TM115_HUMAN Loading...

Transmembrane protein 115

May play a role in retrograde transport of proteins from the Golgi to the endoplasmic reticulum. May indirectly play a role in protein glycosylation in the Golgi.

AlphaFold DB , UniProt , Accession Q12893, Species HUMAN (Homo sapiens, Human), Gene TMEM115, Length 351 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
1M50.1Low67.1Low224 Ų224127.7 Ų127.7100%1.10363%0.634SS**  0-32.70-75.5178.8157.200114.5R3M1-R3 PolarHBondContact O-N 3.29Å
2Q55.4Low67.8Low182 Ų182126.5 Ų126.585%0.8563%0.63SS**THydrogen-bonded Turntrans-66.6-27-177.3-74.4172.2-22.100116.1P6Q2-P6 WeakPolarHBondContact O-CD 3.42Å
3R58.8Low68.6Low241 Ų241120 Ų12091%0.90962%0.615SS**THydrogen-bonded Turntrans-76.4-23.9179.8-68.8-177.3-177.6165.90.4114.8M1 P6M1-R3 PolarHBondContact O-N 3.29Å; R3-P6 WeakPolarHBondContact O-CD 3.03Å; R3-P6 WeakPolarHBondContact O-CG 3.39Å
4A62.6Low69.5Low72 Ų72115.6 Ų115.660%0.59561%0.606SS**Hα-helixtrans-81.6-27.4-179.700000112.8G7 A8A4-G7 PolarHBondContact O-N 3.45Å; A4-A8 PolarHBondContact O-N 3.28Å
5L62.7Low70.1Confident94 Ų94110.4 Ų110.449%0.49258%0.578SS.*Hα-helixtrans-60.3-46.5-179.4-141.287.1000114.2A8 R9L5-A8 PolarHBondContact O-N 3.11Å; L5-R9 WeakPolarHBondContact O-CG 3.48Å; L5-R9 PolarHBondContact O-N 3.4Å
6P70.1Confident70.7Confident64 Ų64108.7 Ų108.742%0.41657%0.569SS.*Hα-helixtrans-64.7-40.2178.822.2-31.9000111.9Q2 R3 R9 Q10Q2-P6 WeakPolarHBondContact O-CD 3.42Å; R3-P6 WeakPolarHBondContact O-CD 3.03Å; R3-P6 WeakPolarHBondContact O-CG 3.39Å; P6-R9 PolarHBondContact O-N 3.02Å; P6-Q10 WeakPolarHBondContact O-CB 3.18Å; P6-Q10 WeakPolarHBondContact O-CG 3.47Å; P6-Q10 PolarHBondContact O-N 2.98Å
7G73.7Confident71.3Confident23 Ų23106.4 Ų106.424%0.23757%0.569CS.*Hα-helixtrans-61.4-48175.600000111.9A4 R9 Q10 H11A4-G7 PolarHBondContact O-N 3.45Å; G7-R9 VanDerWaalsContact C-N 3.34Å; G7-R9 PolarHBondContact O-N 3.13Å; G7-Q10 PolarHBondContact O-N 2.93Å; G7-H11 PolarHBondContact O-CD2 2.76Å; G7-H11 PolarHBondContact O-N 3.45Å
8A71.5Confident72.1Confident49 Ų49105.5 Ų105.541%0.40557%0.573SS.*Hα-helixtrans-60.2-41.5177.600000112.7A4 L5 H11 L12A4-A8 PolarHBondContact O-N 3.28Å; L5-A8 PolarHBondContact O-N 3.11Å; A8-H11 PolarHBondContact O-N 3.09Å; A8-L12 WeakPolarHBondContact O-CB 3.45Å; A8-L12 VanDerWaalsContact O-CG 3.31Å; A8-L12 WeakPolarHBondContact O-CG 3.33Å; A8-L12 PolarHBondContact O-N 3.38Å
9R75.9Confident72.9Confident179 Ų179101.1 Ų101.168%0.67555%0.552SS**Hα-helixtrans-64.8-41.8175.8-73.6178.1177.1-176.9-1.4112.3L5 P6 G7 L12 G13L5-R9 WeakPolarHBondContact O-CG 3.48Å; L5-R9 PolarHBondContact O-N 3.4Å; P6-R9 PolarHBondContact O-N 3.02Å; G7-R9 VanDerWaalsContact C-N 3.34Å; G7-R9 PolarHBondContact O-N 3.13Å; R9-L12 PolarHBondContact O-N 2.98Å; R9-G13 PolarHBondContact O-N 3.15Å
10Q78.5Confident73.8Confident145 Ų14597.3 Ų97.368%0.67853%0.533SS*.Hα-helixtrans-64.7-43.2175.9-74.4174.3-11.700111.5P6 G7 G13 A14P6-Q10 WeakPolarHBondContact O-CB 3.18Å; P6-Q10 WeakPolarHBondContact O-CG 3.47Å; P6-Q10 PolarHBondContact O-N 2.98Å; G7-Q10 PolarHBondContact O-N 2.93Å; Q10-G13 PolarHBondContact O-N 3.02Å; Q10-A14 VanDerWaalsContact O-CB 3.32Å; Q10-A14 WeakPolarHBondContact O-CB 3.39Å; Q10-A14 PolarHBondContact O-N 3.04Å
11H79Confident74.7Confident132 Ų13298.5 Ų98.561%0.61154%0.543SS*.Hα-helixtrans-61.6-50174.5-71.8-60.4000111.2G7 A8 G13 A14 I15G7-H11 PolarHBondContact O-CD2 2.76Å; G7-H11 PolarHBondContact O-N 3.45Å; A8-H11 PolarHBondContact O-N 3.09Å; H11-G13 PolarHBondContact O-N 3.03Å; H11-A14 PolarHBondContact O-N 3.24Å; H11-I15 WeakPolarHBondContact O-CB 3.26Å; H11-I15 VanDerWaalsContact O-CD1 3.3Å; H11-I15 WeakPolarHBondContact O-CD1 2.99Å; H11-I15 WeakPolarHBondContact O-CG1 3.38Å; H11-I15 PolarHBondContact O-N 3.25Å
12L75.7Confident76.8Confident113 Ų11389.2 Ų89.259%0.59250%0.499SS*.Hα-helixtrans-61.7-40.6177.8-72.8171000112.8A8 R9 I15 L16A8-L12 WeakPolarHBondContact O-CB 3.45Å; A8-L12 VanDerWaalsContact O-CG 3.31Å; A8-L12 WeakPolarHBondContact O-CG 3.33Å; A8-L12 PolarHBondContact O-N 3.38Å; R9-L12 PolarHBondContact O-N 2.98Å; L12-I15 HydrophobicContact CD2-CD1 4.13Å; L12-I15 WeakPolarHBondContact O-CB 3.37Å; L12-I15 PolarHBondContact O-N 2.83Å; L12-L16 PolarHBondContact O-N 3.28Å
13G77.7Confident78.7Confident42 Ų4280.6 Ų80.643%0.43346%0.459SS..Hα-helixtrans-62.6-45.417500000112.1R9 Q10 H11 I15 L16 A17R9-G13 PolarHBondContact O-N 3.15Å; Q10-G13 PolarHBondContact O-N 3.02Å; H11-G13 PolarHBondContact O-N 3.03Å; G13-I15 VanDerWaalsContact C-N 3.32Å; G13-I15 PolarHBondContact O-N 3.12Å; G13-L16 PolarHBondContact O-N 2.61Å; G13-A17 VanDerWaalsContact O-CB 3.24Å; G13-A17 WeakPolarHBondContact O-CB 3.32Å; G13-A17 PolarHBondContact O-N 2.96Å
14A80.8Confident80.4Confident59 Ų5973 Ų7349%0.48843%0.433SS..Hα-helixtrans-64.5-38.117500000111.9Q10 H11 A17 S18Q10-A14 VanDerWaalsContact O-CB 3.32Å; Q10-A14 WeakPolarHBondContact O-CB 3.39Å; Q10-A14 PolarHBondContact O-N 3.04Å; H11-A14 PolarHBondContact O-N 3.24Å; A14-A17 PolarHBondContact O-N 3.17Å; A14-S18 PolarHBondContact O-N 3.17Å; A14-S18 PolarHBondContact O-OG 3.31Å; A14-S18 VanDerWaalsContact O-OG 3.14Å
15I79.7Confident81.9Confident37 Ų3772.3 Ų72.319%0.1943%0.427CS..Hα-helixtrans-59.2-48.7175.6-69.6161.1000110.8H11 L12 G13 S18 A19 V83 R87H11-I15 WeakPolarHBondContact O-CB 3.26Å; H11-I15 VanDerWaalsContact O-CD1 3.3Å; H11-I15 WeakPolarHBondContact O-CD1 2.99Å; H11-I15 WeakPolarHBondContact O-CG1 3.38Å; H11-I15 PolarHBondContact O-N 3.25Å; L12-I15 HydrophobicContact CD2-CD1 4.13Å; L12-I15 WeakPolarHBondContact O-CB 3.37Å; L12-I15 PolarHBondContact O-N 2.83Å; G13-I15 VanDerWaalsContact C-N 3.32Å; G13-I15 PolarHBondContact O-N 3.12Å; I15-S18 PolarHBondContact O-OG 3.13Å; I15-A19 PolarHBondContact O-N 2.93Å; I15-V83 HydrophobicContact CG2-CG1 3.69Å; I15-R87 VanDerWaalsContact CA-NH2 3.29Å; I15-R87 VanDerWaalsContact CG2-NE 3.28Å
16L78.9Confident83.5Confident83 Ų8368.6 Ų68.644%0.43541%0.408SS..Hα-helixtrans-72.7-35.2-180-174.662.3000111.6L12 G13 S18 A19 K24L12-L16 PolarHBondContact O-N 3.28Å; G13-L16 PolarHBondContact O-N 2.61Å; L16-S18 PolarHBondContact O-N 3.09Å; L16-A19 VanDerWaalsContact O-CB 3.31Å; L16-A19 WeakPolarHBondContact O-CB 3.32Å; L16-A19 PolarHBondContact O-N 2.97Å; L16-K24 HydrophobicContact CD1-CG 4.23Å; L16-K24 WeakPolarHBondContact O-CE 3.45Å
17A80.8Confident84.7Confident69 Ų6965.9 Ų65.957%0.5739%0.39SS*.Hα-helixtrans-62.9-42.6178.500000111.7G13 A14 A19 K24G13-A17 VanDerWaalsContact O-CB 3.24Å; G13-A17 WeakPolarHBondContact O-CB 3.32Å; G13-A17 PolarHBondContact O-N 2.96Å; A14-A17 PolarHBondContact O-N 3.17Å; A17-A19 VanDerWaalsContact C-N 3.3Å; A17-A19 PolarHBondContact O-N 2.96Å; A17-K24 PolarHBondContact O-NZ 3.49Å
18S85.5Confident85.7Confident91 Ų9167.4 Ų67.464%0.63640%0.4SS*.THydrogen-bonded Turntrans-80.7-6.2176.466.40000114.4A14 I15 L16A14-S18 PolarHBondContact O-N 3.17Å; A14-S18 PolarHBondContact O-OG 3.31Å; A14-S18 VanDerWaalsContact O-OG 3.14Å; I15-S18 PolarHBondContact O-OG 3.13Å; L16-S18 PolarHBondContact O-N 3.09Å
19A87.6Confident86.9Confident21 Ų2166.5 Ų66.517%0.17439%0.393CS..SBendtrans-67.3151.4177.100000111.7I15 L16 A17 V23 K24I15-A19 PolarHBondContact O-N 2.93Å; L16-A19 VanDerWaalsContact O-CB 3.31Å; L16-A19 WeakPolarHBondContact O-CB 3.32Å; L16-A19 PolarHBondContact O-N 2.97Å; A17-A19 VanDerWaalsContact C-N 3.3Å; A17-A19 PolarHBondContact O-N 2.96Å; A19-V23 HydrophobicContact CB-CB 4.2Å; A19-V23 HydrophobicContact CB-CG1 3.92Å; A19-K24 HydrophobicContact CB-CG 4.36Å; A19-K24 WeakPolarHBondContact O-CE 3.33Å; A19-K24 PolarHBondContact O-NZ 3.38Å
20S91.4Very high87.8Confident25 Ų2558 Ų5818%0.17536%0.361CS..  trans-67164.9177.372.30000113V22 V23 K24 E90S20-V22 PolarHBondContact O-N 2.96Å; S20-V23 PolarHBondContact O-N 3.17Å; S20-V23 VanDerWaalsContact OG-CG2 3.27Å; S20-V23 WeakPolarHBondContact OG-CG2 3.17Å; S20-V23 PolarHBondContact OG-N 3.4Å; S20-K24 WeakPolarHBondContact O-CB 3.42Å; S20-K24 WeakPolarHBondContact O-CG 3.3Å; S20-K24 PolarHBondContact O-N 2.88Å; S20-E90 WeakPolarHBondContact CB-OE1 3.32Å; S20-E90 WeakPolarHBondContact CB-OE2 3.44Å; S20-E90 PolarHBondContact OG-OE1 2.83Å; S20-E90 VanDerWaalsContact OG-OE1 3.11Å; S20-E90 PolarHBondContact OG-OE2 3.35Å
21V93.2Very high88.6Confident123 Ų12354.7 Ų54.775%0.74535%0.347SS*.Hα-helixtrans-60-37.8175.7-178.40000111K24 A25V21-K24 PolarHBondContact O-N 3.31Å; V21-A25 VanDerWaalsContact O-CB 3.24Å; V21-A25 WeakPolarHBondContact O-CB 3.32Å; V21-A25 PolarHBondContact O-N 3.47Å
22V93.5Very high89.4Confident29 Ų2954.6 Ų54.618%0.17635%0.345CS..Hα-helixtrans-64.5-49179.4176.30000110.8S20 K24 A25 L26 A95 L99S20-V22 PolarHBondContact O-N 2.96Å; V22-K24 PolarHBondContact O-N 3.35Å; V22-A25 PolarHBondContact O-N 2.84Å; V22-L26 HydrophobicContact CG1-CD1 4.02Å; V22-L26 HydrophobicContact CG1-CG 4.43Å; V22-L26 WeakPolarHBondContact O-CG 3.25Å; V22-L26 PolarHBondContact O-N 2.9Å; V22-A95 HydrophobicContact CG2-CB 3.96Å; V22-L99 HydrophobicContact CG1-CB 4.21Å; V22-L99 HydrophobicContact CG1-CD1 4.16Å
23V94.5Very high90.3Very high2 Ų250.1 Ų50.11%0.01232%0.322CS..Hα-helixtrans-62.4-44.4179173.70000110.6A19 S20 A25 L26 C27 V82 E90A19-V23 HydrophobicContact CB-CB 4.2Å; A19-V23 HydrophobicContact CB-CG1 3.92Å; S20-V23 PolarHBondContact O-N 3.17Å; S20-V23 VanDerWaalsContact OG-CG2 3.27Å; S20-V23 WeakPolarHBondContact OG-CG2 3.17Å; S20-V23 PolarHBondContact OG-N 3.4Å; V23-A25 PolarHBondContact O-N 3.28Å; V23-L26 PolarHBondContact O-N 2.71Å; V23-C27 WeakPolarHBondContact O-CB 3.15Å; V23-C27 PolarHBondContact O-N 3.19Å; V23-C27 PolarHBondContact O-SG 3.2Å; V23-V82 HydrophobicContact CG1-CG1 4.12Å; V23-E90 WeakPolarHBondContact CG2-OE2 3.33Å
24K94.7Very high91.1Very high81 Ų8149.7 Ų49.735%0.35231%0.307SS..Hα-helixtrans-59.7-44.9175.3-74.1167.8176.7157.70111.7L16 A17 A19 S20 V21 V22 C27 A28L16-K24 HydrophobicContact CD1-CG 4.23Å; L16-K24 WeakPolarHBondContact O-CE 3.45Å; A17-K24 PolarHBondContact O-NZ 3.49Å; A19-K24 HydrophobicContact CB-CG 4.36Å; A19-K24 WeakPolarHBondContact O-CE 3.33Å; A19-K24 PolarHBondContact O-NZ 3.38Å; S20-K24 WeakPolarHBondContact O-CB 3.42Å; S20-K24 WeakPolarHBondContact O-CG 3.3Å; S20-K24 PolarHBondContact O-N 2.88Å; V21-K24 PolarHBondContact O-N 3.31Å; V22-K24 PolarHBondContact O-N 3.35Å; K24-C27 PolarHBondContact O-N 3.21Å; K24-A28 VanDerWaalsContact O-CB 3.22Å; K24-A28 WeakPolarHBondContact O-CB 3.4Å; K24-A28 PolarHBondContact O-N 3.05Å
25A95.5Very high91.7Very high57 Ų5752.4 Ų52.447%0.47131%0.313SS..Hα-helixtrans-64.6-43.8179.200000112.1V21 V22 V23 A28 A29V21-A25 VanDerWaalsContact O-CB 3.24Å; V21-A25 WeakPolarHBondContact O-CB 3.32Å; V21-A25 PolarHBondContact O-N 3.47Å; V22-A25 PolarHBondContact O-N 2.84Å; V23-A25 PolarHBondContact O-N 3.28Å; A25-A28 PolarHBondContact O-N 2.96Å; A25-A29 VanDerWaalsContact O-CB 3.3Å; A25-A29 WeakPolarHBondContact O-CB 3.38Å; A25-A29 PolarHBondContact O-N 3.24Å
26L95.5Very high92.3Very high17 Ų1753.2 Ų53.29%0.08932%0.318CS..Hα-helixtrans-64.4-46.3176.8-69173.8000111.6V22 V23 A28 A29 V30 L67 V82 F102V22-L26 HydrophobicContact CG1-CD1 4.02Å; V22-L26 HydrophobicContact CG1-CG 4.43Å; V22-L26 WeakPolarHBondContact O-CG 3.25Å; V22-L26 PolarHBondContact O-N 2.9Å; V23-L26 PolarHBondContact O-N 2.71Å; L26-A28 PolarHBondContact O-N 3.23Å; L26-A29 PolarHBondContact O-N 3.45Å; L26-V30 WeakPolarHBondContact O-CG2 3.43Å; L26-V30 PolarHBondContact O-N 3.22Å; L26-L67 HydrophobicContact CD2-CD2 3.97Å; L26-V82 HydrophobicContact CB-CG1 3.78Å; L26-V82 HydrophobicContact CD1-CG1 4.21Å; L26-F102 HydrophobicContact CD1-CD2 4.28Å; L26-F102 HydrophobicContact CD1-CG 4.39Å; L26-F102 HydrophobicContact CD2-CD1 4.04Å; L26-F102 HydrophobicContact CD2-CE1 3.72Å; L26-F102 HydrophobicContact CD2-CE2 4.23Å; L26-F102 HydrophobicContact CD2-CG 4.44Å; L26-F102 HydrophobicContact CD2-CZ 3.84Å
27C95.2Very high92.9Very high6 Ų651 Ų514%0.04131%0.309CS..Hα-helixtrans-61.1-43.7175.7-70.40000112V23 K24 A29 V30 L31 L79V23-C27 WeakPolarHBondContact O-CB 3.15Å; V23-C27 PolarHBondContact O-N 3.19Å; V23-C27 PolarHBondContact O-SG 3.2Å; K24-C27 PolarHBondContact O-N 3.21Å; C27-A29 VanDerWaalsContact C-N 3.34Å; C27-V30 PolarHBondContact O-N 3.08Å; C27-L31 WeakPolarHBondContact O-CG 3.4Å; C27-L31 PolarHBondContact O-N 3.49Å; C27-L79 HydrophobicContact CB-CD2 3.74Å
28A95.7Very high93.4Very high56 Ų5654.8 Ų54.846%0.46331%0.313SS..Hα-helixtrans-63.8-39.8176.400000111.6K24 A25 L26 L31 F32K24-A28 VanDerWaalsContact O-CB 3.22Å; K24-A28 WeakPolarHBondContact O-CB 3.4Å; K24-A28 PolarHBondContact O-N 3.05Å; A25-A28 PolarHBondContact O-N 2.96Å; L26-A28 PolarHBondContact O-N 3.23Å; A28-L31 PolarHBondContact O-N 3.03Å; A28-F32 WeakPolarHBondContact O-CB 3.28Å; A28-F32 PolarHBondContact O-N 3.35Å
29A95.7Very high93.6Very high29 Ų2954.4 Ų54.424%0.2432%0.315CS..Hα-helixtrans-64.1-44.6176.900000112.1A25 L26 C27 F32 L33 L67A25-A29 VanDerWaalsContact O-CB 3.3Å; A25-A29 WeakPolarHBondContact O-CB 3.38Å; A25-A29 PolarHBondContact O-N 3.24Å; L26-A29 PolarHBondContact O-N 3.45Å; C27-A29 VanDerWaalsContact C-N 3.34Å; A29-F32 PolarHBondContact O-N 3.05Å; A29-L33 WeakPolarHBondContact O-CB 3.46Å; A29-L33 VanDerWaalsContact O-CG 3.32Å; A29-L33 WeakPolarHBondContact O-CG 3.19Å; A29-L33 PolarHBondContact O-N 2.88Å; A29-L67 HydrophobicContact CB-CD1 4.15Å; A29-L67 HydrophobicContact CB-CD2 4.37Å
30V95.6Very high93.6Very high1 Ų157.5 Ų57.51%0.00633%0.332CS..Hα-helixtrans-59.6-48.5175.4171.50000111L26 C27 F32 L33 Y34 L67 E69 V75 S78L26-V30 WeakPolarHBondContact O-CG2 3.43Å; L26-V30 PolarHBondContact O-N 3.22Å; C27-V30 PolarHBondContact O-N 3.08Å; V30-F32 PolarHBondContact O-N 3.11Å; V30-L33 PolarHBondContact O-N 3.34Å; V30-Y34 VanDerWaalsContact O-CB 3.28Å; V30-Y34 WeakPolarHBondContact O-CB 3.31Å; V30-Y34 PolarHBondContact O-N 3.15Å; V30-L67 HydrophobicContact CG2-CD2 3.89Å; V30-E69 HydrophobicContact CG1-CG 4.24Å; V30-V75 HydrophobicContact CG1-CG1 4.4Å; V30-S78 WeakPolarHBondContact CG1-OG 3.34Å
31L95.5Very high93.4Very high76 Ų7662.8 Ų62.840%0.39836%0.358SS..Hα-helixtrans-63.5-42.6178.5-72.6173.3000112C27 A28 Y34 L35 V75 L79C27-L31 WeakPolarHBondContact O-CG 3.4Å; C27-L31 PolarHBondContact O-N 3.49Å; A28-L31 PolarHBondContact O-N 3.03Å; L31-Y34 PolarHBondContact O-N 3.16Å; L31-L35 VanDerWaalsContact O-CG 3.28Å; L31-L35 WeakPolarHBondContact O-CG 3.47Å; L31-L35 PolarHBondContact O-N 2.99Å; L31-V75 HydrophobicContact CD2-CG1 4.01Å; L31-L79 HydrophobicContact CD1-CD2 4.43Å; L31-L79 HydrophobicContact CD2-CD1 3.93Å; L31-L79 HydrophobicContact CG-CD1 4.39Å; L31-L79 HydrophobicContact CG-CD2 4.4Å
32F95.5Very high93Very high130 Ų13057.3 Ų57.357%0.5733%0.325SS*.Hα-helixtrans-63.5-47.4178.7175.4-102.4000111.7A28 A29 V30 Y34 L35 L36A28-F32 WeakPolarHBondContact O-CB 3.28Å; A28-F32 PolarHBondContact O-N 3.35Å; A29-F32 PolarHBondContact O-N 3.05Å; V30-F32 PolarHBondContact O-N 3.11Å; F32-Y34 VanDerWaalsContact C-N 3.33Å; F32-Y34 PolarHBondContact O-N 2.85Å; F32-L35 PolarHBondContact O-N 3.32Å; F32-L36 HydrophobicContact CE1-CD2 4.33Å; F32-L36 WeakPolarHBondContact O-CB 3.45Å; F32-L36 PolarHBondContact O-N 2.95Å
33L94.2Very high92.6Very high19 Ų1956.7 Ų56.710%0.09932%0.324CS..Hα-helixtrans-67.1-34.7178.7-70.5-178000112.4A29 V30 L36 S37 L45 L67 M68A29-L33 WeakPolarHBondContact O-CB 3.46Å; A29-L33 VanDerWaalsContact O-CG 3.32Å; A29-L33 WeakPolarHBondContact O-CG 3.19Å; A29-L33 PolarHBondContact O-N 2.88Å; V30-L33 PolarHBondContact O-N 3.34Å; L33-L36 HydrophobicContact CD2-CD2 4.2Å; L33-L36 PolarHBondContact O-N 3.24Å; L33-S37 PolarHBondContact O-N 2.9Å; L33-L45 HydrophobicContact CD2-CD1 3.64Å; L33-L67 HydrophobicContact CD1-CB 3.64Å; L33-M68 HydrophobicContact CB-SD 3.94Å
