.52Å; L97-L100 PolarHBondContact O-N 2.9Å; L97-L100 VanDerWaalsContact O-N 3.12Å; D98-L100 PolarHBondContact O-N 2.91Å; L100-V102 HydrophobicContact CB-CG2 4.06Å; L100-V102 PolarHBondContact O-N 3.27Å; L100-V102 VanDerWaalsContact O-N 3.12Å
101N90.6Very high73.3Confident106 Ų10688.8 Ų88.857%0.56746%0.462SS*.THydrogen-bonded Turntrans51.330.8-175.6-69.624.2000113.4V35 L97 D98 F99V35-N101 HydrophobicContact CG2-CB 4.19Å; L97-N101 PolarHBondContact O-N 2.73Å; L97-N101 VanDerWaalsContact O-N 3.09Å; D98-N101 PolarHBondContact O-N 3.17Å; D98-N101 VanDerWaalsContact O-N 3.08Å; D98-N101 PolarHBondContact O-OD1 3.16Å; F99-N101 VanDerWaalsContact C-N 3.34Å
102V86.6Confident71.6Confident8 Ų889.6 Ų89.65%0.04847%0.465CS..  trans-85.9115.7174.6173.40000108.2M1 V26 M28 L97 L100 H104M1-V102 HydrophobicContact CE-CG2 3.8Å; V26-V102 HydrophobicContact CG1-CG2 4.25Å; M28-V102 HydrophobicContact CE-CG1 3.49Å; M28-V102 VanDerWaalsContact CE-CG1 3.49Å; M28-V102 HydrophobicContact CE-CG2 4.47Å; M28-V102 HydrophobicContact SD-CG1 3.53Å; M28-V102 VanDerWaalsContact SD-CG1 3.53Å; M28-V102 HydrophobicContact SD-CG2 4.26Å; L97-V102 HydrophobicContact CB-CB 4.18Å; L97-V102 HydrophobicContact CB-CG1 4.47Å; L97-V102 HydrophobicContact CD2-CB 4.2Å; L97-V102 HydrophobicContact CD2-CG1 4.02Å; L97-V102 PolarHBondContact O-N 2.97Å; L100-V102 HydrophobicContact CB-CG2 4.06Å; L100-V102 PolarHBondContact O-N 3.27Å; L100-V102 VanDerWaalsContact O-N 3.12Å; V102-H104 PolarHBondContact O-N 3.37Å; V102-H104 VanDerWaalsContact O-N 3.12Å
103R78.8Confident69.5Low242 Ų24293.3 Ų93.391%0.91349%0.494SS*.  trans-64.2115.2173.7-66.1-173.3-176.2-174.72108.8
104H70.8Confident67.5Low60 Ų6098.6 Ų98.628%0.27853%0.53SS..  trans-99.4112.5165.464.6-83.5000106.9K94 L97 D98 V102K94-H104 WeakPolarHBondContact CD-NE2 3.33Å; K94-H104 WeakPolarHBondContact CG-NE2 3.47Å; L97-H104 HydrophobicContact CD1-CB 3.69Å; D98-H104 IonicContact OD1-CE1 3.53Å; D98-H104 PolarHBondContact OD1-CE1 2.9Å; D98-H104 IonicContact OD1-ND1 2.69Å; D98-H104 PolarHBondContact OD1-ND1 2.89Å; D98-H104 IonicContact OD2-CE1 3.06Å; V102-H104 PolarHBondContact O-N 3.37Å; V102-H104 VanDerWaalsContact O-N 3.12Å
105L53.5Low65Low153 Ų15396.4 Ų96.480%0.80154%0.543SS*.  trans-60137.4174.4-166.966.8000107.3S107L105-S107 PolarHBondContact O-N 2.92Å; L105-S107 VanDerWaalsContact O-N 3.1Å
106P50.3Low63Low93 Ų9398.5 Ų98.560%0.60456%0.564SS**  trans-50.9127.4167.1-19.730.9000106.5L108P106-L108 VanDerWaalsContact C-N 3.32Å; P106-L108 PolarHBondContact O-N 3.03Å