34Y94.4Very high92.3Very high32 Ų3259.2 Ų59.213%0.12534%0.341CS..Hα-helixtrans-63-46.8171.8178.2-114.2000112.1V30 L31 F32 L36 S37 F38 E69 V72 V75V30-Y34 VanDerWaalsContact O-CB 3.28Å; V30-Y34 WeakPolarHBondContact O-CB 3.31Å; V30-Y34 PolarHBondContact O-N 3.15Å; L31-Y34 PolarHBondContact O-N 3.16Å; F32-Y34 VanDerWaalsContact C-N 3.33Å; F32-Y34 PolarHBondContact O-N 2.85Å; Y34-L36 VanDerWaalsContact C-N 3.32Å; Y34-L36 PolarHBondContact O-N 3.25Å; Y34-S37 WeakPolarHBondContact O-CB 3.43Å; Y34-S37 PolarHBondContact O-N 3.08Å; Y34-S37 VanDerWaalsContact O-N 3.17Å; Y34-F38 HydrophobicContact CD1-CE2 4.24Å; Y34-F38 AromaticContact CE1-CE2 3.67Å; Y34-F38 HydrophobicContact CE1-CE2 3.67Å; Y34-F38 HydrophobicContact CE1-CZ 4.25Å; Y34-F38 AromaticContact CE2-CE2 3.98Å; Y34-F38 HydrophobicContact CE2-CE2 3.98Å; Y34-F38 HydrophobicContact CE2-CZ 4.21Å; Y34-F38 AromaticContact CZ-CE2 3.5Å; Y34-F38 AromaticContact CZ-CZ 3.7Å; Y34-F38 WeakPolarHBondContact O-CD2 3.21Å; Y34-F38 VanDerWaalsContact OH-CZ 3.3Å; Y34-F38 WeakPolarHBondContact OH-CZ 3.22Å; Y34-E69 WeakPolarHBondContact CD2-O 3.2Å; Y34-V72 WeakPolarHBondContact OH-CG2 3.27Å; Y34-V75 HydrophobicContact CD1-CG2 3.98Å; Y34-V75 HydrophobicContact CD2-CG2 3.47Å; Y34-V75 VanDerWaalsContact CD2-CG2 3.47Å; Y34-V75 HydrophobicContact CE1-CG2 4.39Å; Y34-V75 HydrophobicContact CE2-CG2 3.96Å; Y34-V75 HydrophobicContact CG-CG2 3.48Å; Y34-V75 VanDerWaalsContact CG-CG2 3.48Å
35L94Very high92.1Very high116 Ų11656.7 Ų56.761%0.60733%0.332SS*.Hα-helixtrans-63.6-39.5175.6-69.8174.4000111.7L31 F32 S37 F38L31-L35 VanDerWaalsContact O-CG 3.28Å; L31-L35 WeakPolarHBondContact O-CG 3.47Å; L31-L35 PolarHBondContact O-N 2.99Å; F32-L35 PolarHBondContact O-N 3.32Å; L35-S37 PolarHBondContact O-N 3.19Å; L35-F38 PolarHBondContact O-N 3.49Å
36L92.5Very high92.1Very high55 Ų5554.1 Ų54.129%0.28831%0.31SS..Hα-helixtrans-62.4-31.9175.7-172.464000111.8F32 L33 Y34 F38 A39 V40 T42F32-L36 HydrophobicContact CE1-CD2 4.33Å; F32-L36 WeakPolarHBondContact O-CB 3.45Å; F32-L36 PolarHBondContact O-N 2.95Å; L33-L36 HydrophobicContact CD2-CD2 4.2Å; L33-L36 PolarHBondContact O-N 3.24Å; Y34-L36 VanDerWaalsContact C-N 3.32Å; Y34-L36 PolarHBondContact O-N 3.25Å; L36-F38 PolarHBondContact O-N 2.84Å; L36-F38 VanDerWaalsContact O-N 3.13Å; L36-A39 PolarHBondContact O-N 3.19Å; L36-V40 HydrophobicContact CD1-CB 4.32Å; L36-V40 HydrophobicContact CD1-CG2 3.94Å; L36-V40 PolarHBondContact O-N 3.26Å; L36-T42 HydrophobicContact CG-CG2 4.39Å
37S90.6Very high92Very high36 Ų3653.3 Ų53.325%0.25231%0.306SS..Hα-helixtrans-58.8-22.7176.2-157.70000114.5L33 Y34 L35 T42 M68L33-S37 PolarHBondContact O-N 2.9Å; Y34-S37 WeakPolarHBondContact O-CB 3.43Å; Y34-S37 PolarHBondContact O-N 3.08Å; Y34-S37 VanDerWaalsContact O-N 3.17Å; L35-S37 PolarHBondContact O-N 3.19Å; S37-T42 PolarHBondContact OG-OG1 2.94Å; S37-M68 WeakPolarHBondContact OG-CE 3.35Å
38F90.9Very high92Very high149 Ų14953.3 Ų53.365%0.65431%0.306SS*.Hα-helixtrans-84.6-25.3175.5-68.6-76.3000113Y34 L35 L36Y34-F38 HydrophobicContact CD1-CE2 4.24Å; Y34-F38 AromaticContact CE1-CE2 3.67Å; Y34-F38 HydrophobicContact CE1-CE2 3.67Å; Y34-F38 HydrophobicContact CE1-CZ 4.25Å; Y34-F38 AromaticContact CE2-CE2 3.98Å; Y34-F38 HydrophobicContact CE2-CE2 3.98Å; Y34-F38 HydrophobicContact CE2-CZ 4.21Å; Y34-F38 AromaticContact CZ-CE2 3.5Å; Y34-F38 AromaticContact CZ-CZ 3.7Å; Y34-F38 WeakPolarHBondContact O-CD2 3.21Å; Y34-F38 VanDerWaalsContact OH-CZ 3.3Å; Y34-F38 WeakPolarHBondContact OH-CZ 3.22Å; L35-F38 PolarHBondContact O-N 3.49Å; L36-F38 PolarHBondContact O-N 2.84Å; L36-F38 VanDerWaalsContact O-N 3.13Å
39A89.1Confident91.8Very high83 Ų8350.6 Ų50.669%0.68628%0.284SS*.Hα-helixtrans-94.9-34.3-175.300000112.5L36L36-A39 PolarHBondContact O-N 3.19Å
40V89.4Confident91.6Very high85 Ų8549.7 Ų49.752%0.51528%0.277SS..SBendtrans-136.5147.7-171.4-174.80000109.9L36 T42L36-V40 HydrophobicContact CD1-CB 4.32Å; L36-V40 HydrophobicContact CD1-CG2 3.94Å; L36-V40 PolarHBondContact O-N 3.26Å; V40-T42 PolarHBondContact O-N 3.45Å; V40-T42 VanDerWaalsContact O-N 3.09Å
41D86.1Confident91.5Very high136 Ų13653.2 Ų53.273%0.72729%0.291SS*.  trans-65.5108.9168.5-175.47.4000110.1G43D41-G43 PolarHBondContact O-N 2.95Å; D41-G43 PolarHBondContact OD1-N 3.3Å
42T84.6Confident91.3Very high9 Ų950.3 Ų50.36%0.05528%0.276CS..G310 helixtrans-86.812-178.348.60000112.9L36 S37 V40 C44 L45 M68L36-T42 HydrophobicContact CG-CG2 4.39Å; S37-T42 PolarHBondContact OG-OG1 2.94Å; V40-T42 PolarHBondContact O-N 3.45Å; V40-T42 VanDerWaalsContact O-N 3.09Å; T42-C44 PolarHBondContact O-N 3.48Å; T42-C44 VanDerWaalsContact O-N 3.11Å; T42-L45 HydrophobicContact CG2-CD1 4.29Å; T42-L45 PolarHBondContact O-N 3.42Å; T42-M68 VanDerWaalsContact CB-CE 3.41Å; T42-M68 HydrophobicContact CG2-CE 3.7Å; T42-M68 HydrophobicContact CG2-SD 3.98Å; T42-M68 WeakPolarHBondContact OG1-CE 3.32Å
43G85Confident90.9Very high15 Ų1547 Ų4716%0.15526%0.261CS..G310 helixtrans-54.2-28.2175.100000114.2D41 L45D41-G43 PolarHBondContact O-N 2.95Å; D41-G43 PolarHBondContact OD1-N 3.3Å; G43-L45 VanDerWaalsContact C-N 3.27Å; G43-L45 PolarHBondContact O-N 2.85Å
44C88.3Confident90.4Very high55 Ų5550.4 Ų50.437%0.37228%0.284SS..G310 helixtrans-74.5-9.8177.168.60000114.9T42 W58 W60 T61T42-C44 PolarHBondContact O-N 3.48Å; T42-C44 VanDerWaalsContact O-N 3.11Å; C44-W58 HydrophobicContact CB-CH2 4.2Å; C44-W58 HydrophobicContact CB-CZ3 4.23Å; C44-W60 PolarHBondContact O-NE1 3.27Å; C44-T61 VanDerWaalsContact O-CG2 3.26Å; C44-T61 WeakPolarHBondContact O-CG2 3.22Å
45L92.1Very high90Very high29 Ų2954 Ų5415%0.15231%0.311CS..THydrogen-bonded Turntrans-100.5-20.3178-63175.9000112.7L33 T42 G43 T64 H65 M68L33-L45 HydrophobicContact CD2-CD1 3.64Å; T42-L45 HydrophobicContact CG2-CD1 4.29Å; T42-L45 PolarHBondContact O-N 3.42Å; G43-L45 VanDerWaalsContact C-N 3.27Å; G43-L45 PolarHBondContact O-N 2.85Å; L45-T64 HydrophobicContact CD2-CG2 4.1Å; L45-T64 PolarHBondContact O-OG1 3.36Å; L45-H65 WeakPolarHBondContact O-CA 3.43Å; L45-H65 PolarHBondContact O-N 2.82Å; L45-M68 HydrophobicContact CD1-SD 4.4Å
46A93.5Very high89.7Confident3 Ų352.2 Ų52.23%0.02530%0.302CS..SBendtrans-82.1145.4174.900000110.7T48 T61 R134 H136A46-T48 PolarHBondContact O-N 3.05Å; A46-T48 VanDerWaalsContact O-N 3.11Å; A46-T61 WeakPolarHBondContact O-CG2 3.34Å; A46-R134 HydrophobicContact CB-CB 4.1Å; A46-R134 HydrophobicContact CB-CG 4.5Å; A46-H136 HydrophobicContact CB-CB 4.05Å
47V94.6Very high89.7Confident0 Ų054.7 Ų54.70%031%0.311CS..BIsolated β-bridgetrans-73.6110.3174.9173.90000108.1T61 L62 H65 A114 I135V47-T61 VanDerWaalsContact CG2-C 3.5Å; V47-T61 VanDerWaalsContact CG2-O 3.3Å; V47-T61 WeakPolarHBondContact CG2-O 3.02Å; V47-L62 HydrophobicContact CG2-CD2 4.2Å; V47-H65 HydrophobicContact CB-CB 4.47Å; V47-H65 HydrophobicContact CG2-CB 3.83Å; V47-A114 HydrophobicContact CG1-CB 4.09Å; V47-I135 HydrophobicContact CB-CB 4.21Å; V47-I135 PolarHBondContact N-O 3.5Å; V47-I135 PolarHBondContact O-N 3.44Å
48T94.1Very high89.8Confident5 Ų555.7 Ų55.73%0.03131%0.309CS..  trans-101.6116.1168.4-560000107.5A46 G50 Y51 L52 L130A46-T48 PolarHBondContact O-N 3.05Å; A46-T48 VanDerWaalsContact O-N 3.11Å; T48-G50 VanDerWaalsContact C-N 3.26Å; T48-G50 PolarHBondContact O-N 3.45Å; T48-G50 VanDerWaalsContact O-N 3.15Å; T48-Y51 HydrophobicContact CG2-CD2 3.41Å; T48-Y51 VanDerWaalsContact CG2-CD2 3.41Å; T48-Y51 HydrophobicContact CG2-CE2 3.78Å; T48-Y51 HydrophobicContact CG2-CG 4.25Å; T48-Y51 PolarHBondContact O-N 2.96Å; T48-L52 PolarHBondContact O-N 3Å; T48-L130 WeakPolarHBondContact CG2-O 3.42Å
49P92.3Very high89.9Confident0 Ų053.4 Ų53.40%030%0.303CS..Hα-helixtrans-52.6-41.7-171.5-28.234.6000113.5Y51 L52 F53 A114 Y117 L130 V133P49-Y51 VanDerWaalsContact C-N 3.33Å; P49-Y51 PolarHBondContact O-N 3.25Å; P49-L52 PolarHBondContact O-N 3.38Å; P49-F53 WeakPolarHBondContact O-CD2 3.3Å; P49-F53 WeakPolarHBondContact O-CE2 3.34Å; P49-A114 HydrophobicContact CB-CB 4.31Å; P49-Y117 HydrophobicContact CG-CD2 4.17Å; P49-Y117 HydrophobicContact CG-CG 4.17Å; P49-L130 HydrophobicContact CB-CD2 4.17Å; P49-V133 VanDerWaalsContact CD-O 3.22Å; P49-V133 WeakPolarHBondContact CD-O 3.4Å
50G91.8Very high90.2Very high10 Ų1055.5 Ų55.510%0.10329%0.293CS..Hα-helixtrans-68.3-23.7179.800000115.2T48 L130T48-G50 VanDerWaalsContact C-N 3.26Å; T48-G50 PolarHBondContact O-N 3.45Å; T48-G50 VanDerWaalsContact O-N 3.15Å; G50-L130 WeakPolarHBondContact CA-O 3Å; G50-L130 PolarHBondContact N-O 3.22Å
51Y92.6Very high90.4Very high75 Ų7551.4 Ų51.429%0.29427%0.269SS..Hα-helixtrans-94.3-15179.5-61.6-48.6000113.6T48 P49 N56 F57 W58 F131T48-Y51 HydrophobicContact CG2-CD2 3.41Å; T48-Y51 VanDerWaalsContact CG2-CD2 3.41Å; T48-Y51 HydrophobicContact CG2-CE2 3.78Å; T48-Y51 HydrophobicContact CG2-CG 4.25Å; T48-Y51 PolarHBondContact O-N 2.96Å; P49-Y51 VanDerWaalsContact C-N 3.33Å; P49-Y51 PolarHBondContact O-N 3.25Å; Y51-N56 HydrophobicContact CD1-CB 4.25Å; Y51-N56 WeakPolarHBondContact CD1-ND2 3.24Å; Y51-F57 PolarHBondContact O-N 3.47Å; Y51-W58 AromaticContact CD2-CE3 4Å; Y51-W58 HydrophobicContact CD2-CE3 4Å; Y51-W58 HydrophobicContact CD2-CH2 4.03Å; Y51-W58 AromaticContact CD2-CZ3 3.64Å; Y51-W58 HydrophobicContact CD2-CZ3 3.64Å; Y51-W58 HydrophobicContact CE2-CH2 4.42Å; Y51-W58 HydrophobicContact CE2-CZ3 4.35Å; Y51-W58 HydrophobicContact CG-CD2 4.32Å; Y51-W58 HydrophobicContact CG-CE3 4.09Å; Y51-W58 HydrophobicContact CG-CH2 4.41Å; Y51-W58 HydrophobicContact CG-CZ3 4.12Å; Y51-W58 PolarHBondContact O-N 3.25Å; Y51-F131 HydrophobicContact CD1-CD1 4.48Å; Y51-F131 HydrophobicContact CD1-CE1 4.39Å; Y51-F131 AromaticContact CE1-CD1 3.96Å; Y51-F131 HydrophobicContact CE1-CD1 3.96Å; Y51-F131 HydrophobicContact CE1-CE1 4.06Å; Y51-F131 HydrophobicContact CE2-CD1 4.45Å; Y51-F131 AromaticContact CZ-CD1 3.92Å
52L91Very high90.9Very high15 Ų1546 Ų468%0.07924%0.239CC..Hα-helixtrans-69.1-37.8174-176.165.9000111.6T48 P49 L62 A114T48-L52 PolarHBondContact O-N 3Å; P49-L52 PolarHBondContact O-N 3.38Å; L52-L62 HydrophobicContact CD1-CD1 4.03Å; L52-L62 HydrophobicContact CD1-CD2 3.87Å; L52-L62 HydrophobicContact CD1-CG 3.77Å; L52-L62 HydrophobicContact CD2-CD2 3.91Å; L52-A114 HydrophobicContact CD2-CB 3.43Å; L52-A114 VanDerWaalsContact CD2-CB 3.43Å
53F87Confident91.3Very high61 Ų6148.2 Ų48.227%0.26826%0.259SS..SBendtrans-81.9165.8179-60.4-64.5000111.5P49 N56 L118P49-F53 WeakPolarHBondContact O-CD2 3.3Å; P49-F53 WeakPolarHBondContact O-CE2 3.34Å; F53-N56 PolarHBondContact O-N 3.49Å; F53-L118 HydrophobicContact CD2-CD2 4.47Å; F53-L118 HydrophobicContact CE1-CD2 4.36Å; F53-L118 HydrophobicContact CE2-CB 4.06Å; F53-L118 HydrophobicContact CE2-CD1 4.42Å; F53-L118 HydrophobicContact CE2-CD2 3.85Å; F53-L118 HydrophobicContact CE2-CG 4.33Å; F53-L118 HydrophobicContact CZ-CB 4.46Å; F53-L118 HydrophobicContact CZ-CD2 3.79Å
54P84.1Confident91.7Very high89 Ų8949.2 Ų49.258%0.57826%0.262SS*.THydrogen-bonded Turntrans-53.6142.6173.5-14.722.5000110.6F57P54-F57 HydrophobicContact CB-CE1 4.32Å; P54-F57 HydrophobicContact CB-CE2 3.81Å; P54-F57 HydrophobicContact CB-CZ 3.68Å; P54-F57 HydrophobicContact CG-CE1 3.76Å; P54-F57 HydrophobicContact CG-CE2 4.12Å; P54-F57 HydrophobicContact CG-CZ 3.45Å; P54-F57 VanDerWaalsContact CG-CZ 3.45Å
55P85.9Confident92Very high108 Ų10846.6 Ų46.670%0.70124%0.244SC*.THydrogen-bonded Turncis-93.9-11.212.934.5-35.3000115.9F57P55-F57 WeakPolarHBondContact O-CD2 3.38Å
56N89.2Confident92.1Very high78 Ų7845.2 Ų45.242%0.41724%0.237SC..THydrogen-bonded Turntrans-85-27-166.6-66.2-64000114.2Y51 F53 W58Y51-N56 HydrophobicContact CD1-CB 4.25Å; Y51-N56 WeakPolarHBondContact CD1-ND2 3.24Å; F53-N56 PolarHBondContact O-N 3.49Å; N56-W58 VanDerWaalsContact O-CD1 3.3Å; N56-W58 PolarHBondContact O-N 2.96Å
57F91.2Very high92.2Very high107 Ų10746.4 Ų46.447%0.46924%0.243SC..  trans46.751.4176.2-67.7-76000114.4Y51 P54 P55 I59Y51-F57 PolarHBondContact O-N 3.47Å; P54-F57 HydrophobicContact CB-CE1 4.32Å; P54-F57 HydrophobicContact CB-CE2 3.81Å; P54-F57 HydrophobicContact CB-CZ 3.68Å; P54-F57 HydrophobicContact CG-CE1 3.76Å; P54-F57 HydrophobicContact CG-CE2 4.12Å; P54-F57 HydrophobicContact CG-CZ 3.45Å; P54-F57 VanDerWaalsContact CG-CZ 3.45Å; P55-F57 WeakPolarHBondContact O-CD2 3.38Å; F57-I59 HydrophobicContact CB-CD1 4.37Å; F57-I59 HydrophobicContact CB-CG1 4.43Å; F57-I59 HydrophobicContact CD1-CD1 4.43Å; F57-I59 PolarHBondContact O-N 2.94Å
58W92.3Very high92.1Very high58 Ų5846.4 Ų46.422%0.2224%0.243CC..  trans-73.555.7176.3-72.68.9000112.5C44 Y51 N56 W60 T61C44-W58 HydrophobicContact CB-CH2 4.2Å; C44-W58 HydrophobicContact CB-CZ3 4.23Å; Y51-W58 AromaticContact CD2-CE3 4Å; Y51-W58 HydrophobicContact CD2-CE3 4Å; Y51-W58 HydrophobicContact CD2-CH2 4.03Å; Y51-W58 AromaticContact CD2-CZ3 3.64Å; Y51-W58 HydrophobicContact CD2-CZ3 3.64Å; Y51-W58 HydrophobicContact CE2-CH2 4.42Å; Y51-W58 HydrophobicContact CE2-CZ3 4.35Å; Y51-W58 HydrophobicContact CG-CD2 4.32Å; Y51-W58 HydrophobicContact CG-CE3 4.09Å; Y51-W58 HydrophobicContact CG-CH2 4.41Å; Y51-W58 HydrophobicContact CG-CZ3 4.12Å; Y51-W58 PolarHBondContact O-N 3.25Å; N56-W58 VanDerWaalsContact O-CD1 3.3Å; N56-W58 PolarHBondContact O-N 2.96Å; W58-W60 VanDerWaalsContact C-N 3.26Å; W58-W60 HydrophobicContact CB-CH2 4.11Å; W58-W60 HydrophobicContact CB-CZ2 3.94Å; W58-W60 HydrophobicContact CB-CZ3 4.49Å; W58-W60 AromaticContact CD1-CH2 3.14Å; W58-W60 AromaticContact CD1-CZ2 3.45Å; W58-W60 VanDerWaalsContact CD1-CZ2 3.45Å; W58-W60 AromaticContact CD1-CZ3 3.99Å; W58-W60 HydrophobicContact CD2-CH2 4.42Å; W58-W60 AromaticContact CD2-CZ2 3.96Å; W58-W60 HydrophobicContact CD2-CZ2 3.96Å; W58-W60 AromaticContact CG-CH2 3.66Å; W58-W60 HydrophobicContact CG-CH2 3.66Å; W58-W60 AromaticContact CG-CZ2 3.52Å; W58-W60 HydrophobicContact CG-CZ2 3.52Å; W58-W60 HydrophobicContact CG-CZ3 4.45Å; W58-W60 AromaticContact NE1-CH2 3.66Å; W58-W60 AromaticContact NE1-CZ2 3.82Å; W58-W60 PolarHBondContact O-N 2.85Å; W58-T61 HydrophobicContact CB-CG2 3.88Å; W58-T61 HydrophobicContact CE3-CG2 4.27Å; W58-T61 WeakPolarHBondContact O-CB 3.45Å; W58-T61 WeakPolarHBondContact O-CG2 3.3Å; W58-T61 PolarHBondContact O-N 2.79Å; W58-T61 VanDerWaalsContact O-N 3.12Å; W58-T61 PolarHBondContact O-OG1 3.34Å
59I93.8Very high92.1Very high101 Ų10146.7 Ų46.752%0.51824%0.244SC..THydrogen-bonded Turntrans-64.3-30.9-172.7-60.3165.6000111.5F57 T61 L62F57-I59 HydrophobicContact CB-CD1 4.37Å; F57-I59 HydrophobicContact CB-CG1 4.43Å; F57-I59 HydrophobicContact CD1-CD1 4.43Å; F57-I59 PolarHBondContact O-N 2.94Å; I59-T61 PolarHBondContact O-N 3.45Å; I59-L62 HydrophobicContact CG2-CD1 4.31Å; I59-L62 WeakPolarHBondContact O-CB 3.28Å; I59-L62 WeakPolarHBondContact O-CG 3.42Å; I59-L62 PolarHBondContact O-N 2.93Å; I59-L62 VanDerWaalsContact O-N 3.13Å
60W94.4Very high92Very high126 Ų12649.8 Ų49.848%0.47726%0.258SS..THydrogen-bonded Turntrans-60.2-26.8177.463.584.6000112.6C44 W58 L62 A63 T64C44-W60 PolarHBondContact O-NE1 3.27Å; W58-W60 VanDerWaalsContact C-N 3.26Å; W58-W60 HydrophobicContact CB-CH2 4.11Å; W58-W60 HydrophobicContact CB-CZ2 3.94Å; W58-W60 HydrophobicContact CB-CZ3 4.49Å; W58-W60 AromaticContact CD1-CH2 3.14Å; W58-W60 AromaticContact CD1-CZ2 3.45Å; W58-W60 VanDerWaalsContact CD1-CZ2 3.45Å; W58-W60 AromaticContact CD1-CZ3 3.99Å; W58-W60 HydrophobicContact CD2-CH2 4.42Å; W58-W60 AromaticContact CD2-CZ2 3.96Å; W58-W60 HydrophobicContact CD2-CZ2 3.96Å; W58-W60 AromaticContact CG-CH2 3.66Å; W58-W60 HydrophobicContact CG-CH2 3.66Å; W58-W60 AromaticContact CG-CZ2 3.52Å; W58-W60 HydrophobicContact CG-CZ2 3.52Å; W58-W60 HydrophobicContact CG-CZ3 4.45Å; W58-W60 AromaticContact NE1-CH2 3.66Å; W58-W60 AromaticContact NE1-CZ2 3.82Å; W58-W60 PolarHBondContact O-N 2.85Å; W60-L62 PolarHBondContact O-N 3.38Å; W60-L62 VanDerWaalsContact O-N 3.17Å; W60-A63 PolarHBondContact O-N 2.9Å; W60-T64 PolarHBondContact O-N 2.66Å; W60-T64 VanDerWaalsContact O-N 3.09Å; W60-T64 PolarHBondContact O-OG1 2.84Å
61T94.9Very high92Very high0 Ų053.5 Ų53.50%027%0.273CS..Hα-helixtrans-58.9-29.8178.162.20000112.3C44 A46 V47 W58 I59 A63 T64 H65C44-T61 VanDerWaalsContact O-CG2 3.26Å; C44-T61 WeakPolarHBondContact O-CG2 3.22Å; A46-T61 WeakPolarHBondContact O-CG2 3.34Å; V47-T61 VanDerWaalsContact CG2-C 3.5Å; V47-T61 VanDerWaalsContact CG2-O 3.3Å; V47-T61 WeakPolarHBondContact CG2-O 3.02Å; W58-T61 HydrophobicContact CB-CG2 3.88Å; W58-T61 HydrophobicContact CE3-CG2 4.27Å; W58-T61 WeakPolarHBondContact O-CB 3.45Å; W58-T61 WeakPolarHBondContact O-CG2 3.3Å; W58-T61 PolarHBondContact O-N 2.79Å; W58-T61 VanDerWaalsContact O-N 3.12Å; W58-T61 PolarHBondContact O-OG1 3.34Å; I59-T61 PolarHBondContact O-N 3.45Å; T61-A63 PolarHBondContact O-N 2.92Å; T61-T64 WeakPolarHBondContact CA-OG1 3.28Å; T61-T64 PolarHBondContact O-N 2.93Å; T61-H65 VanDerWaalsContact O-CB 3.32Å; T61-H65 WeakPolarHBondContact O-CB 3.27Å; T61-H65 PolarHBondContact O-N 3.43Å; T61-H65 PolarHBondContact O-ND1 3.35Å
62L95.2Very high92Very high21 Ų2153.8 Ų53.811%0.1128%0.282CS..Hα-helixtrans-60.2-30.7175.7-62180000112.7V47 L52 I59 W60 H65 V107 L111V47-L62 HydrophobicContact CG2-CD2 4.2Å; L52-L62 HydrophobicContact CD1-CD1 4.03Å; L52-L62 HydrophobicContact CD1-CD2 3.87Å; L52-L62 HydrophobicContact CD1-CG 3.77Å; L52-L62 HydrophobicContact CD2-CD2 3.91Å; I59-L62 HydrophobicContact CG2-CD1 4.31Å; I59-L62 WeakPolarHBondContact O-CB 3.28Å; I59-L62 WeakPolarHBondContact O-CG 3.42Å; I59-L62 PolarHBondContact O-N 2.93Å; I59-L62 VanDerWaalsContact O-N 3.13Å; W60-L62 PolarHBondContact O-N 3.38Å; W60-L62 VanDerWaalsContact O-N 3.17Å; L62-H65 PolarHBondContact O-CE1 3.42Å; L62-H65 PolarHBondContact O-ND1 3.44Å; L62-H65 VanDerWaalsContact O-ND1 3.16Å; L62-V107 HydrophobicContact CB-CG1 4.47Å; L62-V107 HydrophobicContact CB-CG2 4.45Å; L62-L111 HydrophobicContact CD2-CB 4.47Å
63A92.9Very high92.1Very high57 Ų5762.4 Ų62.447%0.47131%0.314SS..Hα-helixtrans-91.8-36.5176.800000112.4W60 T61W60-A63 PolarHBondContact O-N 2.9Å; T61-A63 PolarHBondContact O-N 2.92Å
64T94.3Very high92.4Very high35 Ų3562 Ų6222%0.21531%0.314CS..Hα-helixtrans-84.6-30.4-171.6560000114.2L45 W60 T61 G66 L67L45-T64 HydrophobicContact CD2-CG2 4.1Å; L45-T64 PolarHBondContact O-OG1 3.36Å; W60-T64 PolarHBondContact O-N 2.66Å; W60-T64 VanDerWaalsContact O-N 3.09Å; W60-T64 PolarHBondContact O-OG1 2.84Å; T61-T64 WeakPolarHBondContact CA-OG1 3.28Å; T61-T64 PolarHBondContact O-N 2.93Å; T64-G66 VanDerWaalsContact C-N 3.27Å; T64-G66 PolarHBondContact O-N 3.5Å; T64-L67 PolarHBondContact O-N 3Å; T64-L67 VanDerWaalsContact O-N 3.08Å
65H95.5Very high93Very high1 Ų158.1 Ų58.11%0.00529%0.289CS..G310 helixtrans-61.2-33.4-17174.8-74.4000114L45 V47 T61 L62 L67 M68 N106 I135 H136 G137L45-H65 WeakPolarHBondContact O-CA 3.43Å; L45-H65 PolarHBondContact O-N 2.82Å; V47-H65 HydrophobicContact CB-CB 4.47Å; V47-H65 HydrophobicContact CG2-CB 3.83Å; T61-H65 VanDerWaalsContact O-CB 3.32Å; T61-H65 WeakPolarHBondContact O-CB 3.27Å; T61-H65 PolarHBondContact O-N 3.43Å; T61-H65 PolarHBondContact O-ND1 3.35Å; L62-H65 PolarHBondContact O-CE1 3.42Å; L62-H65 PolarHBondContact O-ND1 3.44Å; L62-H65 VanDerWaalsContact O-ND1 3.16Å; H65-L67 PolarHBondContact O-N 2.81Å; H65-M68 PolarHBondContact O-N 2.94Å; H65-N106 PolarHBondContact CE1-O 2.89Å; H65-I135 WeakPolarHBondContact CB-O 3.35Å; H65-H136 WeakPolarHBondContact O-CA 3.41Å; H65-G137 PolarHBondContact O-N 2.95Å
66G93.7Very high93.4Very high0 Ų055.4 Ų55.40%028%0.276CS..G310 helixtrans-69.6-13.3-179.600000114.2T64 N106 A138T64-G66 VanDerWaalsContact C-N 3.27Å; T64-G66 PolarHBondContact O-N 3.5Å; G66-N106 WeakPolarHBondContact CA-OD1 3.42Å; G66-A138 WeakPolarHBondContact O-CA 3.26Å; G66-A138 WeakPolarHBondContact O-CB 3.23Å; G66-A138 PolarHBondContact O-N 3.3Å
67L94.7Very high93.7Very high27 Ų2755.5 Ų55.514%0.14128%0.275CS..G310 helixtrans-100.6-8176.6-64.6169.1000112.5L26 A29 V30 L33 T64 H65 F102L26-L67 HydrophobicContact CD2-CD2 3.97Å; A29-L67 HydrophobicContact CB-CD1 4.15Å; A29-L67 HydrophobicContact CB-CD2 4.37Å; V30-L67 HydrophobicContact CG2-CD2 3.89Å; L33-L67 HydrophobicContact CD1-CB 3.64Å; T64-L67 PolarHBondContact O-N 3Å; T64-L67 VanDerWaalsContact O-N 3.08Å; H65-L67 PolarHBondContact O-N 2.81Å; L67-F102 HydrophobicContact CD2-CE1 4.25Å; L67-F102 HydrophobicContact CD2-CE2 4.36Å; L67-F102 HydrophobicContact CD2-CZ 3.53Å; L67-F102 HydrophobicContact CG-CE1 4.44Å; L67-F102 HydrophobicContact CG-CZ 3.95Å
68M93.1Very high93.9Very high1 Ų150.4 Ų50.41%0.00525%0.253CS..  trans-95.4113.1-173.2-176.467.4-150.800110.6L33 S37 T42 L45 H65 H136 G137L33-M68 HydrophobicContact CB-SD 3.94Å; S37-M68 WeakPolarHBondContact OG-CE 3.35Å; T42-M68 VanDerWaalsContact CB-CE 3.41Å; T42-M68 HydrophobicContact CG2-CE 3.7Å; T42-M68 HydrophobicContact CG2-SD 3.98Å; T42-M68 WeakPolarHBondContact OG1-CE 3.32Å; L45-M68 HydrophobicContact CD1-SD 4.4Å; H65-M68 PolarHBondContact O-N 2.94Å; M68-H136 HydrophobicContact CB-CB 4.37Å; M68-H136 HydrophobicContact CG-CB 4.49Å; M68-H136 PolarHBondContact O-ND1 2.92Å; M68-G137 VanDerWaalsContact O-CA 3.24Å; M68-G137 WeakPolarHBondContact O-CA 3.33Å; M68-G137 PolarHBondContact O-N 3.27Å
69E94.1Very high94.1Very high10 Ų1049.7 Ų49.75%0.04725%0.253CS..  trans-115.2147.3175.7-62.8-64-178.100111.4V30 Y34 D74 V75 S78 G137 A138V30-E69 HydrophobicContact CG1-CG 4.24Å; Y34-E69 WeakPolarHBondContact CD2-O 3.2Å; E69-D74 HydrophobicContact CB-CB 4.26Å; E69-D74 HydrophobicContact CG-CB 4.3Å; E69-D74 WeakPolarHBondContact OE2-CB 3.22Å; E69-V75 HydrophobicContact CB-CG2 3.57Å; E69-V75 HydrophobicContact CG-CG2 4.27Å; E69-S78 WeakPolarHBondContact OE1-CB 3.42Å; E69-G137 VanDerWaalsContact CD-CA 3.46Å; E69-G137 VanDerWaalsContact OE1-CA 3.28Å; E69-G137 WeakPolarHBondContact OE1-CA 3.49Å; E69-G137 WeakPolarHBondContact OE2-CA 3.37Å; E69-A138 PolarHBondContact OE1-N 3Å
70Q89.9Confident94.1Very high65 Ų6549 Ų4930%0.30425%0.254SS..  trans-108.6-31.6-178.1-68.6-172.8-17.800113.2H136Q70-H136 VanDerWaalsContact CD-CE1 3.47Å; Q70-H136 PolarHBondContact OE1-NE2 3.29Å
71H91.8Very high94.2Very high88 Ų8843.4 Ų43.441%0.40723%0.234SC..SBendtrans-107.4145.8179.7-4991.5000111.1W73 D74 V75H71-W73 PolarHBondContact O-N 3.45Å; H71-D74 WeakPolarHBondContact CB-OD2 3.49Å; H71-D74 IonicContact CG-OD2 2.72Å; H71-D74 IonicContact ND1-OD2 3.62Å; H71-D74 PolarHBondContact ND1-OD2 2.73Å; H71-D74 PolarHBondContact O-N 3.35Å; H71-V75 PolarHBondContact O-N 2.82Å
72V92.7Very high94.2Very high81 Ų8143.6 Ų43.649%0.49124%0.235SC..Hα-helixtrans-54.3-37.5176-179.70000111.4Y34 V75 A76Y34-V72 WeakPolarHBondContact OH-CG2 3.27Å; V72-V75 WeakPolarHBondContact O-CB 3.37Å; V72-V75 PolarHBondContact O-N 3.2Å; V72-A76 PolarHBondContact O-N 2.84Å
73W93.5Very high94.2Very high197 Ų19744.3 Ų44.375%0.74624%0.24SC*.Hα-helixtrans-67-39179.6-29.6110.5000111.6H71 A76 I77H71-W73 PolarHBondContact O-N 3.45Å; W73-A76 WeakPolarHBondContact O-CB 3.31Å; W73-A76 PolarHBondContact O-N 2.91Å; W73-I77 WeakPolarHBondContact O-CG1 3.13Å; W73-I77 PolarHBondContact O-N 2.99Å
74D93.3Very high94.2Very high51 Ų5143.9 Ų43.927%0.27323%0.231SC..Hα-helixtrans-68.6-37.2176.8-57-33.1000110.8E69 H71 A76 I77 S78E69-D74 HydrophobicContact CB-CB 4.26Å; E69-D74 HydrophobicContact CG-CB 4.3Å; E69-D74 WeakPolarHBondContact OE2-CB 3.22Å; H71-D74 WeakPolarHBondContact CB-OD2 3.49Å; H71-D74 IonicContact CG-OD2 2.72Å; H71-D74 IonicContact ND1-OD2 3.62Å; H71-D74 PolarHBondContact ND1-OD2 2.73Å; H71-D74 PolarHBondContact O-N 3.35Å; D74-A76 VanDerWaalsContact C-N 3.34Å; D74-A76 PolarHBondContact O-N 2.92Å; D74-I77 PolarHBondContact O-N 3.13Å; D74-S78 WeakPolarHBondContact O-CB 3.42Å; D74-S78 PolarHBondContact O-N 3.38Å; D74-S78 PolarHBondContact O-OG 3.5Å
75V95.6Very high94.2Very high9 Ų942.2 Ų42.26%0.05522%0.221CC..Hα-helixtrans-59.2-44.8170.3174.60000111V30 L31 Y34 E69 H71 V72 I77 S78 L79V30-V75 HydrophobicContact CG1-CG1 4.4Å; L31-V75 HydrophobicContact CD2-CG1 4.01Å; Y34-V75 HydrophobicContact CD1-CG2 3.98Å; Y34-V75 HydrophobicContact CD2-CG2 3.47Å; Y34-V75 VanDerWaalsContact CD2-CG2 3.47Å; Y34-V75 HydrophobicContact CE1-CG2 4.39Å; Y34-V75 HydrophobicContact CE2-CG2 3.96Å; Y34-V75 HydrophobicContact CG-CG2 3.48Å; Y34-V75 VanDerWaalsContact CG-CG2 3.48Å; E69-V75 HydrophobicContact CB-CG2 3.57Å; E69-V75 HydrophobicContact CG-CG2 4.27Å; H71-V75 PolarHBondContact O-N 2.82Å; V72-V75 WeakPolarHBondContact O-CB 3.37Å; V72-V75 PolarHBondContact O-N 3.2Å; V75-I77 PolarHBondContact O-N 3.33Å; V75-S78 VanDerWaalsContact CA-OG 3.29Å; V75-S78 WeakPolarHBondContact CA-OG 3.37Å; V75-S78 PolarHBondContact O-N 3.03Å; V75-S78 PolarHBondContact O-OG 3.41Å; V75-L79 HydrophobicContact CG1-CD1 3.55Å; V75-L79 HydrophobicContact CG1-CG 4.47Å; V75-L79 WeakPolarHBondContact O-CB 3.36Å; V75-L79 VanDerWaalsContact O-CD1 3.31Å; V75-L79 WeakPolarHBondContact O-CD1 3.36Å; V75-L79 WeakPolarHBondContact O-CG 3.21Å; V75-L79 PolarHBondContact O-N 2.76Å
76A95.8Very high94.1Very high51 Ų5142.7 Ų42.742%0.42123%0.227SC..Hα-helixtrans-64-40.9177.600000112.2V72 W73 D74 T80V72-A76 PolarHBondContact O-N 2.84Å; W73-A76 WeakPolarHBondContact O-CB 3.31Å; W73-A76 PolarHBondContact O-N 2.91Å; D74-A76 VanDerWaalsContact C-N 3.34Å; D74-A76 PolarHBondContact O-N 2.92Å; A76-T80 WeakPolarHBondContact O-CB 3.37Å; A76-T80 PolarHBondContact O-N 3.48Å; A76-T80 PolarHBondContact O-OG1 2.84Å
77I95.2Very high94.1Very high79 Ų7948.4 Ų48.441%0.40525%0.248SC..Hα-helixtrans-65.7-46.4177.1-67.9165.4000110.7W73 D74 V75 T80 T81 L142W73-I77 WeakPolarHBondContact O-CG1 3.13Å; W73-I77 PolarHBondContact O-N 2.99Å; D74-I77 PolarHBondContact O-N 3.13Å; V75-I77 PolarHBondContact O-N 3.33Å; I77-T80 PolarHBondContact O-N 2.89Å; I77-T81 WeakPolarHBondContact O-CB 3.11Å; I77-T81 PolarHBondContact O-N 2.86Å; I77-T81 PolarHBondContact O-OG1 3.03Å; I77-L142 HydrophobicContact CG2-CD2 3.95Å
78S95.7Very high93.9Very high1 Ų150.4 Ų50.41%0.00726%0.259CS..Hα-helixtrans-64.3-46179.454.80000112.2V30 E69 D74 V75 T80 T81 V82V30-S78 WeakPolarHBondContact CG1-OG 3.34Å; E69-S78 WeakPolarHBondContact OE1-CB 3.42Å; D74-S78 WeakPolarHBondContact O-CB 3.42Å; D74-S78 PolarHBondContact O-N 3.38Å; D74-S78 PolarHBondContact O-OG 3.5Å; V75-S78 VanDerWaalsContact CA-OG 3.29Å; V75-S78 WeakPolarHBondContact CA-OG 3.37Å; V75-S78 PolarHBondContact O-N 3.03Å; V75-S78 PolarHBondContact O-OG 3.41Å; S78-T80 VanDerWaalsContact C-N 3.34Å; S78-T80 PolarHBondContact O-N 3.18Å; S78-T81 WeakPolarHBondContact O-CB 3.48Å; S78-T81 PolarHBondContact O-N 3.37Å; S78-V82 WeakPolarHBondContact O-CG2 3.33Å; S78-V82 PolarHBondContact O-N 2.94Å
79L95.8Very high93.9Very high43 Ų4350.4 Ų50.423%0.22526%0.258CS..Hα-helixtrans-56.5-47.7172.7-81.5154.8000111.5C27 L31 V75 T81 V82 V83C27-L79 HydrophobicContact CB-CD2 3.74Å; L31-L79 HydrophobicContact CD1-CD2 4.43Å; L31-L79 HydrophobicContact CD2-CD1 3.93Å; L31-L79 HydrophobicContact CG-CD1 4.39Å; L31-L79 HydrophobicContact CG-CD2 4.4Å; V75-L79 HydrophobicContact CG1-CD1 3.55Å; V75-L79 HydrophobicContact CG1-CG 4.47Å; V75-L79 WeakPolarHBondContact O-CB 3.36Å; V75-L79 VanDerWaalsContact O-CD1 3.31Å; V75-L79 WeakPolarHBondContact O-CD1 3.36Å; V75-L79 WeakPolarHBondContact O-CG 3.21Å; V75-L79 PolarHBondContact O-N 2.76Å; L79-T81 VanDerWaalsContact C-N 3.32Å; L79-T81 PolarHBondContact O-N 2.9Å; L79-V82 PolarHBondContact O-N 3.24Å; L79-V83 WeakPolarHBondContact O-CB 3.33Å; L79-V83 VanDerWaalsContact O-CG2 3.26Å; L79-V83 WeakPolarHBondContact O-CG2 3.28Å; L79-V83 PolarHBondContact O-N 2.88Å
80T94.5Very high93.8Very high87 Ų8751.4 Ų51.453%0.53426%0.263SS..Hα-helixtrans-61.3-43.9178.3-57.50000110.7A76 I77 S78 V83 V84A76-T80 WeakPolarHBondContact O-CB 3.37Å; A76-T80 PolarHBondContact O-N 3.48Å; A76-T80 PolarHBondContact O-OG1 2.84Å; I77-T80 PolarHBondContact O-N 2.89Å; S78-T80 VanDerWaalsContact C-N 3.34Å; S78-T80 PolarHBondContact O-N 3.18Å; T80-V83 PolarHBondContact O-N 2.94Å; T80-V84 HydrophobicContact CG2-CG2 4.24Å; T80-V84 WeakPolarHBondContact O-CB 3.47Å; T80-V84 WeakPolarHBondContact O-CG2 3.24Å; T80-V84 PolarHBondContact O-N 3.48Å
81T95.5Very high93.9Very high7 Ų753.1 Ų53.14%0.04328%0.28CS..Hα-helixtrans-60.2-48.3178.8-57.70000111.5I77 S78 L79 V84 A85 F141 L142 V145I77-T81 WeakPolarHBondContact O-CB 3.11Å; I77-T81 PolarHBondContact O-N 2.86Å; I77-T81 PolarHBondContact O-OG1 3.03Å; S78-T81 WeakPolarHBondContact O-CB 3.48Å; S78-T81 PolarHBondContact O-N 3.37Å; L79-T81 VanDerWaalsContact C-N 3.32Å; L79-T81 PolarHBondContact O-N 2.9Å; T81-V84 PolarHBondContact O-N 3.24Å; T81-A85 WeakPolarHBondContact O-CB 3.38Å; T81-A85 PolarHBondContact O-N 2.86Å; T81-F141 HydrophobicContact CG2-CD1 3.8Å; T81-F141 HydrophobicContact CG2-CE1 4.1Å; T81-L142 HydrophobicContact CG2-CB 3.96Å; T81-L142 HydrophobicContact CG2-CD1 4Å; T81-L142 WeakPolarHBondContact OG1-CD1 3.44Å; T81-V145 HydrophobicContact CG2-CB 4.15Å; T81-V145 HydrophobicContact CG2-CG2 3.86Å
82V95.8Very high93.8Very high4 Ų453.9 Ų53.92%0.02429%0.287CS..Hα-helixtrans-65.6-41.2179.9172.40000111.1V23 L26 S78 L79 A85 G86 F141V23-V82 HydrophobicContact CG1-CG1 4.12Å; L26-V82 HydrophobicContact CB-CG1 3.78Å; L26-V82 HydrophobicContact CD1-CG1 4.21Å; S78-V82 WeakPolarHBondContact O-CG2 3.33Å; S78-V82 PolarHBondContact O-N 2.94Å; L79-V82 PolarHBondContact O-N 3.24Å; V82-A85 PolarHBondContact O-N 3.46Å; V82-G86 PolarHBondContact O-N 3.47Å; V82-F141 HydrophobicContact CG2-CE1 4.3Å
83V94.8Very high93.6Very high36 Ų3651.7 Ų51.722%0.21827%0.269CS..Hα-helixtrans-66.1-41.8176.3170.30000111.7I15 L79 T80 G86 R87I15-V83 HydrophobicContact CG2-CG1 3.69Å; L79-V83 WeakPolarHBondContact O-CB 3.33Å; L79-V83 VanDerWaalsContact O-CG2 3.26Å; L79-V83 WeakPolarHBondContact O-CG2 3.28Å; L79-V83 PolarHBondContact O-N 2.88Å; T80-V83 PolarHBondContact O-N 2.94Å; V83-G86 PolarHBondContact O-N 2.99Å; V83-R87 WeakPolarHBondContact O-CB 3.39Å; V83-R87 WeakPolarHBondContact O-CG 3.29Å; V83-R87 PolarHBondContact O-N 2.87Å
84V92.8Very high93.6Very high48 Ų4843.9 Ų43.929%0.29125%0.25SC..Hα-helixtrans-64-44.7176.51690000110.6T80 T81 G86 R87 L88 L149T80-V84 HydrophobicContact CG2-CG2 4.24Å; T80-V84 WeakPolarHBondContact O-CB 3.47Å; T80-V84 WeakPolarHBondContact O-CG2 3.24Å; T80-V84 PolarHBondContact O-N 3.48Å; T81-V84 PolarHBondContact O-N 3.24Å; V84-G86 PolarHBondContact O-N 2.85Å; V84-R87 PolarHBondContact O-N 3.09Å; V84-L88 HydrophobicContact CG1-CD1 3.85Å; V84-L88 HydrophobicContact CG1-CG 4.4Å; V84-L88 WeakPolarHBondContact O-CB 3.49Å; V84-L88 PolarHBondContact O-N 2.98Å; V84-L149 HydrophobicContact CG1-CD1 4.02Å
85A94.9Very high93.6Very high1 Ų143 Ų431%0.00825%0.25CC..Hα-helixtrans-60.8-45.5175.300000111.6T81 V82 R87 L89 E90 L98 F141 V145T81-A85 WeakPolarHBondContact O-CB 3.38Å; T81-A85 PolarHBondContact O-N 2.86Å; V82-A85 PolarHBondContact O-N 3.46Å; A85-R87 VanDerWaalsContact C-N 3.28Å; A85-R87 PolarHBondContact O-N 3.1Å; A85-L89 HydrophobicContact CB-CD1 4.17Å; A85-L89 WeakPolarHBondContact O-CA 3.38Å; A85-L89 VanDerWaalsContact O-CB 3.26Å; A85-L89 WeakPolarHBondContact O-CB 3.31Å; A85-L89 PolarHBondContact O-N 3.47Å; A85-E90 PolarHBondContact O-N 3.05Å; A85-E90 VanDerWaalsContact O-N 3.12Å; A85-L98 HydrophobicContact CB-CD1 4.23Å; A85-F141 HydrophobicContact CB-CE1 4.22Å; A85-F141 HydrophobicContact CB-CZ 4.11Å; A85-V145 HydrophobicContact CB-CG1 4.32Å; A85-V145 HydrophobicContact CB-CG2 3.81Å
86G93.7Very high93.4Very high11 Ų1148.1 Ų48.111%0.11328%0.276CS..Hα-helixtrans-59.1-34.7175.500000114.3V82 V83 V84 E90V82-G86 PolarHBondContact O-N 3.47Å; V83-G86 PolarHBondContact O-N 2.99Å; V84-G86 PolarHBondContact O-N 2.85Å; G86-E90 WeakPolarHBondContact O-CB 3.38Å