107S45.2Very low60.2Low104 Ų104107.4 Ų107.473%0.72760%0.603SS**  trans-52.8106.5169.951.20000106L105L105-S107 PolarHBondContact O-N 2.92Å; L105-S107 VanDerWaalsContact O-N 3.1Å
108L39.6Very low58.3Low144 Ų144112.9 Ų112.975%0.75463%0.632SS**  trans-49.9128175.5-170.773.7000105.8P106 K110P106-L108 VanDerWaalsContact C-N 3.32Å; P106-L108 PolarHBondContact O-N 3.03Å; L108-K110 PolarHBondContact O-N 3.15Å; L108-K110 VanDerWaalsContact O-N 3.08Å
109P40.7Very low55.8Low104 Ų104117.1 Ų117.168%0.67565%0.649SS**  trans-52.5127.4170.621.8-29.7000106.1A111P109-A111 PolarHBondContact O-N 3.29Å
110K41.8Very low53.7Low210 Ų210122 Ų12291%0.91368%0.681SS**  trans-5489.3174.2-80.4177.9174.5176.60108.1L108L108-K110 PolarHBondContact O-N 3.15Å; L108-K110 VanDerWaalsContact O-N 3.08Å
111A40.3Very low51.2Low80 Ų80130.2 Ų130.266%0.66172%0.719SS**  trans-95.4104.1163.600000104.2P109 S113P109-A111 PolarHBondContact O-N 3.29Å; A111-S113 VanDerWaalsContact C-N 3.32Å; A111-S113 PolarHBondContact O-N 3.44Å
112E46.4Very low48.9Very low193 Ų193131.4 Ų131.490%0.90274%0.736SS**  trans-61.799.2164.3-54.4-165.4161.900106.8
113S43.4Very low46.8Very low115 Ų115138.4 Ų138.480%0.80477%0.768SS**  trans-160125.2163.4-139.80000112.4A111A111-S113 VanDerWaalsContact C-N 3.32Å; A111-S113 PolarHBondContact O-N 3.44Å
114C44.8Very low45.1Very low136 Ų136135 Ų13592%0.91976%0.763SS**  trans-46.8146.6-173-55.20000117
115G36.6Very low43.9Very low79 Ų79137.9 Ų137.981%0.81479%0.79SS**  trans13793.9144.800000117
116S48.3Very low43.7Very low113 Ų113134.9 Ų134.979%0.7978%0.781SS**  trans-48.2137.7164.91550000115.2
117F34.1Very low43.9Very low187 Ų187140.2 Ų140.282%0.8280%0.795SS**  -171.2138.1110.7-145.4-107000109.8
118D51.6Low44.5Very low141 Ų141142.1 Ų142.175%0.75480%0.796SS**  trans-89.3118.6-179.6-163.60.8000107.8
119E39.6Very low45.5Very low173 Ų173140.7 Ų140.781%0.80880%0.798SS**  trans-150116.5149.3-82.4-152125.400109.3E121E119-E121 PolarHBondContact O-N 3.43Å
120T50Low46.6Very low122 Ų122143.1 Ų143.175%0.74880%0.8SS**  trans-31.8118.5155.836.80000112.4
121E43Very low47.6Very low171 Ų171141.2 Ų141.280%0.79980%0.795SS**  -171.989.6130-55.6-157.4163.500107.5E119 E123E119-E121 PolarHBondContact O-N 3.43Å; E121-E123 PolarHBondContact O-N 2.97Å; E121-E123 VanDerWaalsContact O-N 3.15Å
122S42.1Very low48.6Very low132 Ų132142 Ų14292%0.92379%0.793SS**  trans-90.173.4168.9-173.40000108.7