87R92.1Very high93.3Very high120 Ų12048.1 Ų48.145%0.45327%0.267SS..Hα-helixtrans-86.5-38.8-177.9-76.3-175.1153-133.7-16.8114.2I15 V83 V84 A85 P91I15-R87 VanDerWaalsContact CA-NH2 3.29Å; I15-R87 VanDerWaalsContact CG2-NE 3.28Å; V83-R87 WeakPolarHBondContact O-CB 3.39Å; V83-R87 WeakPolarHBondContact O-CG 3.29Å; V83-R87 PolarHBondContact O-N 2.87Å; V84-R87 PolarHBondContact O-N 3.09Å; A85-R87 VanDerWaalsContact C-N 3.28Å; A85-R87 PolarHBondContact O-N 3.1Å; R87-P91 WeakPolarHBondContact O-CD 2.87Å; R87-P91 WeakPolarHBondContact O-CG 3.45Å
88L91.6Very high93.2Very high69 Ų6944.5 Ų44.536%0.36125%0.249SC..Hα-helixtrans-100.2-30.1-170.5-58.4-174.6000112.5V84 L92 L149 M153V84-L88 HydrophobicContact CG1-CD1 3.85Å; V84-L88 HydrophobicContact CG1-CG 4.4Å; V84-L88 WeakPolarHBondContact O-CB 3.49Å; V84-L88 PolarHBondContact O-N 2.98Å; L88-L92 WeakPolarHBondContact O-CD1 3.28Å; L88-L149 HydrophobicContact CB-CD2 3.8Å; L88-L149 HydrophobicContact CD1-CD2 3.56Å; L88-L149 HydrophobicContact CG-CD2 4.33Å; L88-M153 HydrophobicContact CB-CE 4.21Å; L88-M153 HydrophobicContact CD1-CE 4.18Å; L88-M153 HydrophobicContact CD2-CE 3.97Å; L88-M153 HydrophobicContact CG-CE 4.35Å
89L92.7Very high93.2Very high0 Ų048 Ų480%027%0.267CS..THydrogen-bonded Turntrans-104-37.1-176-53.5176.9000112.2A85 L92 W93 L98 V145 A148 L149 T152A85-L89 HydrophobicContact CB-CD1 4.17Å; A85-L89 WeakPolarHBondContact O-CA 3.38Å; A85-L89 VanDerWaalsContact O-CB 3.26Å; A85-L89 WeakPolarHBondContact O-CB 3.31Å; A85-L89 PolarHBondContact O-N 3.47Å; L89-L92 WeakPolarHBondContact O-CB 3.14Å; L89-L92 PolarHBondContact O-N 2.72Å; L89-W93 HydrophobicContact CB-CD2 4.24Å; L89-W93 HydrophobicContact CB-CE3 3.97Å; L89-W93 HydrophobicContact CB-CH2 4.33Å; L89-W93 HydrophobicContact CB-CZ3 4.02Å; L89-W93 HydrophobicContact CD1-CH2 3.87Å; L89-W93 HydrophobicContact CD1-CZ3 3.94Å; L89-W93 HydrophobicContact CD2-CH2 4.21Å; L89-W93 HydrophobicContact CD2-CZ2 4.05Å; L89-W93 HydrophobicContact CG-CH2 4.36Å; L89-W93 HydrophobicContact CG-CZ3 4.45Å; L89-W93 PolarHBondContact O-N 2.87Å; L89-L98 HydrophobicContact CB-CD1 4.29Å; L89-V145 HydrophobicContact CD1-CG1 4.31Å; L89-A148 HydrophobicContact CD1-CB 3.58Å; L89-A148 HydrophobicContact CD2-CB 3.91Å; L89-A148 HydrophobicContact CG-CB 4.42Å; L89-L149 HydrophobicContact CD2-CD2 4.19Å; L89-T152 HydrophobicContact CD2-CG2 3.93Å
90E92.2Very high93.2Very high32 Ų3248.9 Ų48.915%0.1527%0.271CS..Hα-helixtrans-58.8-42.2-179-155.6-172.3139.800114.2S20 V23 A85 G86 L92 W93 G94 A95 L98S20-E90 WeakPolarHBondContact CB-OE1 3.32Å; S20-E90 WeakPolarHBondContact CB-OE2 3.44Å; S20-E90 PolarHBondContact OG-OE1 2.83Å; S20-E90 VanDerWaalsContact OG-OE1 3.11Å; S20-E90 PolarHBondContact OG-OE2 3.35Å; V23-E90 WeakPolarHBondContact CG2-OE2 3.33Å; A85-E90 PolarHBondContact O-N 3.05Å; A85-E90 VanDerWaalsContact O-N 3.12Å; G86-E90 WeakPolarHBondContact O-CB 3.38Å; E90-L92 PolarHBondContact O-N 3.49Å; E90-W93 PolarHBondContact O-N 3.44Å; E90-G94 WeakPolarHBondContact O-CA 2.96Å; E90-G94 PolarHBondContact O-N 3.19Å; E90-A95 HydrophobicContact CG-CB 4.19Å; E90-A95 WeakPolarHBondContact OE1-CB 3.19Å; E90-L98 HydrophobicContact CB-CD2 3.89Å; E90-L98 HydrophobicContact CG-CD2 4Å
91P91.1Very high93.3Very high100 Ų10044.8 Ų44.865%0.64925%0.246SC*.Hα-helixtrans-65.7-22.8177.3-22.535.8000113.3R87R87-P91 WeakPolarHBondContact O-CD 2.87Å; R87-P91 WeakPolarHBondContact O-CG 3.45Å
92L90.1Very high93.3Very high105 Ų10545 Ų4555%0.5525%0.247SC..Hα-helixtrans-86.7-36.2-178-59177.3000112L88 L89 E90 T152L88-L92 WeakPolarHBondContact O-CD1 3.28Å; L89-L92 WeakPolarHBondContact O-CB 3.14Å; L89-L92 PolarHBondContact O-N 2.72Å; E90-L92 PolarHBondContact O-N 3.49Å; L92-T152 HydrophobicContact CD1-CG2 3.41Å; L92-T152 VanDerWaalsContact CD1-CG2 3.41Å
93W89.9Confident93.3Very high35 Ų3547.3 Ų47.313%0.13326%0.263CS..Hα-helixtrans-108.8-23.5-172.8-54.9-19.2000113.5L89 E90 E97 L98 F101 A148 L205L89-W93 HydrophobicContact CB-CD2 4.24Å; L89-W93 HydrophobicContact CB-CE3 3.97Å; L89-W93 HydrophobicContact CB-CH2 4.33Å; L89-W93 HydrophobicContact CB-CZ3 4.02Å; L89-W93 HydrophobicContact CD1-CH2 3.87Å; L89-W93 HydrophobicContact CD1-CZ3 3.94Å; L89-W93 HydrophobicContact CD2-CH2 4.21Å; L89-W93 HydrophobicContact CD2-CZ2 4.05Å; L89-W93 HydrophobicContact CG-CH2 4.36Å; L89-W93 HydrophobicContact CG-CZ3 4.45Å; L89-W93 PolarHBondContact O-N 2.87Å; E90-W93 PolarHBondContact O-N 3.44Å; W93-E97 HydrophobicContact CB-CB 3.92Å; W93-E97 WeakPolarHBondContact O-CB 3.05Å; W93-L98 HydrophobicContact CE3-CD1 4.25Å; W93-L98 HydrophobicContact CZ3-CD1 4.23Å; W93-F101 HydrophobicContact CH2-CD1 4.34Å; W93-F101 HydrophobicContact CH2-CE1 4.42Å; W93-F101 HydrophobicContact CH2-CG 4.39Å; W93-F101 HydrophobicContact CZ3-CB 4.16Å; W93-F101 AromaticContact CZ3-CD1 3.79Å; W93-F101 HydrophobicContact CZ3-CD1 3.79Å; W93-F101 HydrophobicContact CZ3-CD2 4.38Å; W93-F101 HydrophobicContact CZ3-CE1 4.27Å; W93-F101 AromaticContact CZ3-CG 3.84Å; W93-F101 HydrophobicContact CZ3-CG 3.84Å; W93-A148 HydrophobicContact CH2-CB 3.46Å; W93-A148 VanDerWaalsContact CH2-CB 3.46Å; W93-A148 HydrophobicContact CZ2-CB 3.89Å; W93-L205 HydrophobicContact CH2-CD2 3.87Å; W93-L205 HydrophobicContact CZ2-CD2 3.97Å
94G91.8Very high93.4Very high32 Ų3248.3 Ų48.333%0.3327%0.269SS..  trans85.8159.3-16500000112.9E90 L96 L98E90-G94 WeakPolarHBondContact O-CA 2.96Å; E90-G94 PolarHBondContact O-N 3.19Å; G94-L96 VanDerWaalsContact C-N 3.34Å; G94-L96 PolarHBondContact O-N 3.29Å; G94-L98 PolarHBondContact O-N 3.41Å; G94-L98 VanDerWaalsContact O-N 3.15Å
95A93.1Very high93.6Very high33 Ų3346 Ų4627%0.27326%0.255SS..Hα-helixtrans-62.6-36.6-176.500000113.7V22 E90 L99V22-A95 HydrophobicContact CG2-CB 3.96Å; E90-A95 HydrophobicContact CG-CB 4.19Å; E90-A95 WeakPolarHBondContact OE1-CB 3.19Å; A95-L99 PolarHBondContact O-N 3.29Å; A95-L99 VanDerWaalsContact O-N 3.08Å
96L93.2Very high93.7Very high117 Ų11746 Ų4661%0.61326%0.255SS*.Hα-helixtrans-68.3-49.2-178.8-170.7164.5000111G94 L98 L99 I100G94-L96 VanDerWaalsContact C-N 3.34Å; G94-L96 PolarHBondContact O-N 3.29Å; L96-L98 VanDerWaalsContact C-N 3.29Å; L96-L98 PolarHBondContact O-N 3.2Å; L96-L99 WeakPolarHBondContact O-CB 3.41Å; L96-L99 PolarHBondContact O-N 3.02Å; L96-L99 VanDerWaalsContact O-N 3.08Å; L96-I100 HydrophobicContact CD2-CD1 3.32Å; L96-I100 HydrophobicContact CD2-CG1 3.87Å; L96-I100 PolarHBondContact O-N 2.81Å
97E92.6Very high93.9Very high50 Ų5048.2 Ų48.223%0.23427%0.266CS..Hα-helixtrans-64.9-34.7179-69.8-63.7152.100111.7W93 L99 I100 F101W93-E97 HydrophobicContact CB-CB 3.92Å; W93-E97 WeakPolarHBondContact O-CB 3.05Å; E97-L99 VanDerWaalsContact C-N 3.34Å; E97-L99 PolarHBondContact O-N 3.24Å; E97-I100 PolarHBondContact O-N 3.04Å; E97-F101 VanDerWaalsContact O-CB 3.31Å; E97-F101 WeakPolarHBondContact O-CB 3.43Å; E97-F101 PolarHBondContact O-N 2.95Å
98L94.3Very high94.1Very high4 Ų443.5 Ų43.52%0.02125%0.251CS..Hα-helixtrans-61.8-41.4171.4-178.863.4000111.8A85 L89 E90 W93 G94 L96 F101 F102A85-L98 HydrophobicContact CB-CD1 4.23Å; L89-L98 HydrophobicContact CB-CD1 4.29Å; E90-L98 HydrophobicContact CB-CD2 3.89Å; E90-L98 HydrophobicContact CG-CD2 4Å; W93-L98 HydrophobicContact CE3-CD1 4.25Å; W93-L98 HydrophobicContact CZ3-CD1 4.23Å; G94-L98 PolarHBondContact O-N 3.41Å; G94-L98 VanDerWaalsContact O-N 3.15Å; L96-L98 VanDerWaalsContact C-N 3.29Å; L96-L98 PolarHBondContact O-N 3.2Å; L98-F101 PolarHBondContact O-N 2.85Å; L98-F102 WeakPolarHBondContact O-CB 3.48Å; L98-F102 PolarHBondContact O-N 3.07Å
99L95.2Very high94.3Very high74 Ų7440.2 Ų40.239%0.38723%0.234SC..Hα-helixtrans-68-39.7176.6-176.564.6000112.1V22 A95 L96 E97 F101 F102 S103V22-L99 HydrophobicContact CG1-CB 4.21Å; V22-L99 HydrophobicContact CG1-CD1 4.16Å; A95-L99 PolarHBondContact O-N 3.29Å; A95-L99 VanDerWaalsContact O-N 3.08Å; L96-L99 WeakPolarHBondContact O-CB 3.41Å; L96-L99 PolarHBondContact O-N 3.02Å; L96-L99 VanDerWaalsContact O-N 3.08Å; E97-L99 VanDerWaalsContact C-N 3.34Å; E97-L99 PolarHBondContact O-N 3.24Å; L99-F101 VanDerWaalsContact C-N 3.35Å; L99-F102 PolarHBondContact O-N 3.01Å; L99-S103 WeakPolarHBondContact O-CB 3.28Å; L99-S103 PolarHBondContact O-N 3.27Å; L99-S103 PolarHBondContact O-OG 3.38Å
100I95.4Very high94.5Very high61 Ų6140.2 Ų40.231%0.31323%0.234SC..Hα-helixtrans-60.2-48.8172.4-69.1176.1000109.4L96 E97 F102 S103 V104 Y204L96-I100 HydrophobicContact CD2-CD1 3.32Å; L96-I100 HydrophobicContact CD2-CG1 3.87Å; L96-I100 PolarHBondContact O-N 2.81Å; E97-I100 PolarHBondContact O-N 3.04Å; I100-F102 PolarHBondContact O-N 3.11Å; I100-S103 PolarHBondContact O-N 3.26Å; I100-S103 VanDerWaalsContact O-N 3.14Å; I100-V104 HydrophobicContact CG2-CG2 3.97Å; I100-V104 WeakPolarHBondContact O-CB 3.29Å; I100-V104 VanDerWaalsContact O-CG2 3.28Å; I100-V104 WeakPolarHBondContact O-CG2 3.25Å; I100-V104 PolarHBondContact O-N 3.14Å; I100-Y204 WeakPolarHBondContact CG2-OH 3.09Å
101F96Very high94.7Very high1 Ų142.9 Ų42.90%0.00425%0.249CC..Hα-helixtrans-57.6-48.7178.5175.1-105.8000111.7W93 E97 L98 L99 S103 V104 V105 F141 A148 S201 Y204 L205W93-F101 HydrophobicContact CH2-CD1 4.34Å; W93-F101 HydrophobicContact CH2-CE1 4.42Å; W93-F101 HydrophobicContact CH2-CG 4.39Å; W93-F101 HydrophobicContact CZ3-CB 4.16Å; W93-F101 AromaticContact CZ3-CD1 3.79Å; W93-F101 HydrophobicContact CZ3-CD1 3.79Å; W93-F101 HydrophobicContact CZ3-CD2 4.38Å; W93-F101 HydrophobicContact CZ3-CE1 4.27Å; W93-F101 AromaticContact CZ3-CG 3.84Å; W93-F101 HydrophobicContact CZ3-CG 3.84Å; E97-F101 VanDerWaalsContact O-CB 3.31Å; E97-F101 WeakPolarHBondContact O-CB 3.43Å; E97-F101 PolarHBondContact O-N 2.95Å; L98-F101 PolarHBondContact O-N 2.85Å; L99-F101 VanDerWaalsContact C-N 3.35Å; F101-S103 VanDerWaalsContact C-N 3.31Å; F101-S103 PolarHBondContact O-N 3.19Å; F101-V104 PolarHBondContact O-N 2.92Å; F101-V105 HydrophobicContact CD2-CG2 3.97Å; F101-V105 HydrophobicContact CE1-CG2 4.31Å; F101-V105 HydrophobicContact CE2-CG2 3.62Å; F101-V105 HydrophobicContact CG-CG2 4.47Å; F101-V105 HydrophobicContact CZ-CG2 3.81Å; F101-V105 WeakPolarHBondContact O-CB 3.5Å; F101-V105 VanDerWaalsContact O-CG2 3.29Å; F101-V105 WeakPolarHBondContact O-CG2 3.28Å; F101-V105 PolarHBondContact O-N 3.45Å; F101-F141 AromaticContact CD1-CE2 3.77Å; F101-F141 HydrophobicContact CD1-CE2 3.77Å; F101-F141 HydrophobicContact CE1-CD2 4.39Å; F101-F141 AromaticContact CE1-CE2 3.75Å; F101-F141 HydrophobicContact CE1-CE2 3.75Å; F101-A148 HydrophobicContact CZ-CB 4.39Å; F101-S201 WeakPolarHBondContact CE2-OG 3.45Å; F101-S201 VanDerWaalsContact CZ-OG 3.24Å; F101-S201 WeakPolarHBondContact CZ-OG 3.48Å; F101-Y204 HydrophobicContact CB-CE1 4.32Å; F101-Y204 AromaticContact CD2-CD1 3.57Å; F101-Y204 HydrophobicContact CD2-CD1 3.57Å; F101-Y204 AromaticContact CD2-CE1 3.74Å; F101-Y204 HydrophobicContact CD2-CE1 3.74Å; F101-Y204 HydrophobicContact CE2-CD1 4.1Å; F101-L205 HydrophobicContact CD2-CD2 4.14Å; F101-L205 HydrophobicContact CE2-CD1 4.16Å; F101-L205 HydrophobicContact CE2-CD2 3.93Å; F101-L205 HydrophobicContact CE2-CG 4.01Å
102F96.3Very high94.9Very high12 Ų1241.1 Ų41.15%0.05323%0.234CC..Hα-helixtrans-54.9-47.1174.1176.6-91.1000111.7L26 L67 L98 L99 I100 N106 F141L26-F102 HydrophobicContact CD1-CD2 4.28Å; L26-F102 HydrophobicContact CD1-CG 4.39Å; L26-F102 HydrophobicContact CD2-CD1 4.04Å; L26-F102 HydrophobicContact CD2-CE1 3.72Å; L26-F102 HydrophobicContact CD2-CE2 4.23Å; L26-F102 HydrophobicContact CD2-CG 4.44Å; L26-F102 HydrophobicContact CD2-CZ 3.84Å; L67-F102 HydrophobicContact CD2-CE1 4.25Å; L67-F102 HydrophobicContact CD2-CE2 4.36Å; L67-F102 HydrophobicContact CD2-CZ 3.53Å; L67-F102 HydrophobicContact CG-CE1 4.44Å; L67-F102 HydrophobicContact CG-CZ 3.95Å; L98-F102 WeakPolarHBondContact O-CB 3.48Å; L98-F102 PolarHBondContact O-N 3.07Å; L99-F102 PolarHBondContact O-N 3.01Å; I100-F102 PolarHBondContact O-N 3.11Å; F102-N106 WeakPolarHBondContact CD2-ND2 3.46Å; F102-N106 WeakPolarHBondContact CE1-ND2 3.37Å; F102-N106 WeakPolarHBondContact CE2-ND2 3.4Å; F102-N106 WeakPolarHBondContact CZ-ND2 3.31Å; F102-N106 WeakPolarHBondContact O-CB 3.23Å; F102-N106 PolarHBondContact O-N 3.45Å; F102-N106 PolarHBondContact O-ND2 2.85Å; F102-F141 HydrophobicContact CB-CD2 4.39Å; F102-F141 HydrophobicContact CB-CE2 3.87Å; F102-F141 HydrophobicContact CB-CZ 4.34Å; F102-F141 AromaticContact CD2-CD1 3.93Å; F102-F141 HydrophobicContact CD2-CD1 3.93Å; F102-F141 AromaticContact CD2-CD2 3.64Å; F102-F141 HydrophobicContact CD2-CD2 3.64Å; F102-F141 AromaticContact CD2-CE1 3.93Å; F102-F141 HydrophobicContact CD2-CE1 3.93Å; F102-F141 AromaticContact CD2-CE2 3.64Å; F102-F141 HydrophobicContact CD2-CE2 3.64Å; F102-F141 AromaticContact CD2-CG 3.79Å; F102-F141 HydrophobicContact CD2-CG 3.79Å; F102-F141 AromaticContact CD2-CZ 3.78Å; F102-F141 HydrophobicContact CD2-CZ 3.78Å; F102-F141 HydrophobicContact CE2-CD1 4.15Å; F102-F141 HydrophobicContact CE2-CD2 4.37Å; F102-F141 HydrophobicContact CE2-CE1 4.46Å; F102-F141 HydrophobicContact CE2-CG 4.1Å; F102-F141 HydrophobicContact CG-CD2 4.4Å; F102-F141 HydrophobicContact CG-CE2 4.23Å
103S96.1Very high95.2Very high53 Ų5336.1 Ų36.137%0.37121%0.208SC..Hα-helixtrans-66.9-46.4-177.7-54.90000111.8L99 I100 F101 V107L99-S103 WeakPolarHBondContact O-CB 3.28Å; L99-S103 PolarHBondContact O-N 3.27Å; L99-S103 PolarHBondContact O-OG 3.38Å; I100-S103 PolarHBondContact O-N 3.26Å; I100-S103 VanDerWaalsContact O-N 3.14Å; F101-S103 VanDerWaalsContact C-N 3.31Å; F101-S103 PolarHBondContact O-N 3.19Å; S103-V107 VanDerWaalsContact O-CB 3.31Å; S103-V107 WeakPolarHBondContact O-CB 3.44Å; S103-V107 WeakPolarHBondContact O-CG2 3.4Å; S103-V107 PolarHBondContact O-N 2.93Å
104V96.3Very high95.5Very high56 Ų5634.5 Ų34.534%0.33920%0.202SC..Hα-helixtrans-63.3-47.1-179.8171.20000110.8I100 F101 S108 Y204I100-V104 HydrophobicContact CG2-CG2 3.97Å; I100-V104 WeakPolarHBondContact O-CB 3.29Å; I100-V104 VanDerWaalsContact O-CG2 3.28Å; I100-V104 WeakPolarHBondContact O-CG2 3.25Å; I100-V104 PolarHBondContact O-N 3.14Å; F101-V104 PolarHBondContact O-N 2.92Å; V104-S108 WeakPolarHBondContact O-CB 3.43Å; V104-S108 PolarHBondContact O-N 3.37Å; V104-S108 PolarHBondContact O-OG 3.01Å; V104-S108 VanDerWaalsContact O-OG 3.05Å; V104-Y204 HydrophobicContact CB-CD2 4.35Å; V104-Y204 HydrophobicContact CB-CE2 4.36Å; V104-Y204 HydrophobicContact CG1-CD2 3.66Å; V104-Y204 HydrophobicContact CG1-CE2 4.1Å; V104-Y204 HydrophobicContact CG1-CG 4.24Å; V104-Y204 HydrophobicContact CG2-CE2 4.12Å
105V97.3Very high95.7Very high0 Ų038.3 Ų38.30%021%0.21CC..Hα-helixtrans-62.2-51.3179.3173.40000110F101 S108 V109F101-V105 HydrophobicContact CD2-CG2 3.97Å; F101-V105 HydrophobicContact CE1-CG2 4.31Å; F101-V105 HydrophobicContact CE2-CG2 3.62Å; F101-V105 HydrophobicContact CG-CG2 4.47Å; F101-V105 HydrophobicContact CZ-CG2 3.81Å; F101-V105 WeakPolarHBondContact O-CB 3.5Å; F101-V105 VanDerWaalsContact O-CG2 3.29Å; F101-V105 WeakPolarHBondContact O-CG2 3.28Å; F101-V105 PolarHBondContact O-N 3.45Å; V105-S108 PolarHBondContact O-N 2.89Å; V105-S108 PolarHBondContact O-OG 3.34Å; V105-V109 HydrophobicContact CG1-CG2 4.3Å; V105-V109 WeakPolarHBondContact O-CB 3.42Å; V105-V109 VanDerWaalsContact O-CG2 3.25Å; V105-V109 WeakPolarHBondContact O-CG2 3.15Å; V105-V109 PolarHBondContact O-N 3.11Å
106N97Very high95.8Very high2 Ų238 Ų381%0.01121%0.207CC..Hα-helixtrans-62.6-49.2-179.2-75.4-60.2000112.3H65 G66 F102 S108 V109 G110H65-N106 PolarHBondContact CE1-O 2.89Å; G66-N106 WeakPolarHBondContact CA-OD1 3.42Å; F102-N106 WeakPolarHBondContact CD2-ND2 3.46Å; F102-N106 WeakPolarHBondContact CE1-ND2 3.37Å; F102-N106 WeakPolarHBondContact CE2-ND2 3.4Å; F102-N106 WeakPolarHBondContact CZ-ND2 3.31Å; F102-N106 WeakPolarHBondContact O-CB 3.23Å; F102-N106 PolarHBondContact O-N 3.45Å; F102-N106 PolarHBondContact O-ND2 2.85Å; N106-S108 VanDerWaalsContact C-N 3.25Å; N106-S108 PolarHBondContact O-N 3.5Å; N106-V109 PolarHBondContact O-N 3.36Å; N106-V109 VanDerWaalsContact O-N 3.09Å; N106-G110 PolarHBondContact O-N 3.08Å
107V96.9Very high95.9Very high57 Ų5732.9 Ų32.935%0.34518%0.179SC..Hα-helixtrans-58.1-41.8178.5170.40000111L62 S103 G110 L111L62-V107 HydrophobicContact CB-CG1 4.47Å; L62-V107 HydrophobicContact CB-CG2 4.45Å; S103-V107 VanDerWaalsContact O-CB 3.31Å; S103-V107 WeakPolarHBondContact O-CB 3.44Å; S103-V107 WeakPolarHBondContact O-CG2 3.4Å; S103-V107 PolarHBondContact O-N 2.93Å; V107-G110 PolarHBondContact O-N 3.4Å; V107-L111 WeakPolarHBondContact O-CB 3.33Å; V107-L111 PolarHBondContact O-N 3.4Å
108S96.5Very high96Very high20 Ų2032.2 Ų32.214%0.1418%0.177CC..Hα-helixtrans-66.4-39.917773.80000112.5V104 V105 N106 L111 L112 S200V104-S108 WeakPolarHBondContact O-CB 3.43Å; V104-S108 PolarHBondContact O-N 3.37Å; V104-S108 PolarHBondContact O-OG 3.01Å; V104-S108 VanDerWaalsContact O-OG 3.05Å; V105-S108 PolarHBondContact O-N 2.89Å; V105-S108 PolarHBondContact O-OG 3.34Å; N106-S108 VanDerWaalsContact C-N 3.25Å; N106-S108 PolarHBondContact O-N 3.5Å; S108-L111 PolarHBondContact O-N 3.38Å; S108-L112 VanDerWaalsContact O-CB 3.28Å; S108-L112 WeakPolarHBondContact O-CB 3.43Å; S108-L112 WeakPolarHBondContact O-CD1 3.35Å; S108-L112 PolarHBondContact O-N 3.15Å; S108-S200 WeakPolarHBondContact OG-CB 3.48Å; S108-S200 PolarHBondContact OG-OG 2.83Å; S108-S200 VanDerWaalsContact OG-OG 3.1Å
109V97.7Very high96Very high1 Ų136.5 Ų36.51%0.00620%0.2CC..Hα-helixtrans-61.9-46175.5168.40000110.9V105 N106 G113 F196V105-V109 HydrophobicContact CG1-CG2 4.3Å; V105-V109 WeakPolarHBondContact O-CB 3.42Å; V105-V109 VanDerWaalsContact O-CG2 3.25Å; V105-V109 WeakPolarHBondContact O-CG2 3.15Å; V105-V109 PolarHBondContact O-N 3.11Å; N106-V109 PolarHBondContact O-N 3.36Å; N106-V109 VanDerWaalsContact O-N 3.09Å; V109-G113 WeakPolarHBondContact O-CA 3.32Å; V109-G113 PolarHBondContact O-N 3.2Å; V109-F196 HydrophobicContact CG2-CB 4.36Å
110G96Very high96Very high0 Ų035.5 Ų35.50%020%0.197CC..Hα-helixtrans-60.9-45.9176.400000112N106 V107 A114N106-G110 PolarHBondContact O-N 3.08Å; V107-G110 PolarHBondContact O-N 3.4Å; G110-A114 WeakPolarHBondContact O-CB 3.49Å; G110-A114 PolarHBondContact O-N 2.9Å
111L96Very high95.9Very high88 Ų8835.1 Ų35.146%0.46119%0.192SC..Hα-helixtrans-69.9-51.2-177.9-177.863.3000112.5L62 V107 S108 G113 A114 F115L62-L111 HydrophobicContact CD2-CB 4.47Å; V107-L111 WeakPolarHBondContact O-CB 3.33Å; V107-L111 PolarHBondContact O-N 3.4Å; S108-L111 PolarHBondContact O-N 3.38Å; L111-G113 VanDerWaalsContact C-N 3.32Å; L111-G113 PolarHBondContact O-N 3.08Å; L111-A114 PolarHBondContact O-N 3.43Å; L111-F115 WeakPolarHBondContact O-CB 3.46Å; L111-F115 PolarHBondContact O-N 3.45Å
112L96.5Very high95.9Very high62 Ų6240 Ų4033%0.32522%0.216SC..Hα-helixtrans-66.1-38.2179.3-84.171.4000110.7S108 F115 A116 F196S108-L112 VanDerWaalsContact O-CB 3.28Å; S108-L112 WeakPolarHBondContact O-CB 3.43Å; S108-L112 WeakPolarHBondContact O-CD1 3.35Å; S108-L112 PolarHBondContact O-N 3.15Å; L112-F115 PolarHBondContact O-N 3.34Å; L112-A116 VanDerWaalsContact O-CB 3.26Å; L112-A116 WeakPolarHBondContact O-CB 3.37Å; L112-A116 PolarHBondContact O-N 2.97Å; L112-F196 HydrophobicContact CB-CB 4.37Å; L112-F196 HydrophobicContact CB-CD1 3.89Å; L112-F196 HydrophobicContact CB-CD2 4.34Å; L112-F196 HydrophobicContact CB-CE1 4.26Å; L112-F196 HydrophobicContact CB-CG 3.95Å; L112-F196 HydrophobicContact CD2-CD1 3.85Å; L112-F196 HydrophobicContact CD2-CE1 4.41Å
113G96.3Very high95.8Very high1 Ų143.5 Ų43.51%0.0125%0.247CC..Hα-helixtrans-62.6-49.6174.700000112.2V109 L111 F115 A116 Y117V109-G113 WeakPolarHBondContact O-CA 3.32Å; V109-G113 PolarHBondContact O-N 3.2Å; L111-G113 VanDerWaalsContact C-N 3.32Å; L111-G113 PolarHBondContact O-N 3.08Å; G113-F115 VanDerWaalsContact C-N 3.32Å; G113-F115 PolarHBondContact O-N 2.69Å; G113-A116 PolarHBondContact O-N 3.23Å; G113-Y117 VanDerWaalsContact O-CD2 3.23Å; G113-Y117 WeakPolarHBondContact O-CD2 3.1Å; G113-Y117 PolarHBondContact O-N 2.53Å
114A95.2Very high95.8Very high0 Ų043.5 Ų43.50%025%0.247CC..Hα-helixtrans-60.5-42.3176.200000112V47 P49 L52 G110 L111 Y117 L118V47-A114 HydrophobicContact CG1-CB 4.09Å; P49-A114 HydrophobicContact CB-CB 4.31Å; L52-A114 HydrophobicContact CD2-CB 3.43Å; L52-A114 VanDerWaalsContact CD2-CB 3.43Å; G110-A114 WeakPolarHBondContact O-CB 3.49Å; G110-A114 PolarHBondContact O-N 2.9Å; L111-A114 PolarHBondContact O-N 3.43Å; A114-Y117 PolarHBondContact O-N 2.83Å; A114-L118 WeakPolarHBondContact O-CB 3.33Å; A114-L118 PolarHBondContact O-N 3.38Å
115F95.2Very high95.6Very high113 Ų11348.3 Ų48.350%0.49626%0.264SS..Hα-helixtrans-64.6-41.8176.2-173.7-109.9000112.4L111 L112 G113 Y117 L118 L119L111-F115 WeakPolarHBondContact O-CB 3.46Å; L111-F115 PolarHBondContact O-N 3.45Å; L112-F115 PolarHBondContact O-N 3.34Å; G113-F115 VanDerWaalsContact C-N 3.32Å; G113-F115 PolarHBondContact O-N 2.69Å; F115-Y117 PolarHBondContact O-N 2.84Å; F115-L118 HydrophobicContact CD2-CD2 4.44Å; F115-L118 WeakPolarHBondContact O-CB 2.82Å; F115-L118 PolarHBondContact O-N 3.29Å; F115-L119 HydrophobicContact CD1-CD1 4.02Å; F115-L119 HydrophobicContact CD1-CG 4.45Å; F115-L119 HydrophobicContact CE1-CD1 3.59Å; F115-L119 HydrophobicContact CE1-CG 4.13Å; F115-L119 HydrophobicContact CZ-CD1 4.07Å; F115-L119 HydrophobicContact CZ-CD2 4.19Å; F115-L119 HydrophobicContact CZ-CG 4.21Å; F115-L119 WeakPolarHBondContact O-CG 3.27Å; F115-L119 PolarHBondContact O-N 3.47Å
116A95.5Very high95.4Very high26 Ų2651.9 Ų51.922%0.21528%0.283CS..Hα-helixtrans-63.7-40.5177.200000112.4L112 G113 L119 T120 F196L112-A116 VanDerWaalsContact O-CB 3.26Å; L112-A116 WeakPolarHBondContact O-CB 3.37Å; L112-A116 PolarHBondContact O-N 2.97Å; G113-A116 PolarHBondContact O-N 3.23Å; A116-L119 PolarHBondContact O-N 2.94Å; A116-T120 PolarHBondContact O-N 3.39Å; A116-T120 PolarHBondContact O-OG1 3.01Å; A116-F196 HydrophobicContact CB-CE2 3.71Å; A116-F196 HydrophobicContact CB-CZ 3.58Å
117Y95.3Very high95.3Very high9 Ų956.4 Ų56.44%0.03531%0.307CS..Hα-helixtrans-71.9-31.4174.7-78.6-62.9000113P49 G113 A114 F115 T120 Y121 Y129 V133 I135 S188 P189 A192P49-Y117 HydrophobicContact CG-CD2 4.17Å; P49-Y117 HydrophobicContact CG-CG 4.17Å; G113-Y117 VanDerWaalsContact O-CD2 3.23Å; G113-Y117 WeakPolarHBondContact O-CD2 3.1Å; G113-Y117 PolarHBondContact O-N 2.53Å; A114-Y117 PolarHBondContact O-N 2.83Å; F115-Y117 PolarHBondContact O-N 2.84Å; Y117-T120 PolarHBondContact O-N 3.44Å; Y117-Y121 WeakPolarHBondContact O-CB 3.41Å; Y117-Y121 PolarHBondContact O-N 2.72Å; Y117-Y129 AromaticContact CD1-CD1 3.95Å; Y117-Y129 HydrophobicContact CD1-CD1 3.95Å; Y117-Y129 HydrophobicContact CE1-CD1 4.19Å; Y117-V133 HydrophobicContact CD1-CG1 4.22Å; Y117-V133 HydrophobicContact CD2-CG1 4.06Å; Y117-V133 HydrophobicContact CE1-CG1 3.92Å; Y117-V133 HydrophobicContact CE1-CG2 4.43Å; Y117-V133 HydrophobicContact CE2-CG1 3.74Å; Y117-V133 HydrophobicContact CG-CG1 4.3Å; Y117-I135 HydrophobicContact CD2-CD1 3.93Å; Y117-I135 HydrophobicContact CD2-CG1 4.32Å; Y117-I135 HydrophobicContact CE2-CD1 4Å; Y117-I135 HydrophobicContact CE2-CG1 4.08Å; Y117-S188 WeakPolarHBondContact OH-CB 3.01Å; Y117-S188 PolarHBondContact OH-O 3.11Å; Y117-S188 PolarHBondContact OH-OG 3.2Å; Y117-P189 HydrophobicContact CE2-CB 4.4Å; Y117-P189 WeakPolarHBondContact OH-CA 3.38Å; Y117-A192 HydrophobicContact CE2-CB 4.38Å
118L94.3Very high95.1Very high37 Ų3757 Ų5719%0.19431%0.31CS..Hα-helixtrans-60.7-47.3168.9178.867.1000111F53 A114 F115 T120 Y121 M122 L130F53-L118 HydrophobicContact CD2-CD2 4.47Å; F53-L118 HydrophobicContact CE1-CD2 4.36Å; F53-L118 HydrophobicContact CE2-CB 4.06Å; F53-L118 HydrophobicContact CE2-CD1 4.42Å; F53-L118 HydrophobicContact CE2-CD2 3.85Å; F53-L118 HydrophobicContact CE2-CG 4.33Å; F53-L118 HydrophobicContact CZ-CB 4.46Å; F53-L118 HydrophobicContact CZ-CD2 3.79Å; A114-L118 WeakPolarHBondContact O-CB 3.33Å; A114-L118 PolarHBondContact O-N 3.38Å; F115-L118 HydrophobicContact CD2-CD2 4.44Å; F115-L118 WeakPolarHBondContact O-CB 2.82Å; F115-L118 PolarHBondContact O-N 3.29Å; L118-T120 VanDerWaalsContact C-N 3.32Å; L118-T120 PolarHBondContact O-N 2.87Å; L118-Y121 HydrophobicContact CD1-CD1 4.42Å; L118-Y121 WeakPolarHBondContact O-CB 3.26Å; L118-Y121 PolarHBondContact O-N 3.45Å; L118-M122 HydrophobicContact CD1-CE 3.91Å; L118-M122 VanDerWaalsContact O-CG 3.32Å; L118-M122 WeakPolarHBondContact O-CG 3.34Å; L118-M122 PolarHBondContact O-N 3.19Å; L118-L130 HydrophobicContact CD1-CD2 4.02Å
119L95.3Very high94.9Very high93 Ų9359.6 Ų59.649%0.48732%0.317SS..Hα-helixtrans-62.8-39.3176-67.7177.7000112.1F115 A116 Y121 M122 A123F115-L119 HydrophobicContact CD1-CD1 4.02Å; F115-L119 HydrophobicContact CD1-CG 4.45Å; F115-L119 HydrophobicContact CE1-CD1 3.59Å; F115-L119 HydrophobicContact CE1-CG 4.13Å; F115-L119 HydrophobicContact CZ-CD1 4.07Å; F115-L119 HydrophobicContact CZ-CD2 4.19Å; F115-L119 HydrophobicContact CZ-CG 4.21Å; F115-L119 WeakPolarHBondContact O-CG 3.27Å; F115-L119 PolarHBondContact O-N 3.47Å; A116-L119 PolarHBondContact O-N 2.94Å; L119-Y121 VanDerWaalsContact C-N 3.32Å; L119-Y121 PolarHBondContact O-N 3.38Å; L119-M122 PolarHBondContact O-N 3.24Å; L119-A123 PolarHBondContact O-N 3.49Å
120T94.5Very high94.7Very high54 Ų5460.2 Ų60.233%0.33132%0.32SS..Hα-helixtrans-63.7-40.2175.9-54.20000111.2A116 Y117 L118 A123 S124 Y129A116-T120 PolarHBondContact O-N 3.39Å; A116-T120 PolarHBondContact O-OG1 3.01Å; Y117-T120 PolarHBondContact O-N 3.44Å; L118-T120 VanDerWaalsContact C-N 3.32Å; L118-T120 PolarHBondContact O-N 2.87Å; T120-A123 PolarHBondContact O-N 3.06Å; T120-S124 WeakPolarHBondContact O-CB 3.11Å; T120-S124 PolarHBondContact O-N 3.4Å; T120-S124 PolarHBondContact O-OG 3.36Å; T120-Y129 HydrophobicContact CG2-CD1 3.97Å; T120-Y129 HydrophobicContact CG2-CD2 4Å; T120-Y129 HydrophobicContact CG2-CE1 3.93Å; T120-Y129 HydrophobicContact CG2-CE2 3.96Å; T120-Y129 HydrophobicContact CG2-CG 4Å
121Y94.7Very high94.6Very high52 Ų5264.5 Ų64.520%0.20434%0.339CS..Hα-helixtrans-61.3-47.9171.5162.3-102.1000111.5Y117 L118 L119 A123 S124 F125 N126 L127 L130Y117-Y121 WeakPolarHBondContact O-CB 3.41Å; Y117-Y121 PolarHBondContact O-N 2.72Å; L118-Y121 HydrophobicContact CD1-CD1 4.42Å; L118-Y121 WeakPolarHBondContact O-CB 3.26Å; L118-Y121 PolarHBondContact O-N 3.45Å; L119-Y121 VanDerWaalsContact C-N 3.32Å; L119-Y121 PolarHBondContact O-N 3.38Å; Y121-A123 PolarHBondContact O-N 2.85Å; Y121-S124 PolarHBondContact O-N 3.5Å; Y121-F125 VanDerWaalsContact O-CA 3.25Å; Y121-F125 WeakPolarHBondContact O-CA 3.31Å; Y121-F125 PolarHBondContact O-N 2.93Å; Y121-N126 WeakPolarHBondContact CD2-O 3.39Å; Y121-L127 HydrophobicContact CE2-CD2 3.7Å; Y121-L127 HydrophobicContact CE2-CG 4.43Å; Y121-L130 HydrophobicContact CD1-CD1 3.53Å; Y121-L130 HydrophobicContact CD1-CD2 4.36Å; Y121-L130 HydrophobicContact CD1-CG 4.03Å; Y121-L130 HydrophobicContact CD2-CD1 3.77Å; Y121-L130 HydrophobicContact CD2-CG 3.94Å; Y121-L130 HydrophobicContact CE1-CD1 3.69Å; Y121-L130 HydrophobicContact CE2-CD1 3.95Å; Y121-L130 HydrophobicContact CG-CD1 3.54Å; Y121-L130 HydrophobicContact CG-CD2 4.18Å; Y121-L130 HydrophobicContact CG-CG 3.62Å
122M94.6Very high94.4Very high103 Ų10364.4 Ų64.451%0.50734%0.342SS..Hα-helixtrans-60.5-31.3179.2-67-64.6177.900112.5L118 L119 F125L118-M122 HydrophobicContact CD1-CE 3.91Å; L118-M122 VanDerWaalsContact O-CG 3.32Å; L118-M122 WeakPolarHBondContact O-CG 3.34Å; L118-M122 PolarHBondContact O-N 3.19Å; L119-M122 PolarHBondContact O-N 3.24Å; M122-F125 WeakPolarHBondContact O-CE2 3.41Å
123A95.8Very high94.2Very high86 Ų8662.4 Ų62.471%0.71133%0.333SS*.Hα-helixtrans-80.7-33.9177.100000113.7L119 T120 Y121L119-A123 PolarHBondContact O-N 3.49Å; T120-A123 PolarHBondContact O-N 3.06Å; Y121-A123 PolarHBondContact O-N 2.85Å
124S94.4Very high94.1Very high53 Ų5367.6 Ų67.637%0.37135%0.352SS..Hα-helixtrans-103.7-13.9-173.261.50000114.5T120 Y121 N126 Y129T120-S124 WeakPolarHBondContact O-CB 3.11Å; T120-S124 PolarHBondContact O-N 3.4Å; T120-S124 PolarHBondContact O-OG 3.36Å; Y121-S124 PolarHBondContact O-N 3.5Å; S124-N126 PolarHBondContact O-N 2.84Å; S124-N126 PolarHBondContact OG-N 3.44Å; S124-Y129 VanDerWaalsContact OG-CD2 3.28Å; S124-Y129 WeakPolarHBondContact OG-CD2 3.34Å; S124-Y129 VanDerWaalsContact OG-CE2 3.27Å; S124-Y129 WeakPolarHBondContact OG-CE2 3.16Å
125F93.4Very high94Very high158 Ų15867.7 Ų67.769%0.69335%0.352SS*.  trans50.123-169.9-65.2-82.6000114.6Y121 M122Y121-F125 VanDerWaalsContact O-CA 3.25Å; Y121-F125 WeakPolarHBondContact O-CA 3.31Å; Y121-F125 PolarHBondContact O-N 2.93Å; M122-F125 WeakPolarHBondContact O-CE2 3.41Å
126N93.5Very high94Very high74 Ų7463.6 Ų63.640%0.39634%0.335SS..  trans-100113.6-177.4-169.9-20.7000111.7Y121 S124 V128 Y129Y121-N126 WeakPolarHBondContact CD2-O 3.39Å; S124-N126 PolarHBondContact O-N 2.84Å; S124-N126 PolarHBondContact OG-N 3.44Å; N126-V128 PolarHBondContact O-N 3.45Å; N126-V128 VanDerWaalsContact O-N 3.08Å; N126-V128 VanDerWaalsContact OD1-CB 3.31Å; N126-V128 WeakPolarHBondContact OD1-CB 3.24Å; N126-V128 WeakPolarHBondContact OD1-CG2 3.38Å; N126-V128 PolarHBondContact OD1-N 3.3Å; N126-Y129 HydrophobicContact CB-CD2 4Å; N126-Y129 HydrophobicContact CB-CE2 4.04Å; N126-Y129 WeakPolarHBondContact O-CD2 3.28Å; N126-Y129 PolarHBondContact O-N 2.84Å
127L93.3Very high93.9Very high98 Ų9862.5 Ų62.551%0.51333%0.326SS..THydrogen-bonded Turntrans-60.5-18.5-178.2-64.7172.7000114.1Y121 Y129 L130 F131Y121-L127 HydrophobicContact CE2-CD2 3.7Å; Y121-L127 HydrophobicContact CE2-CG 4.43Å; L127-Y129 PolarHBondContact O-N 2.89Å; L127-L130 PolarHBondContact O-N 3.18Å; L127-F131 HydrophobicContact CB-CD2 4.32Å; L127-F131 HydrophobicContact CD2-CD2 4.38Å; L127-F131 HydrophobicContact CD2-CE2 4.09Å; L127-F131 PolarHBondContact O-N 2.83Å
128V94Very high93.8Very high68 Ų6862.2 Ų62.241%0.41233%0.326SS..Hα-helixtrans-55-38.6175.6171.80000111.3N126 L130 T132 V133N126-V128 PolarHBondContact O-N 3.45Å; N126-V128 VanDerWaalsContact O-N 3.08Å; N126-V128 VanDerWaalsContact OD1-CB 3.31Å; N126-V128 WeakPolarHBondContact OD1-CB 3.24Å; N126-V128 WeakPolarHBondContact OD1-CG2 3.38Å; N126-V128 PolarHBondContact OD1-N 3.3Å; V128-L130 VanDerWaalsContact C-N 3.27Å; V128-L130 PolarHBondContact O-N 3.43Å; V128-T132 HydrophobicContact CG1-CG2 4.38Å; V128-T132 WeakPolarHBondContact O-CA 3.33Å; V128-T132 VanDerWaalsContact O-CB 3.27Å; V128-T132 WeakPolarHBondContact O-CB 3.39Å; V128-T132 PolarHBondContact O-N 3.37Å; V128-V133 PolarHBondContact O-N 3.03Å
129Y92.6Very high93.8Very high75 Ų7562.2 Ų62.229%0.29433%0.326SS..Hα-helixtrans-69-24.1-180-64.6-66.2000113.8Y117 T120 S124 N126 L127 V133Y117-Y129 AromaticContact CD1-CD1 3.95Å; Y117-Y129 HydrophobicContact CD1-CD1 3.95Å; Y117-Y129 HydrophobicContact CE1-CD1 4.19Å; T120-Y129 HydrophobicContact CG2-CD1 3.97Å; T120-Y129 HydrophobicContact CG2-CD2 4Å; T120-Y129 HydrophobicContact CG2-CE1 3.93Å; T120-Y129 HydrophobicContact CG2-CE2 3.96Å; T120-Y129 HydrophobicContact CG2-CG 4Å; S124-Y129 VanDerWaalsContact OG-CD2 3.28Å; S124-Y129 WeakPolarHBondContact OG-CD2 3.34Å; S124-Y129 VanDerWaalsContact OG-CE2 3.27Å; S124-Y129 WeakPolarHBondContact OG-CE2 3.16Å; N126-Y129 HydrophobicContact CB-CD2 4Å; N126-Y129 HydrophobicContact CB-CE2 4.04Å; N126-Y129 WeakPolarHBondContact O-CD2 3.28Å; N126-Y129 PolarHBondContact O-N 2.84Å; L127-Y129 PolarHBondContact O-N 2.89Å; Y129-V133 HydrophobicContact CD1-CG2 4.21Å