123E42.6Very low49.4Very low154 Ų154139.1 Ų139.172%0.7279%0.788SS**  trans-47.7140.7162.2-76.9-72.111000110.3E121 S125E121-E123 PolarHBondContact O-N 2.97Å; E121-E123 VanDerWaalsContact O-N 3.15Å; E123-S125 PolarHBondContact O-N 3.31Å
124E43.5Very low50.6Low172 Ų172140 Ų14080%0.80478%0.783SS**  trans-46.9116174.5-168.9168.5-166.500110.7S126E124-S126 PolarHBondContact O-N 2.92Å; E124-S126 PolarHBondContact O-OG 2.87Å
125S44.2Very low51.3Low120 Ų120140.6 Ų140.684%0.83978%0.777SS**  trans-69.872.7175.753.40000111.2E123 K127E123-S125 PolarHBondContact O-N 3.31Å; S125-K127 PolarHBondContact O-N 3.44Å; S125-K127 VanDerWaalsContact O-N 3.14Å
126S49.6Very low52.6Low89 Ų89143.5 Ų143.562%0.62277%0.767SS**  trans-66.7102.6156.744.50000106.9E124 L128E124-S126 PolarHBondContact O-N 2.92Å; E124-S126 PolarHBondContact O-OG 2.87Å; S126-L128 PolarHBondContact O-N 2.96Å
127K53.8Low53.2Low206 Ų206147 Ų14790%0.89678%0.775SS**  trans-57.598170.9-91.7177.7172.8174.90108.8S125 S129S125-K127 PolarHBondContact O-N 3.44Å; S125-K127 VanDerWaalsContact O-N 3.14Å; K127-S129 PolarHBondContact O-N 2.92Å
128L58.8Low54.6Low144 Ų144148.5 Ų148.575%0.75478%0.776SS**  trans-67.6126.9168.3-62.2177.4000108.4S126 H130S126-L128 PolarHBondContact O-N 2.96Å; L128-H130 PolarHBondContact O-N 2.91Å; L128-H130 VanDerWaalsContact O-N 3.15Å
129S60.9Low55.4Low114 Ų114146.2 Ų146.280%0.79776%0.764SS**  trans-75.48.3-176.772.90000114.8K127K127-S129 PolarHBondContact O-N 2.92Å
130H64Low56.7Low154 Ų154142 Ų14271%0.71375%0.752SS**SBendtrans-98.3139.3-173.7-60.1-70.2000111.2L128L128-H130 PolarHBondContact O-N 2.91Å; L128-H130 VanDerWaalsContact O-N 3.15Å
131Q61.8Low57.5Low171 Ų171145.9 Ų145.980%0.79975%0.754SS**PPolyproline II helixtrans-71.5130.8172.8-169.3173.2-2.900108.8V133Q131-V133 WeakPolarHBondContact O-CG2 3.43Å; Q131-V133 PolarHBondContact O-N 2.93Å
132P61.9Low58.7Low97 Ų97142.5 Ų142.563%0.6375%0.745SS**PPolyproline II helixtrans-65.8119.7177.125-31.1000109.4
133V63.1Low59.5Low131 Ų131143.4 Ų143.479%0.79474%0.738SS**  trans-93.5-12.9-175.2178.30000112.8Q131Q131-V133 WeakPolarHBondContact O-CG2 3.43Å; Q131-V133 PolarHBondContact O-N 2.93Å
134L69.1Low60.5Low133 Ų133141.4 Ų141.470%0.69674%0.739SS**  trans-145.8124.8171.2-99115.4000111.2F136L134-F136 HydrophobicContact CD2-CZ 4.21Å
135L58.8Low61.4Low150 Ų150137.7 Ų137.779%0.78574%0.738SS**  trans-117.9117.9169.4-82.2154.3000107.2