130L92.3Very high93.9Very high14 Ų1457.8 Ų57.87%0.07330%0.302CS..Hα-helixtrans-91.1-43.9179-70.3-176.7000112.8T48 P49 G50 L118 Y121 L127 V128T48-L130 WeakPolarHBondContact CG2-O 3.42Å; P49-L130 HydrophobicContact CB-CD2 4.17Å; G50-L130 WeakPolarHBondContact CA-O 3Å; G50-L130 PolarHBondContact N-O 3.22Å; L118-L130 HydrophobicContact CD1-CD2 4.02Å; Y121-L130 HydrophobicContact CD1-CD1 3.53Å; Y121-L130 HydrophobicContact CD1-CD2 4.36Å; Y121-L130 HydrophobicContact CD1-CG 4.03Å; Y121-L130 HydrophobicContact CD2-CD1 3.77Å; Y121-L130 HydrophobicContact CD2-CG 3.94Å; Y121-L130 HydrophobicContact CE1-CD1 3.69Å; Y121-L130 HydrophobicContact CE2-CD1 3.95Å; Y121-L130 HydrophobicContact CG-CD1 3.54Å; Y121-L130 HydrophobicContact CG-CD2 4.18Å; Y121-L130 HydrophobicContact CG-CG 3.62Å; L127-L130 PolarHBondContact O-N 3.18Å; V128-L130 VanDerWaalsContact C-N 3.27Å; V128-L130 PolarHBondContact O-N 3.43Å
131F93Very high94Very high90 Ų9055.3 Ų55.340%0.39529%0.287SS..Hα-helixtrans-112.6-13.4-166.4-61.6-69.4000114.5Y51 L127Y51-F131 HydrophobicContact CD1-CD1 4.48Å; Y51-F131 HydrophobicContact CD1-CE1 4.39Å; Y51-F131 AromaticContact CE1-CD1 3.96Å; Y51-F131 HydrophobicContact CE1-CD1 3.96Å; Y51-F131 HydrophobicContact CE1-CE1 4.06Å; Y51-F131 HydrophobicContact CE2-CD1 4.45Å; Y51-F131 AromaticContact CZ-CD1 3.92Å; L127-F131 HydrophobicContact CB-CD2 4.32Å; L127-F131 HydrophobicContact CD2-CD2 4.38Å; L127-F131 HydrophobicContact CD2-CE2 4.09Å; L127-F131 PolarHBondContact O-N 2.83Å
132T92Very high94.1Very high86 Ų8654.1 Ų54.153%0.52828%0.284SS..THydrogen-bonded Turntrans-108.9-36.5-179.4-47.40000112.2V128 R134V128-T132 HydrophobicContact CG1-CG2 4.38Å; V128-T132 WeakPolarHBondContact O-CA 3.33Å; V128-T132 VanDerWaalsContact O-CB 3.27Å; V128-T132 WeakPolarHBondContact O-CB 3.39Å; V128-T132 PolarHBondContact O-N 3.37Å; T132-R134 PolarHBondContact O-N 2.83Å
133V93.3Very high94.2Very high21 Ų2149.2 Ų49.213%0.12726%0.26CS..  trans-69.6123.2176.6176.80000109.9P49 Y117 V128 Y129 P189P49-V133 VanDerWaalsContact CD-O 3.22Å; P49-V133 WeakPolarHBondContact CD-O 3.4Å; Y117-V133 HydrophobicContact CD1-CG1 4.22Å; Y117-V133 HydrophobicContact CD2-CG1 4.06Å; Y117-V133 HydrophobicContact CE1-CG1 3.92Å; Y117-V133 HydrophobicContact CE1-CG2 4.43Å; Y117-V133 HydrophobicContact CE2-CG1 3.74Å; Y117-V133 HydrophobicContact CG-CG1 4.3Å; V128-V133 PolarHBondContact O-N 3.03Å; Y129-V133 HydrophobicContact CD1-CG2 4.21Å; V133-P189 HydrophobicContact CG1-CB 4.16Å; V133-P189 HydrophobicContact CG1-CG 4.23Å
134R93.5Very high94.2Very high110 Ų11045.1 Ų45.142%0.41523%0.226SC..  trans-116.2126.2175.5-67.4-176-68.7-1102109.4A46 T132A46-R134 HydrophobicContact CB-CB 4.1Å; A46-R134 HydrophobicContact CB-CG 4.5Å; T132-R134 PolarHBondContact O-N 2.83Å
135I94.2Very high94.3Very high1 Ų142.7 Ų42.71%0.00521%0.209CC..BIsolated β-bridgetrans-94.8121.1171.6-51.9173.4000107.3V47 H65 Y117 P189V47-I135 HydrophobicContact CB-CB 4.21Å; V47-I135 PolarHBondContact N-O 3.5Å; V47-I135 PolarHBondContact O-N 3.44Å; H65-I135 WeakPolarHBondContact CB-O 3.35Å; Y117-I135 HydrophobicContact CD2-CD1 3.93Å; Y117-I135 HydrophobicContact CD2-CG1 4.32Å; Y117-I135 HydrophobicContact CE2-CD1 4Å; Y117-I135 HydrophobicContact CE2-CG1 4.08Å; I135-P189 HydrophobicContact CG1-CB 4.13Å
136H93.9Very high94.4Very high28 Ų2836.1 Ų36.113%0.1318%0.181CC..  trans-150.4169.3174.964.383.6000109.9A46 H65 M68 Q70A46-H136 HydrophobicContact CB-CB 4.05Å; H65-H136 WeakPolarHBondContact O-CA 3.41Å; M68-H136 HydrophobicContact CB-CB 4.37Å; M68-H136 HydrophobicContact CG-CB 4.49Å; M68-H136 PolarHBondContact O-ND1 2.92Å; Q70-H136 VanDerWaalsContact CD-CE1 3.47Å; Q70-H136 PolarHBondContact OE1-NE2 3.29Å
137G93.4Very high94.4Very high3 Ų332.6 Ų32.63%0.03116%0.162CC..SBendtrans94.8157175.500000114.1H65 M68 E69 L139H65-G137 PolarHBondContact O-N 2.95Å; M68-G137 VanDerWaalsContact O-CA 3.24Å; M68-G137 WeakPolarHBondContact O-CA 3.33Å; M68-G137 PolarHBondContact O-N 3.27Å; E69-G137 VanDerWaalsContact CD-CA 3.46Å; E69-G137 VanDerWaalsContact OE1-CA 3.28Å; E69-G137 WeakPolarHBondContact OE1-CA 3.49Å; E69-G137 WeakPolarHBondContact OE2-CA 3.37Å; G137-L139 PolarHBondContact O-N 3.49Å
138A94Very high94.4Very high3 Ų327.9 Ų27.93%0.02514%0.138CC..THydrogen-bonded Turntrans-80.210.7-178.800000112.7G66 E69 G140 F141 L142G66-A138 WeakPolarHBondContact O-CA 3.26Å; G66-A138 WeakPolarHBondContact O-CB 3.23Å; G66-A138 PolarHBondContact O-N 3.3Å; E69-A138 PolarHBondContact OE1-N 3Å; A138-G140 VanDerWaalsContact C-N 3.28Å; A138-G140 PolarHBondContact O-N 2.88Å; A138-F141 CarbonylContact O-C 3.52Å; A138-F141 WeakPolarHBondContact O-CA 3.46Å; A138-F141 WeakPolarHBondContact O-CB 3.35Å; A138-F141 PolarHBondContact O-N 3.42Å; A138-L142 PolarHBondContact O-N 2.68Å
139L95.1Very high94.3Very high36 Ų3625.7 Ų25.719%0.18812%0.123CC..Hα-helixtrans-63.6-34.6-176.1-167.968.6000112.3G137 L142 G143 L177 A190 Y194G137-L139 PolarHBondContact O-N 3.49Å; L139-L142 HydrophobicContact CD1-CD2 3.96Å; L139-L142 WeakPolarHBondContact O-CB 3.24Å; L139-L142 PolarHBondContact O-N 3.49Å; L139-G143 PolarHBondContact O-N 2.97Å; L139-G143 VanDerWaalsContact O-N 3.11Å; L139-L177 HydrophobicContact CD2-CD1 4.35Å; L139-A190 HydrophobicContact CD2-CB 3.7Å; L139-A190 VanDerWaalsContact CD2-O 3.23Å; L139-A190 WeakPolarHBondContact CD2-O 3.49Å; L139-Y194 HydrophobicContact CD1-CD2 4.32Å; L139-Y194 HydrophobicContact CG-CD2 4.18Å; L139-Y194 WeakPolarHBondContact O-CD2 3.25Å
140G96.1Very high94.2Very high0 Ų022.4 Ų22.40%011%0.111CC..Hα-helixtrans-63.8-42.2170.200000112.4A138 L142 G143 G144 S193 G197A138-G140 VanDerWaalsContact C-N 3.28Å; A138-G140 PolarHBondContact O-N 2.88Å; G140-L142 PolarHBondContact O-N 3.22Å; G140-G143 PolarHBondContact O-N 3.5Å; G140-G144 PolarHBondContact O-N 3.09Å; G140-S193 WeakPolarHBondContact CA-O 3.32Å; G140-G197 VanDerWaalsContact O-CA 3.31Å; G140-G197 WeakPolarHBondContact O-CA 3.3Å
141F97Very high94.1Very high2 Ų223 Ų231%0.00911%0.113CC..Hα-helixtrans-65.1-36.9174.6-176.7-113.5000112.3T81 V82 A85 F101 F102 A138 G143 G144 V145T81-F141 HydrophobicContact CG2-CD1 3.8Å; T81-F141 HydrophobicContact CG2-CE1 4.1Å; V82-F141 HydrophobicContact CG2-CE1 4.3Å; A85-F141 HydrophobicContact CB-CE1 4.22Å; A85-F141 HydrophobicContact CB-CZ 4.11Å; F101-F141 AromaticContact CD1-CE2 3.77Å; F101-F141 HydrophobicContact CD1-CE2 3.77Å; F101-F141 HydrophobicContact CE1-CD2 4.39Å; F101-F141 AromaticContact CE1-CE2 3.75Å; F101-F141 HydrophobicContact CE1-CE2 3.75Å; F102-F141 HydrophobicContact CB-CD2 4.39Å; F102-F141 HydrophobicContact CB-CE2 3.87Å; F102-F141 HydrophobicContact CB-CZ 4.34Å; F102-F141 AromaticContact CD2-CD1 3.93Å; F102-F141 HydrophobicContact CD2-CD1 3.93Å; F102-F141 AromaticContact CD2-CD2 3.64Å; F102-F141 HydrophobicContact CD2-CD2 3.64Å; F102-F141 AromaticContact CD2-CE1 3.93Å; F102-F141 HydrophobicContact CD2-CE1 3.93Å; F102-F141 AromaticContact CD2-CE2 3.64Å; F102-F141 HydrophobicContact CD2-CE2 3.64Å; F102-F141 AromaticContact CD2-CG 3.79Å; F102-F141 HydrophobicContact CD2-CG 3.79Å; F102-F141 AromaticContact CD2-CZ 3.78Å; F102-F141 HydrophobicContact CD2-CZ 3.78Å; F102-F141 HydrophobicContact CE2-CD1 4.15Å; F102-F141 HydrophobicContact CE2-CD2 4.37Å; F102-F141 HydrophobicContact CE2-CE1 4.46Å; F102-F141 HydrophobicContact CE2-CG 4.1Å; F102-F141 HydrophobicContact CG-CD2 4.4Å; F102-F141 HydrophobicContact CG-CE2 4.23Å; A138-F141 CarbonylContact O-C 3.52Å; A138-F141 WeakPolarHBondContact O-CA 3.46Å; A138-F141 WeakPolarHBondContact O-CB 3.35Å; A138-F141 PolarHBondContact O-N 3.42Å; F141-G143 PolarHBondContact O-N 2.9Å; F141-G144 CarbonylContact O-C 3.46Å; F141-G144 WeakPolarHBondContact O-CA 3.39Å; F141-G144 PolarHBondContact O-N 3.46Å; F141-V145 HydrophobicContact CD1-CG2 3.96Å; F141-V145 HydrophobicContact CD2-CG2 4.39Å; F141-V145 HydrophobicContact CE1-CG2 3.51Å; F141-V145 HydrophobicContact CE2-CG2 3.98Å; F141-V145 HydrophobicContact CG-CG2 4.38Å; F141-V145 HydrophobicContact CZ-CG2 3.52Å; F141-V145 WeakPolarHBondContact O-CG2 3.12Å; F141-V145 PolarHBondContact O-N 2.89Å
142L96.8Very high93.8Very high27 Ų2720.8 Ų20.814%0.14111%0.107CC..Hα-helixtrans-57.7-47.3172172.263.7000111.6I77 T81 A138 L139 G140 G144 V145 L146 L173 Y194I77-L142 HydrophobicContact CG2-CD2 3.95Å; T81-L142 HydrophobicContact CG2-CB 3.96Å; T81-L142 HydrophobicContact CG2-CD1 4Å; T81-L142 WeakPolarHBondContact OG1-CD1 3.44Å; A138-L142 PolarHBondContact O-N 2.68Å; L139-L142 HydrophobicContact CD1-CD2 3.96Å; L139-L142 WeakPolarHBondContact O-CB 3.24Å; L139-L142 PolarHBondContact O-N 3.49Å; G140-L142 PolarHBondContact O-N 3.22Å; L142-G144 PolarHBondContact O-N 3.01Å; L142-V145 PolarHBondContact O-N 3.27Å; L142-L146 HydrophobicContact CD1-CD1 4.21Å; L142-L146 HydrophobicContact CD1-CG 4.14Å; L142-L146 HydrophobicContact CG-CD1 4.27Å; L142-L146 WeakPolarHBondContact O-CG 3.45Å; L142-L146 PolarHBondContact O-N 3.45Å; L142-L173 HydrophobicContact CD2-CD2 3.94Å; L142-L173 HydrophobicContact CG-CD2 4.44Å; L142-Y194 HydrophobicContact CG-CE2 4.43Å
143G96.3Very high93.3Very high0 Ų020.2 Ų20.20%010%0.099CC..Hα-helixtrans-55.5-41.6172.900000111.4L139 G140 F141 L146 V147L139-G143 PolarHBondContact O-N 2.97Å; L139-G143 VanDerWaalsContact O-N 3.11Å; G140-G143 PolarHBondContact O-N 3.5Å; F141-G143 PolarHBondContact O-N 2.9Å; G143-L146 PolarHBondContact O-N 3.27Å; G143-V147 WeakPolarHBondContact O-CG2 3.31Å; G143-V147 PolarHBondContact O-N 2.84Å
144G96.4Very high92.4Very high0 Ų020.4 Ų20.40%011%0.105CC..Hα-helixtrans-64.8-44.1176.200000114.5G140 F141 L142 V147 A148 S201G140-G144 PolarHBondContact O-N 3.09Å; F141-G144 CarbonylContact O-C 3.46Å; F141-G144 WeakPolarHBondContact O-CA 3.39Å; F141-G144 PolarHBondContact O-N 3.46Å; L142-G144 PolarHBondContact O-N 3.01Å; G144-V147 PolarHBondContact O-N 2.98Å; G144-A148 PolarHBondContact O-N 3.1Å; G144-S201 WeakPolarHBondContact CA-OG 3.26Å; G144-S201 PolarHBondContact O-OG 3.45Å
145V95.8Very high91.3Very high3 Ų320.4 Ų20.42%0.01811%0.114CC..Hα-helixtrans-63.8-40.3177.3170.90000110.9T81 A85 L89 F141 L142 V147 A148 L149T81-V145 HydrophobicContact CG2-CB 4.15Å; T81-V145 HydrophobicContact CG2-CG2 3.86Å; A85-V145 HydrophobicContact CB-CG1 4.32Å; A85-V145 HydrophobicContact CB-CG2 3.81Å; L89-V145 HydrophobicContact CD1-CG1 4.31Å; F141-V145 HydrophobicContact CD1-CG2 3.96Å; F141-V145 HydrophobicContact CD2-CG2 4.39Å; F141-V145 HydrophobicContact CE1-CG2 3.51Å; F141-V145 HydrophobicContact CE2-CG2 3.98Å; F141-V145 HydrophobicContact CG-CG2 4.38Å; F141-V145 HydrophobicContact CZ-CG2 3.52Å; F141-V145 WeakPolarHBondContact O-CG2 3.12Å; F141-V145 PolarHBondContact O-N 2.89Å; L142-V145 PolarHBondContact O-N 3.27Å; V145-V147 VanDerWaalsContact C-N 3.32Å; V145-V147 PolarHBondContact O-N 3.05Å; V145-A148 WeakPolarHBondContact O-CB 3.49Å; V145-A148 PolarHBondContact O-N 2.89Å; V145-L149 HydrophobicContact CG1-CD1 4.01Å; V145-L149 HydrophobicContact CG1-CG 4.2Å; V145-L149 WeakPolarHBondContact O-CB 3.31Å; V145-L149 VanDerWaalsContact O-CG 3.27Å; V145-L149 WeakPolarHBondContact O-CG 3.45Å; V145-L149 PolarHBondContact O-N 2.91Å
146L94.9Very high90.3Very high19 Ų1923.5 Ų23.510%0.09914%0.135CC..Hα-helixtrans-63.8-38.8177-69.6173.4000112.1L142 G143 L149 K150 M169 P170 L173 Y194L142-L146 HydrophobicContact CD1-CD1 4.21Å; L142-L146 HydrophobicContact CD1-CG 4.14Å; L142-L146 HydrophobicContact CG-CD1 4.27Å; L142-L146 WeakPolarHBondContact O-CG 3.45Å; L142-L146 PolarHBondContact O-N 3.45Å; G143-L146 PolarHBondContact O-N 3.27Å; L146-L149 PolarHBondContact O-N 3.22Å; L146-K150 PolarHBondContact O-N 3.27Å; L146-K150 VanDerWaalsContact O-N 3.1Å; L146-M169 HydrophobicContact CD2-CB 4.48Å; L146-P170 HydrophobicContact CB-CB 4.24Å; L146-P170 HydrophobicContact CB-CG 3.91Å; L146-L173 HydrophobicContact CD1-CD2 3.62Å; L146-Y194 HydrophobicContact CD1-CE2 4.21Å; L146-Y194 WeakPolarHBondContact CD1-OH 3.34Å
147V94.5Very high89Confident0 Ų025 Ų250%015%0.146CC..Hα-helixtrans-64.1-43.4173.3174.30000111.1G143 G144 V145 K150 Q151 P170 L198 W202 L205 F222 F227G143-V147 WeakPolarHBondContact O-CG2 3.31Å; G143-V147 PolarHBondContact O-N 2.84Å; G144-V147 PolarHBondContact O-N 2.98Å; V145-V147 VanDerWaalsContact C-N 3.32Å; V145-V147 PolarHBondContact O-N 3.05Å; V147-K150 WeakPolarHBondContact O-CB 3.44Å; V147-K150 PolarHBondContact O-N 3.49Å; V147-Q151 PolarHBondContact O-N 3.35Å; V147-Q151 VanDerWaalsContact O-N 3.12Å; V147-P170 HydrophobicContact CG2-CB 4.31Å; V147-P170 HydrophobicContact CG2-CG 4.48Å; V147-L198 HydrophobicContact CG2-CB 4.39Å; V147-L198 HydrophobicContact CG2-CD2 4.49Å; V147-L198 HydrophobicContact CG2-CG 3.75Å; V147-W202 HydrophobicContact CG1-CB 4.01Å; V147-L205 HydrophobicContact CG1-CD1 3.97Å; V147-F222 HydrophobicContact CG1-CE2 3.96Å; V147-F222 HydrophobicContact CG1-CZ 3.81Å; V147-F227 HydrophobicContact CB-CE1 4.23Å; V147-F227 HydrophobicContact CG1-CE1 3.92Å; V147-F227 HydrophobicContact CG1-CZ 3.89Å; V147-F227 HydrophobicContact CG2-CE1 3.93Å
148A93.8Very high87.6Confident0 Ų029.1 Ų29.10%017%0.17CC..Hα-helixtrans-63.5-40.5176.600000112.7L89 W93 F101 G144 V145 K150 Q151 T152 L205L89-A148 HydrophobicContact CD1-CB 3.58Å; L89-A148 HydrophobicContact CD2-CB 3.91Å; L89-A148 HydrophobicContact CG-CB 4.42Å; W93-A148 HydrophobicContact CH2-CB 3.46Å; W93-A148 VanDerWaalsContact CH2-CB 3.46Å; W93-A148 HydrophobicContact CZ2-CB 3.89Å; F101-A148 HydrophobicContact CZ-CB 4.39Å; G144-A148 PolarHBondContact O-N 3.1Å; V145-A148 WeakPolarHBondContact O-CB 3.49Å; V145-A148 PolarHBondContact O-N 2.89Å; A148-K150 VanDerWaalsContact C-N 3.3Å; A148-K150 PolarHBondContact O-N 3.41Å; A148-Q151 WeakPolarHBondContact O-CB 3.36Å; A148-Q151 PolarHBondContact O-N 3.4Å; A148-Q151 VanDerWaalsContact O-N 3.08Å; A148-T152 WeakPolarHBondContact O-CG2 3.45Å; A148-T152 PolarHBondContact O-N 2.92Å; A148-T152 PolarHBondContact O-OG1 3.45Å; A148-L205 HydrophobicContact CB-CD1 3.95Å
149L92.2Very high86Confident21 Ų2133 Ų3311%0.1119%0.19CC..Hα-helixtrans-64.3-35.9176.4-72.6174.5000112V84 L88 L89 V145 L146 Q151 T152 M153 V166V84-L149 HydrophobicContact CG1-CD1 4.02Å; L88-L149 HydrophobicContact CB-CD2 3.8Å; L88-L149 HydrophobicContact CD1-CD2 3.56Å; L88-L149 HydrophobicContact CG-CD2 4.33Å; L89-L149 HydrophobicContact CD2-CD2 4.19Å; V145-L149 HydrophobicContact CG1-CD1 4.01Å; V145-L149 HydrophobicContact CG1-CG 4.2Å; V145-L149 WeakPolarHBondContact O-CB 3.31Å; V145-L149 VanDerWaalsContact O-CG 3.27Å; V145-L149 WeakPolarHBondContact O-CG 3.45Å; V145-L149 PolarHBondContact O-N 2.91Å; L146-L149 PolarHBondContact O-N 3.22Å; L149-Q151 VanDerWaalsContact C-N 3.33Å; L149-T152 PolarHBondContact O-N 3.04Å; L149-T152 PolarHBondContact O-OG1 3.19Å; L149-M153 VanDerWaalsContact O-CB 3.26Å; L149-M153 WeakPolarHBondContact O-CB 3.38Å; L149-M153 PolarHBondContact O-N 3.47Å; L149-V166 HydrophobicContact CB-CG1 4.05Å
150K90.6Very high84.6Confident7 Ų740.5 Ų40.53%0.0322%0.216CC..Hα-helixtrans-62.6-42.5170.6175.8-175.6174.9-179.60111.6L146 V147 A148 T152 G154 V166 T226 F227L146-K150 PolarHBondContact O-N 3.27Å; L146-K150 VanDerWaalsContact O-N 3.1Å; V147-K150 WeakPolarHBondContact O-CB 3.44Å; V147-K150 PolarHBondContact O-N 3.49Å; A148-K150 VanDerWaalsContact C-N 3.3Å; A148-K150 PolarHBondContact O-N 3.41Å; K150-T152 VanDerWaalsContact C-N 3.28Å; K150-T152 PolarHBondContact O-N 2.8Å; K150-G154 VanDerWaalsContact O-CA 3.29Å; K150-G154 WeakPolarHBondContact O-CA 3.08Å; K150-G154 PolarHBondContact O-N 2.98Å; K150-V166 HydrophobicContact CB-CG1 4.44Å; K150-T226 PolarHBondContact NZ-O 3.29Å; K150-T226 PolarHBondContact NZ-OG1 3.32Å; K150-F227 HydrophobicContact CB-CE1 4.43Å; K150-F227 HydrophobicContact CD-CD1 3.59Å; K150-F227 HydrophobicContact CD-CD2 4.36Å; K150-F227 HydrophobicContact CD-CE1 3.31Å; K150-F227 HydrophobicContact CD-CE2 4.11Å; K150-F227 HydrophobicContact CD-CG 4.12Å; K150-F227 HydrophobicContact CD-CZ 3.59Å; K150-F227 HydrophobicContact CG-CE1 4.43Å; K150-F227 VanDerWaalsContact NZ-CA 3.27Å; K150-F227 VanDerWaalsContact NZ-CE2 3.29Å
151Q88.9Confident83.1Confident25 Ų2546.3 Ų46.312%0.11725%0.251CS..Hα-helixtrans-61.4-38.4179-168-171.822.200111.8V147 A148 L149 F222V147-Q151 PolarHBondContact O-N 3.35Å; V147-Q151 VanDerWaalsContact O-N 3.12Å; A148-Q151 WeakPolarHBondContact O-CB 3.36Å; A148-Q151 PolarHBondContact O-N 3.4Å; A148-Q151 VanDerWaalsContact O-N 3.08Å; L149-Q151 VanDerWaalsContact C-N 3.33Å; Q151-F222 HydrophobicContact CB-CD2 4.04Å; Q151-F222 HydrophobicContact CB-CE2 3.74Å; Q151-F222 HydrophobicContact CB-CZ 4.32Å; Q151-F222 HydrophobicContact CG-CD2 4.21Å; Q151-F222 HydrophobicContact CG-CE2 4.14Å; Q151-F222 HydrophobicContact CG-CZ 4.43Å
152T87.3Confident81.4Confident45 Ų4550.6 Ų50.628%0.27628%0.279SS..Hα-helixtrans-89.7-39.6-174.157.50000113.6L89 L92 A148 L149 K150L89-T152 HydrophobicContact CD2-CG2 3.93Å; L92-T152 HydrophobicContact CD1-CG2 3.41Å; L92-T152 VanDerWaalsContact CD1-CG2 3.41Å; A148-T152 WeakPolarHBondContact O-CG2 3.45Å; A148-T152 PolarHBondContact O-N 2.92Å; A148-T152 PolarHBondContact O-OG1 3.45Å; L149-T152 PolarHBondContact O-N 3.04Å; L149-T152 PolarHBondContact O-OG1 3.19Å; K150-T152 VanDerWaalsContact C-N 3.28Å; K150-T152 PolarHBondContact O-N 2.8Å
153M80.9Confident80.1Confident73 Ų7356.7 Ų56.736%0.3631%0.307SS..Hα-helixtrans-98.9-11.1-175-57-66.9-178.200113.3L88 L149 D155 C156 V166L88-M153 HydrophobicContact CB-CE 4.21Å; L88-M153 HydrophobicContact CD1-CE 4.18Å; L88-M153 HydrophobicContact CD2-CE 3.97Å; L88-M153 HydrophobicContact CG-CE 4.35Å; L149-M153 VanDerWaalsContact O-CB 3.26Å; L149-M153 WeakPolarHBondContact O-CB 3.38Å; L149-M153 PolarHBondContact O-N 3.47Å; M153-D155 PolarHBondContact O-N 3.39Å; M153-D155 VanDerWaalsContact O-N 3.12Å; M153-C156 HydrophobicContact CB-CB 4.31Å; M153-C156 PolarHBondContact O-N 3.48Å; M153-C156 PolarHBondContact O-SG 2.95Å; M153-V166 HydrophobicContact CB-CG2 4.45Å
154G75.1Confident79Confident25 Ų2557.9 Ų57.926%0.25831%0.314SS..THydrogen-bonded Turntrans57.2-115.3-178.200000112.6K150K150-G154 VanDerWaalsContact O-CA 3.29Å; K150-G154 WeakPolarHBondContact O-CA 3.08Å; K150-G154 PolarHBondContact O-N 2.98Å
155D70.1Confident78.3Confident110 Ų11062 Ų6259%0.58833%0.33SS*.THydrogen-bonded Turntrans-104.925.8-173.2-74.1-47.4000114.4M153 V157 S167M153-D155 PolarHBondContact O-N 3.39Å; M153-D155 VanDerWaalsContact O-N 3.12Å; D155-V157 PolarHBondContact O-N 2.76Å; D155-S167 WeakPolarHBondContact OD1-CB 3.37Å; D155-S167 PolarHBondContact OD1-OG 2.92Å
156C72.4Confident77.5Confident67 Ų6762.4 Ų62.445%0.45333%0.332SS..  trans-53.1135.6171.3-700000111.2M153 V158 V166M153-C156 HydrophobicContact CB-CB 4.31Å; M153-C156 PolarHBondContact O-N 3.48Å; M153-C156 PolarHBondContact O-SG 2.95Å; C156-V158 PolarHBondContact O-N 2.9Å; C156-V166 HydrophobicContact CB-CG2 4.06Å; C156-V166 WeakPolarHBondContact O-CG2 3.47Å; C156-V166 PolarHBondContact O-N 2.99Å
157V68.1Low76.9Confident60 Ų6061.9 Ų61.936%0.36433%0.33SS..EExtended strand (participates in β ladder)trans-85110.2176.1179.60000107.9D155 L159 R165D155-V157 PolarHBondContact O-N 2.76Å; V157-L159 WeakPolarHBondContact CG1-O 3.38Å; V157-R165 HydrophobicContact CG2-CG 4.37Å
158V62.8Low76.5Confident88 Ų8863 Ų6353%0.53334%0.337SS..EExtended strand (participates in β ladder)trans-77.6-48.8-179.6-1790000110.7C156 V164 V166 M169C156-V158 PolarHBondContact O-N 2.9Å; V158-V164 PolarHBondContact N-O 3.32Å; V158-V166 HydrophobicContact CG2-CB 4.25Å; V158-V166 HydrophobicContact CG2-CG2 3.17Å; V158-M169 HydrophobicContact CB-SD 4.11Å; V158-M169 HydrophobicContact CG1-CE 4.33Å; V158-M169 HydrophobicContact CG1-SD 4.39Å; V158-M169 HydrophobicContact CG2-SD 3.54Å; V158-M169 VanDerWaalsContact CG2-SD 3.54Å
159L61.2Low76.2Confident85 Ų8565.7 Ų65.745%0.44535%0.35SS..EExtended strand (participates in β ladder)trans-108.9122.2179.7-170.562.6000108.2V157 V161 P162 Q163 V164V157-L159 WeakPolarHBondContact CG1-O 3.38Å; L159-V161 VanDerWaalsContact C-N 3.32Å; L159-V161 WeakPolarHBondContact CD2-O 3.47Å; L159-V161 WeakPolarHBondContact CG-O 3.35Å; L159-P162 CarbonylContact C-O 3.54Å; L159-P162 WeakPolarHBondContact CB-O 3.46Å; L159-P162 HydrophobicContact CD2-CG 4.13Å; L159-P162 WeakPolarHBondContact CG-O 3.2Å; L159-Q163 VanDerWaalsContact O-CA 3.26Å; L159-Q163 WeakPolarHBondContact O-CA 3.4Å; L159-V164 HydrophobicContact CB-CB 4.18Å; L159-V164 HydrophobicContact CB-CG2 4.45Å; L159-V164 HydrophobicContact CD2-CG2 4.42Å; L159-V164 PolarHBondContact N-O 3.25Å; L159-V164 PolarHBondContact O-N 3.23Å
160R64.5Low76.3Confident194 Ų19464.7 Ų64.773%0.73235%0.345SS*.THydrogen-bonded Turntrans-73.3-27.8178.8-172.3132.6-76.3178.9-4.1111.7Q163R160-Q163 WeakPolarHBondContact O-CG 3.02Å
161V65.4Low76.4Confident122 Ų12265.3 Ų65.374%0.73935%0.348SS*.THydrogen-bonded Turntrans-145.4112.8179.6-171.20000110.7L159L159-V161 VanDerWaalsContact C-N 3.32Å; L159-V161 WeakPolarHBondContact CD2-O 3.47Å; L159-V161 WeakPolarHBondContact CG-O 3.35Å
162P60.7Low76.5Confident92 Ų9268.8 Ų68.860%0.59737%0.366SS*.THydrogen-bonded Turncis-62.9152.9-14.927-35000112L159 V164L159-P162 CarbonylContact C-O 3.54Å; L159-P162 WeakPolarHBondContact CB-O 3.46Å; L159-P162 HydrophobicContact CD2-CG 4.13Å; L159-P162 WeakPolarHBondContact CG-O 3.2Å; P162-V164 VanDerWaalsContact C-N 3.29Å; P162-V164 HydrophobicContact CG-CG2 4.24Å; P162-V164 PolarHBondContact O-N 3.12Å
163Q69.9Low76.8Confident155 Ų15568.7 Ų68.772%0.72436%0.364SS*.THydrogen-bonded Turntrans-65.481.5179.6-70.1-176-45.400111.7L159 R160L159-Q163 VanDerWaalsContact O-CA 3.26Å; L159-Q163 WeakPolarHBondContact O-CA 3.4Å; R160-Q163 WeakPolarHBondContact O-CG 3.02Å
164V73.2Confident77.5Confident24 Ų2467.1 Ų67.115%0.14536%0.357CS..EExtended strand (participates in β ladder)trans-93.1114.4176.1-177.10000108.6V158 L159 P162 V168 M169 L172V158-V164 PolarHBondContact N-O 3.32Å; L159-V164 HydrophobicContact CB-CB 4.18Å; L159-V164 HydrophobicContact CB-CG2 4.45Å; L159-V164 HydrophobicContact CD2-CG2 4.42Å; L159-V164 PolarHBondContact N-O 3.25Å; L159-V164 PolarHBondContact O-N 3.23Å; P162-V164 VanDerWaalsContact C-N 3.29Å; P162-V164 HydrophobicContact CG-CG2 4.24Å; P162-V164 PolarHBondContact O-N 3.12Å; V164-V168 HydrophobicContact CG1-CG2 4.27Å; V164-M169 HydrophobicContact CG1-CG 3.85Å; V164-L172 HydrophobicContact CG1-CD2 4.1Å; V164-L172 HydrophobicContact CG2-CD2 4.48Å
165R81.7Confident78.4Confident88 Ų8868.2 Ų68.233%0.33236%0.363SS..EExtended strand (participates in β ladder)trans-78.6143.5172.9-63.2-173.6-67.8-108.912.4110.2V157 S167 V168 M169 E230V157-R165 HydrophobicContact CG2-CG 4.37Å; R165-S167 WeakPolarHBondContact CB-OG 3.19Å; R165-S167 PolarHBondContact O-N 2.88Å; R165-S167 VanDerWaalsContact O-N 3.12Å; R165-V168 HydrophobicContact CB-CG2 4.47Å; R165-V168 VanDerWaalsContact O-CG2 3.28Å; R165-V168 WeakPolarHBondContact O-CG2 3.3Å; R165-V168 PolarHBondContact O-N 2.86Å; R165-M169 WeakPolarHBondContact O-CG 2.99Å; R165-E230 IonicContact CZ-OE1 3.22Å; R165-E230 IonicContact NH1-OE1 3.39Å; R165-E230 IonicContact NH2-OE1 2.64Å; R165-E230 PolarHBondContact NH2-OE1 3.31Å
166V80.1Confident79.6Confident11 Ų1167.2 Ų67.27%0.06736%0.358CS..G310 helixtrans-50.8-37.61731790000110.6L149 K150 M153 C156 V158 V168 M169 P170L149-V166 HydrophobicContact CB-CG1 4.05Å; K150-V166 HydrophobicContact CB-CG1 4.44Å; M153-V166 HydrophobicContact CB-CG2 4.45Å; C156-V166 HydrophobicContact CB-CG2 4.06Å; C156-V166 WeakPolarHBondContact O-CG2 3.47Å; C156-V166 PolarHBondContact O-N 2.99Å; V158-V166 HydrophobicContact CG2-CB 4.25Å; V158-V166 HydrophobicContact CG2-CG2 3.17Å; V166-V168 VanDerWaalsContact C-N 3.26Å; V166-V168 PolarHBondContact O-N 3.5Å; V166-M169 WeakPolarHBondContact O-CB 3.41Å; V166-M169 PolarHBondContact O-N 3.39Å; V166-M169 VanDerWaalsContact O-N 3.14Å; V166-P170 WeakPolarHBondContact O-CD 3.35Å
167S81.6Confident80.6Confident7 Ų764.6 Ų64.65%0.04934%0.339CS..G310 helixtrans-57.8-31.2-176.650.90000115.5D155 R165D155-S167 WeakPolarHBondContact OD1-CB 3.37Å; D155-S167 PolarHBondContact OD1-OG 2.92Å; R165-S167 WeakPolarHBondContact CB-OG 3.19Å; R165-S167 PolarHBondContact O-N 2.88Å; R165-S167 VanDerWaalsContact O-N 3.12Å
168V86.1Confident81.9Confident25 Ų2565.8 Ų65.815%0.15234%0.343CS..G310 helixtrans-99-10.8180-62.70000113.4V164 R165 V166 P170 M171 L172V164-V168 HydrophobicContact CG1-CG2 4.27Å; R165-V168 HydrophobicContact CB-CG2 4.47Å; R165-V168 VanDerWaalsContact O-CG2 3.28Å; R165-V168 WeakPolarHBondContact O-CG2 3.3Å; R165-V168 PolarHBondContact O-N 2.86Å; V166-V168 VanDerWaalsContact C-N 3.26Å; V166-V168 PolarHBondContact O-N 3.5Å; V168-P170 VanDerWaalsContact C-CD 3.46Å; V168-M171 PolarHBondContact O-N 3.37Å; V168-L172 WeakPolarHBondContact O-CB 3.35Å; V168-L172 PolarHBondContact O-N 2.81Å
169M88.3Confident83.5Confident56 Ų5667 Ų6728%0.27635%0.346SS..Hα-helixtrans-56.2-43.5-176.7-64.5-175.183.100114.1L146 V158 V164 R165 V166 M171 L172 L173L146-M169 HydrophobicContact CD2-CB 4.48Å; V158-M169 HydrophobicContact CB-SD 4.11Å; V158-M169 HydrophobicContact CG1-CE 4.33Å; V158-M169 HydrophobicContact CG1-SD 4.39Å; V158-M169 HydrophobicContact CG2-SD 3.54Å; V158-M169 VanDerWaalsContact CG2-SD 3.54Å; V164-M169 HydrophobicContact CG1-CG 3.85Å; R165-M169 WeakPolarHBondContact O-CG 2.99Å; V166-M169 WeakPolarHBondContact O-CB 3.41Å; V166-M169 PolarHBondContact O-N 3.39Å; V166-M169 VanDerWaalsContact O-N 3.14Å; M169-M171 VanDerWaalsContact C-N 3.29Å; M169-M171 PolarHBondContact O-N 3.14Å; M169-L172 PolarHBondContact O-N 3.48Å; M169-L173 WeakPolarHBondContact O-CB 3.32Å; M169-L173 PolarHBondContact O-N 3.47Å
170P92.7Very high85.1Confident0 Ų065.8 Ų65.80%034%0.34CS..Hα-helixtrans-58.1-42.6-179-22.130.7000112.4L146 V147 V166 V168 L174 Y194 L198 F227L146-P170 HydrophobicContact CB-CB 4.24Å; L146-P170 HydrophobicContact CB-CG 3.91Å; V147-P170 HydrophobicContact CG2-CB 4.31Å; V147-P170 HydrophobicContact CG2-CG 4.48Å; V166-P170 WeakPolarHBondContact O-CD 3.35Å; V168-P170 VanDerWaalsContact C-CD 3.46Å; P170-L174 PolarHBondContact O-N 2.88Å; P170-L174 VanDerWaalsContact O-N 3.09Å; P170-Y194 WeakPolarHBondContact CA-OH 3.37Å; P170-Y194 WeakPolarHBondContact O-CE1 3.4Å; P170-Y194 PolarHBondContact O-OH 3.09Å; P170-L198 HydrophobicContact CB-CD1 3.63Å; P170-L198 HydrophobicContact CB-CG 4.4Å; P170-F227 HydrophobicContact CB-CD1 4.14Å; P170-F227 HydrophobicContact CG-CD1 3.92Å; P170-F227 HydrophobicContact CG-CE1 4.17Å
171M92.6Very high86.5Confident20 Ų2061 Ų6110%0.09932%0.322CS..Hα-helixtrans-83.2-32.2-177.5-65.2-56.5-5000112.8V168 M169 L173 L174 A175 L198 F227 F228V168-M171 PolarHBondContact O-N 3.37Å; M169-M171 VanDerWaalsContact C-N 3.29Å; M169-M171 PolarHBondContact O-N 3.14Å; M171-L173 VanDerWaalsContact C-N 3.32Å; M171-L174 HydrophobicContact CE-CB 4.36Å; M171-L174 HydrophobicContact CE-CD2 3.49Å; M171-L174 VanDerWaalsContact CE-CD2 3.49Å; M171-L174 WeakPolarHBondContact O-CB 3.49Å; M171-L174 PolarHBondContact O-N 3.27Å; M171-L174 HydrophobicContact SD-CD2 4.15Å; M171-A175 WeakPolarHBondContact O-CB 3.31Å; M171-A175 PolarHBondContact O-N 3.43Å; M171-L198 HydrophobicContact SD-CD1 3.91Å; M171-L198 HydrophobicContact SD-CD2 4.28Å; M171-F227 WeakPolarHBondContact CB-O 3.33Å; M171-F227 HydrophobicContact CG-CB 3.58Å; M171-F227 WeakPolarHBondContact CG-O 3.34Å; M171-F227 HydrophobicContact SD-CB 4.46Å; M171-F228 HydrophobicContact CE-CD1 4.18Å; M171-F228 HydrophobicContact CE-CE1 3.42Å; M171-F228 VanDerWaalsContact CE-CE1 3.42Å; M171-F228 HydrophobicContact CE-CE2 3.89Å; M171-F228 HydrophobicContact CE-CZ 3.24Å; M171-F228 HydrophobicContact CG-CD2 4.29Å; M171-F228 HydrophobicContact CG-CE2 4.24Å; M171-F228 HydrophobicContact CG-CZ 4.46Å; M171-F228 HydrophobicContact SD-CE2 4.09Å; M171-F228 HydrophobicContact SD-CZ 4.04Å
172L91.9Very high87.9Confident97 Ų9761.1 Ų61.151%0.50832%0.317SS..Hα-helixtrans-62.2-43.3172.6-176.665.3000110.8V164 V168 M169 A175 L176V164-L172 HydrophobicContact CG1-CD2 4.1Å; V164-L172 HydrophobicContact CG2-CD2 4.48Å; V168-L172 WeakPolarHBondContact O-CB 3.35Å; V168-L172 PolarHBondContact O-N 2.81Å; M169-L172 PolarHBondContact O-N 3.48Å; L172-A175 PolarHBondContact O-N 2.87Å; L172-L176 WeakPolarHBondContact O-CB 3.4Å; L172-L176 PolarHBondContact O-N 2.95Å
173L93.3Very high89.5Confident43 Ų4359.3 Ų59.323%0.22531%0.31CS..Hα-helixtrans-68-37.7174.7179.759000111.6L142 L146 M169 M171 A175 L176 L177 Y194L142-L173 HydrophobicContact CD2-CD2 3.94Å; L142-L173 HydrophobicContact CG-CD2 4.44Å; L146-L173 HydrophobicContact CD1-CD2 3.62Å; M169-L173 WeakPolarHBondContact O-CB 3.32Å; M169-L173 PolarHBondContact O-N 3.47Å; M171-L173 VanDerWaalsContact C-N 3.32Å; L173-A175 VanDerWaalsContact C-N 3.31Å; L173-A175 PolarHBondContact O-N 3.22Å; L173-L176 HydrophobicContact CD1-CD2 4.21Å; L173-L176 PolarHBondContact O-N 3.38Å; L173-L177 HydrophobicContact CD1-CD1 4.41Å; L173-L177 HydrophobicContact CD1-CG 4.11Å; L173-L177 HydrophobicContact CG-CD1 4.23Å; L173-L177 HydrophobicContact CG-CG 4.39Å; L173-L177 WeakPolarHBondContact O-CB 3.12Å; L173-L177 VanDerWaalsContact O-CG 3.31Å; L173-L177 WeakPolarHBondContact O-CG 3.41Å; L173-L177 PolarHBondContact O-N 3.37Å; L173-Y194 WeakPolarHBondContact CB-OH 3.47Å; L173-Y194 HydrophobicContact CD2-CD2 4.35Å; L173-Y194 HydrophobicContact CD2-CE2 3.46Å; L173-Y194 VanDerWaalsContact CD2-CE2 3.46Å; L173-Y194 HydrophobicContact CG-CE1 4.4Å; L173-Y194 HydrophobicContact CG-CE2 3.91Å
174L95.3Very high90.5Very high41 Ų4157.3 Ų57.322%0.21531%0.308CS..Hα-helixtrans-57.7-46.3171.9-172.864.2000111.2P170 M171 L177 L178 L191 Y194P170-L174 PolarHBondContact O-N 2.88Å; P170-L174 VanDerWaalsContact O-N 3.09Å; M171-L174 HydrophobicContact CE-CB 4.36Å; M171-L174 HydrophobicContact CE-CD2 3.49Å; M171-L174 VanDerWaalsContact CE-CD2 3.49Å; M171-L174 WeakPolarHBondContact O-CB 3.49Å; M171-L174 PolarHBondContact O-N 3.27Å; M171-L174 HydrophobicContact SD-CD2 4.15Å; L174-L177 PolarHBondContact O-N 3.03Å; L174-L178 WeakPolarHBondContact O-CB 3.36Å; L174-L178 PolarHBondContact O-N 3.43Å; L174-L191 HydrophobicContact CD1-CD1 3.97Å; L174-Y194 HydrophobicContact CB-CD1 4.24Å; L174-Y194 HydrophobicContact CB-CE1 3.78Å; L174-Y194 HydrophobicContact CD1-CD1 3.64Å; L174-Y194 HydrophobicContact CD1-CE1 4.07Å
175A94.2Very high91.3Very high47 Ų4762.5 Ų62.539%0.38834%0.335SS..Hα-helixtrans-63.7-41.2178.800000111.5M171 L172 L173 L178 L179M171-A175 WeakPolarHBondContact O-CB 3.31Å; M171-A175 PolarHBondContact O-N 3.43Å; L172-A175 PolarHBondContact O-N 2.87Å; L173-A175 VanDerWaalsContact C-N 3.31Å; L173-A175 PolarHBondContact O-N 3.22Å; A175-L178 WeakPolarHBondContact O-CB 3.43Å; A175-L178 PolarHBondContact O-N 3.01Å; A175-L179 VanDerWaalsContact O-CG 3.3Å; A175-L179 WeakPolarHBondContact O-CG 3.32Å; A175-L179 PolarHBondContact O-N 3.31Å
176L94.6Very high91.6Very high89 Ų8960 Ų6047%0.46633%0.328SS..Hα-helixtrans-61.8-47.8174.8178.662.9000111.8L172 L173 L178 L179 L180L172-L176 WeakPolarHBondContact O-CB 3.4Å; L172-L176 PolarHBondContact O-N 2.95Å; L173-L176 HydrophobicContact CD1-CD2 4.21Å; L173-L176 PolarHBondContact O-N 3.38Å; L176-L178 VanDerWaalsContact C-N 3.28Å; L176-L178 PolarHBondContact O-N 2.96Å; L176-L179 PolarHBondContact O-N 3.03Å; L176-L180 HydrophobicContact CD1-CG 4.49Å; L176-L180 HydrophobicContact CG-CD1 4.28Å; L176-L180 WeakPolarHBondContact O-CG 3.49Å; L176-L180 PolarHBondContact O-N 3.26Å