136F63.4Low62.3Low140 Ų140136.7 Ų136.761%0.61474%0.737SS**  trans-79127.1166-64.5-82.8000108L134 R138 P140L134-F136 HydrophobicContact CD2-CZ 4.21Å; F136-R138 WeakPolarHBondContact CB-O 3.37Å; F136-R138 PolarHBondContact O-N 2.87Å; F136-R138 VanDerWaalsContact O-N 3.16Å; F136-P140 HydrophobicContact CD2-CG 4.5Å
137L62.1Low62.8Low185 Ų185136.1 Ų136.197%0.96973%0.733SS**SBendtrans-63.8-14.5175.4-81.2147.9000112.7
138R62.7Low63.2Low219 Ų219134.5 Ų134.583%0.82673%0.734SS**SBendtrans-142.6151.8175.7-79.7-170.4168179.1-3.2110.3F136 P140F136-R138 WeakPolarHBondContact CB-O 3.37Å; F136-R138 PolarHBondContact O-N 2.87Å; F136-R138 VanDerWaalsContact O-N 3.16Å; R138-P140 WeakPolarHBondContact O-CD 3.27Å
139D69.1Low63.4Low94 Ų94135.6 Ų135.650%0.50373%0.733SS.*  trans-58.6119.5175-178.9-10.9000110.4Y141 V142D139-Y141 PolarHBondContact O-N 2.62Å; D139-Y141 WeakPolarHBondContact OD1-CB 3.17Å; D139-Y141 WeakPolarHBondContact OD1-CD2 3.47Å; D139-Y141 PolarHBondContact OD1-N 3.2Å; D139-V142 HydrophobicContact CB-CB 4.32Å; D139-V142 HydrophobicContact CB-CG2 3.63Å; D139-V142 PolarHBondContact O-N 2.74Å
140P66.4Low63.5Low85 Ų85134.5 Ų134.555%0.55272%0.723SS**THydrogen-bonded Turntrans-67.9-13-178.628.2-34.5000113.6F136 R138F136-P140 HydrophobicContact CD2-CG 4.5Å; R138-P140 WeakPolarHBondContact O-CD 3.27Å
141Y66.1Low63.8Low202 Ų202131.8 Ų131.879%0.79271%0.714SS**THydrogen-bonded Turntrans-97.4-7.3178.7-56.8-75.2000113.3D139 L143D139-Y141 PolarHBondContact O-N 2.62Å; D139-Y141 WeakPolarHBondContact OD1-CB 3.17Å; D139-Y141 WeakPolarHBondContact OD1-CD2 3.47Å; D139-Y141 PolarHBondContact OD1-N 3.2Å; Y141-L143 PolarHBondContact O-N 2.71Å; Y141-L143 VanDerWaalsContact O-N 3.11Å
142V68.3Low64.6Low101 Ų101128.4 Ų128.461%0.61270%0.704SS**SBendtrans-74.6104.6170.3176.10000108.1D139D139-V142 HydrophobicContact CB-CB 4.32Å; D139-V142 HydrophobicContact CB-CG2 3.63Å; D139-V142 PolarHBondContact O-N 2.74Å
143L59.3Low65.3Low150 Ų150129 Ų12979%0.78571%0.706SS**PPolyproline II helixtrans-57.9134.9172.2-65.3174.3000109.1Y141 A145Y141-L143 PolarHBondContact O-N 2.71Å; Y141-L143 VanDerWaalsContact O-N 3.11Å; L143-A145 PolarHBondContact O-N 3.03Å
144P62.8Low66.1Low112 Ų112127.3 Ų127.373%0.72769%0.691SS**PPolyproline II helixtrans-51.1138.7174.7-23.131.2000110.2A146P144-A146 PolarHBondContact O-N 3.18Å
145A63.8Low66.5Low95 Ų95125.8 Ų125.879%0.78568%0.681SS**SBendtrans-48.7130.7168.200000108.1L143 S147L143-A145 PolarHBondContact O-N 3.03Å; A145-S147 PolarHBondContact O-N 3.01Å
146A61.7Low67.6Low99 Ų99120.9 Ų120.982%0.81867%0.666SS**  trans-38.2108-170.100000110.2P144 D148P144-A146 PolarHBondContact O-N 3.18Å; A146-D148 PolarHBondContact O-N 3.49Å
147S60.2Low68.6Low77 Ų77118 Ų11854%0.53866%0.66SS.*  trans-66.7135.817856.60000108.4A145 F149A145-S147 PolarHBondContact O-N 3.01Å; S147-F149 PolarHBondContact O-N 2.93Å
148D62.5Low69.5Low171 Ų171113 Ų11391%0.91463%0.634SS**SBendtrans-63.67.8172-68.2-38.3000113.6A146A146-D148 PolarHBondContact O-N 3.49Å
149F62.9Low70.3Confident167 Ų167106.1 Ų106.173%0.73261%0.611SS**SBendtrans-86135.8174.7-62.6-67.1000110.1S147 N151S147-F149 PolarHBondContact O-N 2.93Å; F149-N151 PolarHBondContact O-N 3.49Å
150P62.6Low70.6Confident91 Ų91103.7 Ų103.759%0.59161%0.608SS**  trans-58.5134.5177.824.4-32.3000109.3V152P150-V152 HydrophobicContact CB-CG2 4.44Å; P150-V152 HydrophobicContact CG-CG2 4.23Å; P150-V152 WeakPolarHBondContact O-CG2 3.46Å; P150-V152 PolarHBondContact O-N 3.12Å
151N70.7Confident71.2Confident98 Ų98104.9 Ų104.952%0.52461%0.609SS.*  trans-78.472.1179-161.8-21.8000109.3F149 V153 I154 E155F149-N151 PolarHBondContact O-N 3.49Å; N151-V153 PolarHBondContact O-N 3.26Å; N151-I154 HydrophobicContact CB-CB 4.29Å; N151-I154 VanDerWaalsContact ND2-CD1 3.25Å; N151-I154 WeakPolarHBondContact ND2-CD1 3.33Å; N151-I154 PolarHBondContact O-N 2.87Å; N151-E155 PolarHBondContact O-N 3.35Å
152V79.1Confident71.6Confident99 Ų99101.5 Ų101.560%0.660%0.598SS**Hα-helixtrans-54-29.4-173.7177.10000111.9P150 G156P150-V152 HydrophobicContact CB-CG2 4.44Å; P150-V152 HydrophobicContact CG-CG2 4.23Å; P150-V152 WeakPolarHBondContact O-CG2 3.46Å; P150-V152 PolarHBondContact O-N 3.12Å; V152-G156 PolarHBondContact O-N 2.79Å
153V77.7Confident71.8Confident110 Ų110102.2 Ų102.267%0.66759%0.591SS**Hα-helixtrans-68.9-48.2176.2-177.30000110.9N151 V157N151-V153 PolarHBondContact O-N 3.26Å; V153-V157 VanDerWaalsContact O-CG2 3.23Å; V153-V157 WeakPolarHBondContact O-CG2 3.5Å; V153-V157 PolarHBondContact O-N 3.49Å
154I78.1Confident72.1Confident95 Ų9599.1 Ų99.149%0.48758%0.58SS.*Hα-helixtrans-67.1-42.6177.4-65.3-169.6000110.6N151 G156 V157 L158N151-I154 HydrophobicContact CB-CB 4.29Å; N151-I154 VanDerWaalsContact ND2-CD1 3.25Å; N151-I154 WeakPolarHBondContact ND2-CD1 3.33Å; N151-I154 PolarHBondContact O-N 2.87Å; I154-G156 PolarHBondContact O-N 3.46Å; I154-V157 PolarHBondContact O-N 2.96Å; I154-L158 HydrophobicContact CG2-CD1 3.99Å; I154-L158 HydrophobicContact CG2-CG 4.37Å; I154-L158 WeakPolarHBondContact O-CG 3.46Å; I154-L158 PolarHBondContact O-N 2.96Å
155E79.3Confident72.3Confident102 Ų102100.4 Ų100.448%0.47758%0.576SS.*Hα-helixtrans-61.1-45.5177.6-166.6-176.2-176.200111.5N151 V157 L158 H159N151-E155 PolarHBondContact O-N 3.35Å; E155-V157 PolarHBondContact O-N 2.93Å; E155-L158 PolarHBondContact O-N 3.22Å; E155-H159 WeakPolarHBondContact O-CB 3.45Å; E155-H159 PolarHBondContact O-CD2 3.39Å; E155-H159 PolarHBondContact O-N 3.24Å
156G79.9Confident72.3Confident46 Ų46100.9 Ų100.947%0.47456%0.564SS.*Hα-helixtrans-62.7-39176.800000113.2V152 I154 H159 G160V152-G156 PolarHBondContact O-N 2.79Å; I154-G156 PolarHBondContact O-N 3.46Å; G156-H159 PolarHBondContact O-N 3.25Å; G156-G160 PolarHBondContact O-N 2.78Å
157V84.9Confident72.2Confident79 Ų79102.4 Ų102.448%0.47955%0.554SS.*Hα-helixtrans-67.7-43.8175.8171.60000111.1V153 I154 E155 H159 G160 I161V153-V157 VanDerWaalsContact O-CG2 3.23Å; V153-V157 WeakPolarHBondContact O-CG2 3.5Å; V153-V157 PolarHBondContact O-N 3.49Å; I154-V157 PolarHBondContact O-N 2.96Å; E155-V157 PolarHBondContact O-N 2.93Å; V157-H159 VanDerWaalsContact C-N 3.33Å; V157-H159 PolarHBondContact O-N 3.08Å; V157-G160 PolarHBondContact O-N 3.34Å; V157-I161 HydrophobicContact CG1-CD1 3.55Å; V157-I161 HydrophobicContact CG1-CG1 4.35Å; V157-I161 WeakPolarHBondContact O-CB 3.4Å; V157-I161 VanDerWaalsContact O-CG1 3.28Å; V157-I161 WeakPolarHBondContact O-CG1 3.38Å; V157-I161 PolarHBondContact O-N 3.09Å
158L81.4Confident72.3Confident81 Ų81104.5 Ų104.542%0.42457%0.566SS.*Hα-helixtrans-63-40.5176-71.7173.7000111.7I154 E155 I161 F162I154-L158 HydrophobicContact CG2-CD1 3.99Å; I154-L158 HydrophobicContact CG2-CG 4.37Å; I154-L158 WeakPolarHBondContact O-CG 3.46Å; I154-L158 PolarHBondContact O-N 2.96Å; E155-L158 PolarHBondContact O-N 3.22Å; L158-I161 PolarHBondContact O-N 3.13Å; L158-F162 HydrophobicContact CD2-CD2 3.78Å; L158-F162 HydrophobicContact CD2-CE2 3.75Å; L158-F162 WeakPolarHBondContact O-CB 3.4Å; L158-F162 PolarHBondContact O-N 2.74Å
159H79.3Confident71.9Confident75 Ų75111.8 Ų111.835%0.34758%0.581SS.*Hα-helixtrans-61.9-46.2174-88.4-129.3000112.3E155 G156 V157 I161 Y163E155-H159 WeakPolarHBondContact O-CB 3.45Å; E155-H159 PolarHBondContact O-CD2 3.39Å; E155-H159 PolarHBondContact O-N 3.24Å; G156-H159 PolarHBondContact O-N 3.25Å; V157-H159 VanDerWaalsContact C-N 3.33Å; V157-H159 PolarHBondContact O-N 3.08Å; H159-I161 PolarHBondContact O-N 2.91Å; H159-Y163 CarbonylContact O-C 3.12Å; H159-Y163 VanDerWaalsContact O-CA 3.28Å; H159-Y163 WeakPolarHBondContact O-CA 3.37Å; H159-Y163 PolarHBondContact O-N 3.23Å
160G75.6Confident72.3Confident43 Ų43109 Ų10944%0.44357%0.573SS.*Hα-helixtrans-65.8-34.6179.400000113.9G156 V157G156-G160 PolarHBondContact O-N 2.78Å; V157-G160 PolarHBondContact O-N 3.34Å
161I78.1Confident72.8Confident110 Ų110109.9 Ų109.956%0.56457%0.572SS**Hα-helixtrans-86.2-42.9-177.1-63.7173.7000111.7V157 L158 H159V157-I161 HydrophobicContact CG1-CD1 3.55Å; V157-I161 HydrophobicContact CG1-CG1 4.35Å; V157-I161 WeakPolarHBondContact O-CB 3.4Å; V157-I161 VanDerWaalsContact O-CG1 3.28Å; V157-I161 WeakPolarHBondContact O-CG1 3.38Å; V157-I161 PolarHBondContact O-N 3.09Å; L158-I161 PolarHBondContact O-N 3.13Å; H159-I161 PolarHBondContact O-N 2.91Å
162F76.1Confident73Confident131 Ų131110.6 Ų110.658%0.57558%0.575SS**Hα-helixtrans-109.7-17.9-168.6-62.1-76.7000114.1L158L158-F162 HydrophobicContact CD2-CD2 3.78Å; L158-F162 HydrophobicContact CD2-CE2 3.75Å; L158-F162 WeakPolarHBondContact O-CB 3.4Å; L158-F162 PolarHBondContact O-N 2.74Å
163Y72.9Confident72.6Confident115 Ų115111.3 Ų111.345%0.45157%0.573SS.*  trans-127.351-178.6-55-84.1000113.9H159 H165 L166H159-Y163 CarbonylContact O-C 3.12Å; H159-Y163 VanDerWaalsContact O-CA 3.28Å; H159-Y163 WeakPolarHBondContact O-CA 3.37Å; H159-Y163 PolarHBondContact O-N 3.23Å; Y163-H165 PolarHBondContact O-N 2.81Å; Y163-L166 HydrophobicContact CD1-CD1 4.15Å; Y163-L166 HydrophobicContact CG-CD1 4.15Å; Y163-L166 PolarHBondContact O-N 3Å; Y163-L166 VanDerWaalsContact O-N 3.11Å
164P64.6Low72.3Confident85 Ų85111.4 Ų111.455%0.55257%0.568SS**G310 helixtrans-63.8-14.6-175.427.2-35.9000114
165H68.1Low71.9Confident140 Ų140112.5 Ų112.565%0.64857%0.573SS**G310 helixtrans-87-5.8-179.448.1-86.4000113.9Y163Y163-H165 PolarHBondContact O-N 2.81Å
166L63.2Low71.4Confident104 Ų104113.2 Ų113.255%0.54558%0.58SS.*G310 helixtrans-91.73.3177.6-66.2177.5000113.7Y163Y163-L166 HydrophobicContact CD1-CD1 4.15Å; Y163-L166 HydrophobicContact CG-CD1 4.15Å; Y163-L166 PolarHBondContact O-N 3Å; Y163-L166 VanDerWaalsContact O-N 3.11Å
167H59.3Low70.7Confident132 Ų132118.4 Ų118.461%0.61159%0.588SS**SBendtrans-73.1124.9173.5-82.6-96.5000110.6
168P62.9Low69.5Low121 Ų121121.7 Ų121.779%0.78660%0.597SS**  trans-64.2138.2169.8-1.514000109.3
169R53Low68.5Low323 Ų323125.4 Ų125.4100%1.21961%0.613SS**  trans-66.10169.2-86.7-174.5179166.9-0.1111.7

Retrieved 169 of 169 residues in 124.7 ms (Link to these results)

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