177L95Very high92.1Very high13 Ų1365 Ų657%0.06835%0.35CS..Hα-helixtrans-62.9-37.2177.5-68.6175.4000111.7L139 L173 L174 L180 R181 L186 L191 Y194L139-L177 HydrophobicContact CD2-CD1 4.35Å; L173-L177 HydrophobicContact CD1-CD1 4.41Å; L173-L177 HydrophobicContact CD1-CG 4.11Å; L173-L177 HydrophobicContact CG-CD1 4.23Å; L173-L177 HydrophobicContact CG-CG 4.39Å; L173-L177 WeakPolarHBondContact O-CB 3.12Å; L173-L177 VanDerWaalsContact O-CG 3.31Å; L173-L177 WeakPolarHBondContact O-CG 3.41Å; L173-L177 PolarHBondContact O-N 3.37Å; L174-L177 PolarHBondContact O-N 3.03Å; L177-L180 PolarHBondContact O-N 3.49Å; L177-R181 WeakPolarHBondContact O-CB 3.49Å; L177-R181 PolarHBondContact O-N 3.45Å; L177-L186 HydrophobicContact CB-CD2 3.89Å; L177-L186 HydrophobicContact CD2-CD1 4.43Å; L177-L186 HydrophobicContact CD2-CD2 3.8Å; L177-L186 HydrophobicContact CG-CD2 4.4Å; L177-L186 WeakPolarHBondContact O-CD2 3.41Å; L177-L191 HydrophobicContact CB-CD1 3.94Å; L177-Y194 HydrophobicContact CD1-CD1 3.7Å; L177-Y194 HydrophobicContact CD1-CD2 3.82Å; L177-Y194 HydrophobicContact CD1-CE1 4.34Å; L177-Y194 HydrophobicContact CD1-CE2 4.44Å; L177-Y194 HydrophobicContact CD1-CG 3.41Å; L177-Y194 VanDerWaalsContact CD1-CG 3.41Å
178L95.4Very high92.4Very high85 Ų8566.9 Ų66.945%0.44536%0.364SS..Hα-helixtrans-62.3-48.5173.3179.863.5000110.7L174 A175 L176 L180 R181 L182 L191L174-L178 WeakPolarHBondContact O-CB 3.36Å; L174-L178 PolarHBondContact O-N 3.43Å; A175-L178 WeakPolarHBondContact O-CB 3.43Å; A175-L178 PolarHBondContact O-N 3.01Å; L176-L178 VanDerWaalsContact C-N 3.28Å; L176-L178 PolarHBondContact O-N 2.96Å; L178-L180 VanDerWaalsContact C-N 3.35Å; L178-L180 PolarHBondContact O-N 3.43Å; L178-R181 WeakPolarHBondContact O-CA 3.41Å; L178-R181 WeakPolarHBondContact O-CB 3.46Å; L178-R181 PolarHBondContact O-N 3.37Å; L178-R181 VanDerWaalsContact O-N 3.09Å; L178-L182 HydrophobicContact CD1-CD1 3.58Å; L178-L182 HydrophobicContact CG-CD1 3.67Å; L178-L182 WeakPolarHBondContact O-CD1 3.5Å; L178-L182 PolarHBondContact O-N 3.01Å; L178-L191 HydrophobicContact CB-CD1 4.31Å; L178-L191 HydrophobicContact CD1-CD2 3.84Å
179L96.2Very high92.8Very high114 Ų11466.4 Ų66.460%0.59736%0.361SS*.Hα-helixtrans-59.6-43.3176.8-70.7171.6000112.2A175 L176 R181 L182 A183A175-L179 VanDerWaalsContact O-CG 3.3Å; A175-L179 WeakPolarHBondContact O-CG 3.32Å; A175-L179 PolarHBondContact O-N 3.31Å; L176-L179 PolarHBondContact O-N 3.03Å; L179-R181 VanDerWaalsContact C-N 3.28Å; L179-R181 PolarHBondContact O-N 2.93Å; L179-L182 PolarHBondContact O-N 3.44Å; L179-A183 WeakPolarHBondContact O-CB 3.48Å; L179-A183 PolarHBondContact O-N 2.92Å
180L95Very high93Very high59 Ų5964.8 Ų64.831%0.30936%0.356SS..Hα-helixtrans-62.5-36.1175-69.7172.3000111.9L176 L177 L178 A183 T184 L185 L186L176-L180 HydrophobicContact CD1-CG 4.49Å; L176-L180 HydrophobicContact CG-CD1 4.28Å; L176-L180 WeakPolarHBondContact O-CG 3.49Å; L176-L180 PolarHBondContact O-N 3.26Å; L177-L180 PolarHBondContact O-N 3.49Å; L178-L180 VanDerWaalsContact C-N 3.35Å; L178-L180 PolarHBondContact O-N 3.43Å; L180-A183 CarbonylContact O-C 3.51Å; L180-A183 PolarHBondContact O-N 3.31Å; L180-T184 PolarHBondContact O-N 3.28Å; L180-L185 HydrophobicContact CD2-CB 4.37Å; L180-L185 HydrophobicContact CD2-CD2 4.27Å; L180-L185 PolarHBondContact O-N 3.41Å; L180-L186 HydrophobicContact CB-CB 3.93Å; L180-L186 PolarHBondContact O-N 3.47Å
181R93.1Very high93.1Very high94 Ų9466.4 Ų66.436%0.35537%0.365SS..Hα-helixtrans-67.8-42173.9175.359.7-170.297.3-4.5112L177 L178 L179 A183 T184 L186 L191L177-R181 WeakPolarHBondContact O-CB 3.49Å; L177-R181 PolarHBondContact O-N 3.45Å; L178-R181 WeakPolarHBondContact O-CA 3.41Å; L178-R181 WeakPolarHBondContact O-CB 3.46Å; L178-R181 PolarHBondContact O-N 3.37Å; L178-R181 VanDerWaalsContact O-N 3.09Å; L179-R181 VanDerWaalsContact C-N 3.28Å; L179-R181 PolarHBondContact O-N 2.93Å; R181-A183 VanDerWaalsContact C-N 3.29Å; R181-A183 PolarHBondContact O-N 3.14Å; R181-T184 WeakPolarHBondContact O-CA 2.8Å; R181-T184 PolarHBondContact O-N 2.91Å; R181-L186 HydrophobicContact CB-CB 4.32Å; R181-L186 WeakPolarHBondContact CD-O 3.34Å; R181-L191 HydrophobicContact CB-CD2 4.13Å; R181-L191 HydrophobicContact CG-CD2 4.07Å
182L94.2Very high93.2Very high124 Ų12466.5 Ų66.565%0.64937%0.369SS*.Hα-helixtrans-62.8-38.2174.8-87.387.1000111.3L178 L179 T184L178-L182 HydrophobicContact CD1-CD1 3.58Å; L178-L182 HydrophobicContact CG-CD1 3.67Å; L178-L182 WeakPolarHBondContact O-CD1 3.5Å; L178-L182 PolarHBondContact O-N 3.01Å; L179-L182 PolarHBondContact O-N 3.44Å; L182-T184 PolarHBondContact O-N 3.46Å
183A95.4Very high93.4Very high53 Ų5362 Ų6244%0.43835%0.346SS..THydrogen-bonded Turntrans-72.90.7173.300000113.5L179 L180 R181 L185L179-A183 WeakPolarHBondContact O-CB 3.48Å; L179-A183 PolarHBondContact O-N 2.92Å; L180-A183 CarbonylContact O-C 3.51Å; L180-A183 PolarHBondContact O-N 3.31Å; R181-A183 VanDerWaalsContact C-N 3.29Å; R181-A183 PolarHBondContact O-N 3.14Å; A183-L185 HydrophobicContact CB-CD1 3.96Å; A183-L185 WeakPolarHBondContact O-CD1 3.33Å; A183-L185 PolarHBondContact O-N 2.82Å
184T90.3Very high93.5Very high113 Ų11360 Ų6069%0.69334%0.335SS*.THydrogen-bonded Turntrans62.613.2-177.168.20000115.6L180 R181 L182L180-T184 PolarHBondContact O-N 3.28Å; R181-T184 WeakPolarHBondContact O-CA 2.8Å; R181-T184 PolarHBondContact O-N 2.91Å; L182-T184 PolarHBondContact O-N 3.46Å
185L89.5Confident93.6Very high133 Ų13359 Ų5970%0.69633%0.334SS*.  trans-81.3-18.1176.4-88.168000112.9L180 A183L180-L185 HydrophobicContact CD2-CB 4.37Å; L180-L185 HydrophobicContact CD2-CD2 4.27Å; L180-L185 PolarHBondContact O-N 3.41Å; A183-L185 HydrophobicContact CB-CD1 3.96Å; A183-L185 WeakPolarHBondContact O-CD1 3.33Å; A183-L185 PolarHBondContact O-N 2.82Å
186L89.3Confident93.7Very high36 Ų3659.1 Ų59.119%0.18833%0.326CS..SBendtrans-116.4137.1-178.9-169.673.2000111.4L177 L180 R181 A190 L191L177-L186 HydrophobicContact CB-CD2 3.89Å; L177-L186 HydrophobicContact CD2-CD1 4.43Å; L177-L186 HydrophobicContact CD2-CD2 3.8Å; L177-L186 HydrophobicContact CG-CD2 4.4Å; L177-L186 WeakPolarHBondContact O-CD2 3.41Å; L180-L186 HydrophobicContact CB-CB 3.93Å; L180-L186 PolarHBondContact O-N 3.47Å; R181-L186 HydrophobicContact CB-CB 4.32Å; R181-L186 WeakPolarHBondContact CD-O 3.34Å; L186-A190 HydrophobicContact CD1-CB 3.8Å; L186-A190 HydrophobicContact CD2-CB 4.19Å; L186-A190 HydrophobicContact CG-CB 3.97Å; L186-L191 HydrophobicContact CD2-CB 4.29Å
187Q89.2Confident93.9Very high116 Ų11654.9 Ų54.954%0.54230%0.304SS..  trans-69.3144.4172.5-61.9-176.5-6.100111.2P189 A190Q187-P189 HydrophobicContact CB-CG 4.2Å; Q187-A190 PolarHBondContact O-N 2.84Å
188S89.7Confident93.9Very high47 Ų4754.5 Ų54.533%0.32930%0.302SS..Hα-helixtrans-52.6-44.2177.4-169.80000115.3Y117 A190 L191 A192Y117-S188 WeakPolarHBondContact OH-CB 3.01Å; Y117-S188 PolarHBondContact OH-O 3.11Å; Y117-S188 PolarHBondContact OH-OG 3.2Å; S188-A190 PolarHBondContact O-N 2.98Å; S188-L191 PolarHBondContact O-N 3.31Å; S188-A192 PolarHBondContact O-N 3.5Å
189P92.8Very high93.9Very high15 Ų1553.7 Ų53.710%0.09730%0.298CS..Hα-helixtrans-63.7-27.8-177.221.7-35.2000113.6Y117 V133 I135 Q187 A192 S193Y117-P189 HydrophobicContact CE2-CB 4.4Å; Y117-P189 WeakPolarHBondContact OH-CA 3.38Å; V133-P189 HydrophobicContact CG1-CB 4.16Å; V133-P189 HydrophobicContact CG1-CG 4.23Å; I135-P189 HydrophobicContact CG1-CB 4.13Å; Q187-P189 HydrophobicContact CB-CG 4.2Å; P189-A192 PolarHBondContact O-N 3.44Å; P189-S193 VanDerWaalsContact O-CB 3.28Å; P189-S193 WeakPolarHBondContact O-CB 3.44Å; P189-S193 PolarHBondContact O-N 2.85Å; P189-S193 PolarHBondContact O-OG 2.84Å; P189-S193 VanDerWaalsContact O-OG 3.11Å
190A93.2Very high93.9Very high21 Ų2149 Ų4917%0.17427%0.274CS..Hα-helixtrans-67.4-43.7177.200000111.9L139 L186 Q187 S188 A192 S193 Y194L139-A190 HydrophobicContact CD2-CB 3.7Å; L139-A190 VanDerWaalsContact CD2-O 3.23Å; L139-A190 WeakPolarHBondContact CD2-O 3.49Å; L186-A190 HydrophobicContact CD1-CB 3.8Å; L186-A190 HydrophobicContact CD2-CB 4.19Å; L186-A190 HydrophobicContact CG-CB 3.97Å; Q187-A190 PolarHBondContact O-N 2.84Å; S188-A190 PolarHBondContact O-N 2.98Å; A190-A192 VanDerWaalsContact C-N 3.35Å; A190-S193 PolarHBondContact O-N 2.79Å; A190-S193 PolarHBondContact O-OG 2.97Å; A190-Y194 WeakPolarHBondContact O-CB 3.34Å; A190-Y194 PolarHBondContact O-N 2.71Å; A190-Y194 VanDerWaalsContact O-N 3.07Å
191L94.8Very high93.9Very high34 Ų3446.1 Ų46.118%0.17826%0.26CS..Hα-helixtrans-63.4-43.5174.9179.863.7000111.3L174 L177 L178 R181 L186 S188 G195L174-L191 HydrophobicContact CD1-CD1 3.97Å; L177-L191 HydrophobicContact CB-CD1 3.94Å; L178-L191 HydrophobicContact CB-CD1 4.31Å; L178-L191 HydrophobicContact CD1-CD2 3.84Å; R181-L191 HydrophobicContact CB-CD2 4.13Å; R181-L191 HydrophobicContact CG-CD2 4.07Å; L186-L191 HydrophobicContact CD2-CB 4.29Å; S188-L191 PolarHBondContact O-N 3.31Å; L191-G195 PolarHBondContact O-N 3.28Å
192A94.4Very high94Very high22 Ų2243.4 Ų43.418%0.18225%0.249CC..Hα-helixtrans-63.8-45.2178.800000111.7Y117 S188 P189 A190 G195 F196Y117-A192 HydrophobicContact CE2-CB 4.38Å; S188-A192 PolarHBondContact O-N 3.5Å; P189-A192 PolarHBondContact O-N 3.44Å; A190-A192 VanDerWaalsContact C-N 3.35Å; A192-G195 PolarHBondContact O-N 3.21Å; A192-F196 HydrophobicContact CB-CD2 4.25Å; A192-F196 HydrophobicContact CB-CE2 4.11Å; A192-F196 WeakPolarHBondContact O-CB 3.36Å; A192-F196 WeakPolarHBondContact O-CD2 3.49Å; A192-F196 WeakPolarHBondContact O-CG 3.48Å; A192-F196 PolarHBondContact O-N 2.9Å
193S95.7Very high93.9Very high3 Ų339.8 Ų39.82%0.02123%0.233CC..Hα-helixtrans-64.3-44.8-17965.10000111.7G140 P189 A190 G197G140-S193 WeakPolarHBondContact CA-O 3.32Å; P189-S193 VanDerWaalsContact O-CB 3.28Å; P189-S193 WeakPolarHBondContact O-CB 3.44Å; P189-S193 PolarHBondContact O-N 2.85Å; P189-S193 PolarHBondContact O-OG 2.84Å; P189-S193 VanDerWaalsContact O-OG 3.11Å; A190-S193 PolarHBondContact O-N 2.79Å; A190-S193 PolarHBondContact O-OG 2.97Å; S193-G197 PolarHBondContact O-N 3.07Å
194Y97.1Very high93.7Very high0 Ų038.6 Ų38.60%022%0.217CC..Hα-helixtrans-60.6-48.6174.1-174.3-94.5000111.9L139 L142 L146 P170 L173 L174 L177 A190 G197 L198L139-Y194 HydrophobicContact CD1-CD2 4.32Å; L139-Y194 HydrophobicContact CG-CD2 4.18Å; L139-Y194 WeakPolarHBondContact O-CD2 3.25Å; L142-Y194 HydrophobicContact CG-CE2 4.43Å; L146-Y194 HydrophobicContact CD1-CE2 4.21Å; L146-Y194 WeakPolarHBondContact CD1-OH 3.34Å; P170-Y194 WeakPolarHBondContact CA-OH 3.37Å; P170-Y194 WeakPolarHBondContact O-CE1 3.4Å; P170-Y194 PolarHBondContact O-OH 3.09Å; L173-Y194 WeakPolarHBondContact CB-OH 3.47Å; L173-Y194 HydrophobicContact CD2-CD2 4.35Å; L173-Y194 HydrophobicContact CD2-CE2 3.46Å; L173-Y194 VanDerWaalsContact CD2-CE2 3.46Å; L173-Y194 HydrophobicContact CG-CE1 4.4Å; L173-Y194 HydrophobicContact CG-CE2 3.91Å; L174-Y194 HydrophobicContact CB-CD1 4.24Å; L174-Y194 HydrophobicContact CB-CE1 3.78Å; L174-Y194 HydrophobicContact CD1-CD1 3.64Å; L174-Y194 HydrophobicContact CD1-CE1 4.07Å; L177-Y194 HydrophobicContact CD1-CD1 3.7Å; L177-Y194 HydrophobicContact CD1-CD2 3.82Å; L177-Y194 HydrophobicContact CD1-CE1 4.34Å; L177-Y194 HydrophobicContact CD1-CE2 4.44Å; L177-Y194 HydrophobicContact CD1-CG 3.41Å; L177-Y194 VanDerWaalsContact CD1-CG 3.41Å; A190-Y194 WeakPolarHBondContact O-CB 3.34Å; A190-Y194 PolarHBondContact O-N 2.71Å; A190-Y194 VanDerWaalsContact O-N 3.07Å; Y194-G197 PolarHBondContact O-N 3.27Å; Y194-L198 HydrophobicContact CE1-CD1 4.02Å; Y194-L198 WeakPolarHBondContact O-CB 3.32Å; Y194-L198 PolarHBondContact O-N 2.91Å
195G96.5Very high93.8Very high20 Ų2033.2 Ų33.221%0.20618%0.184CC..Hα-helixtrans-62.7-46.3-17900000112.9L191 A192 G197 L198 L199L191-G195 PolarHBondContact O-N 3.28Å; A192-G195 PolarHBondContact O-N 3.21Å; G195-G197 VanDerWaalsContact C-N 3.34Å; G195-L198 PolarHBondContact O-N 3.37Å; G195-L199 WeakPolarHBondContact O-CB 3.47Å; G195-L199 PolarHBondContact O-N 3.42Å
196F97Very high93.8Very high50 Ų5028 Ų2822%0.21916%0.155CC..Hα-helixtrans-69-32.2175.6-68.6-51.5000112.3V109 L112 A116 A192 L199 S200V109-F196 HydrophobicContact CG2-CB 4.36Å; L112-F196 HydrophobicContact CB-CB 4.37Å; L112-F196 HydrophobicContact CB-CD1 3.89Å; L112-F196 HydrophobicContact CB-CD2 4.34Å; L112-F196 HydrophobicContact CB-CE1 4.26Å; L112-F196 HydrophobicContact CB-CG 3.95Å; L112-F196 HydrophobicContact CD2-CD1 3.85Å; L112-F196 HydrophobicContact CD2-CE1 4.41Å; A116-F196 HydrophobicContact CB-CE2 3.71Å; A116-F196 HydrophobicContact CB-CZ 3.58Å; A192-F196 HydrophobicContact CB-CD2 4.25Å; A192-F196 HydrophobicContact CB-CE2 4.11Å; A192-F196 WeakPolarHBondContact O-CB 3.36Å; A192-F196 WeakPolarHBondContact O-CD2 3.49Å; A192-F196 WeakPolarHBondContact O-CG 3.48Å; A192-F196 PolarHBondContact O-N 2.9Å; F196-L199 PolarHBondContact O-N 3.33Å; F196-S200 WeakPolarHBondContact O-CB 3.45Å; F196-S200 PolarHBondContact O-N 3.15Å; F196-S200 PolarHBondContact O-OG 2.88Å
197G97.2Very high93.7Very high0 Ų029.6 Ų29.60%016%0.16CC..Hα-helixtrans-66.8-43.9175.400000112.5G140 S193 Y194 G195 S200 S201G140-G197 VanDerWaalsContact O-CA 3.31Å; G140-G197 WeakPolarHBondContact O-CA 3.3Å; S193-G197 PolarHBondContact O-N 3.07Å; Y194-G197 PolarHBondContact O-N 3.27Å; G195-G197 VanDerWaalsContact C-N 3.34Å; G197-S200 WeakPolarHBondContact CA-OG 3.27Å; G197-S200 PolarHBondContact O-OG 3.3Å; G197-S200 VanDerWaalsContact O-OG 3.1Å; G197-S201 WeakPolarHBondContact O-CB 3.47Å; G197-S201 PolarHBondContact O-N 2.8Å
198L96.3Very high93.5Very high6 Ų630.7 Ų30.73%0.03116%0.16CC..Hα-helixtrans-60.1-50.1172.5-178.2156.1000111V147 P170 M171 Y194 G195 W202 F224V147-L198 HydrophobicContact CG2-CB 4.39Å; V147-L198 HydrophobicContact CG2-CD2 4.49Å; V147-L198 HydrophobicContact CG2-CG 3.75Å; P170-L198 HydrophobicContact CB-CD1 3.63Å; P170-L198 HydrophobicContact CB-CG 4.4Å; M171-L198 HydrophobicContact SD-CD1 3.91Å; M171-L198 HydrophobicContact SD-CD2 4.28Å; Y194-L198 HydrophobicContact CE1-CD1 4.02Å; Y194-L198 WeakPolarHBondContact O-CB 3.32Å; Y194-L198 PolarHBondContact O-N 2.91Å; G195-L198 PolarHBondContact O-N 3.37Å; L198-W202 WeakPolarHBondContact O-CB 3.41Å; L198-W202 PolarHBondContact O-N 3.08Å; L198-F224 HydrophobicContact CD2-CE2 4.26Å
199L94.9Very high93.3Very high68 Ų6828.7 Ų28.736%0.35615%0.146SC..Hα-helixtrans-65.4-48.1-177.9-179.263000112.1G195 F196 W202 V203G195-L199 WeakPolarHBondContact O-CB 3.47Å; G195-L199 PolarHBondContact O-N 3.42Å; F196-L199 PolarHBondContact O-N 3.33Å; L199-W202 PolarHBondContact O-N 2.87Å; L199-V203 HydrophobicContact CD1-CG2 4.41Å; L199-V203 WeakPolarHBondContact O-CG2 3.38Å; L199-V203 PolarHBondContact O-N 2.97Å
200S95.4Very high92.6Very high14 Ų1437 Ų3710%0.09818%0.176CC..Hα-helixtrans-64.1-43-179.5570000112.3S108 F196 G197 V203 Y204S108-S200 WeakPolarHBondContact OG-CB 3.48Å; S108-S200 PolarHBondContact OG-OG 2.83Å; S108-S200 VanDerWaalsContact OG-OG 3.1Å; F196-S200 WeakPolarHBondContact O-CB 3.45Å; F196-S200 PolarHBondContact O-N 3.15Å; F196-S200 PolarHBondContact O-OG 2.88Å; G197-S200 WeakPolarHBondContact CA-OG 3.27Å; G197-S200 PolarHBondContact O-OG 3.3Å; G197-S200 VanDerWaalsContact O-OG 3.1Å; S200-V203 PolarHBondContact O-N 3.4Å; S200-Y204 VanDerWaalsContact O-CB 3.28Å; S200-Y204 WeakPolarHBondContact O-CB 3.47Å; S200-Y204 PolarHBondContact O-N 3.12Å
201S95.8Very high91.6Very high0 Ų040 Ų400%019%0.186CC..Hα-helixtrans-60.1-46.6173.3173.80000111.3F101 G144 G197 V203 Y204 L205F101-S201 WeakPolarHBondContact CE2-OG 3.45Å; F101-S201 VanDerWaalsContact CZ-OG 3.24Å; F101-S201 WeakPolarHBondContact CZ-OG 3.48Å; G144-S201 WeakPolarHBondContact CA-OG 3.26Å; G144-S201 PolarHBondContact O-OG 3.45Å; G197-S201 WeakPolarHBondContact O-CB 3.47Å; G197-S201 PolarHBondContact O-N 2.8Å; S201-V203 PolarHBondContact O-N 3.2Å; S201-Y204 PolarHBondContact O-N 3.3Å; S201-L205 WeakPolarHBondContact O-CB 3.29Å; S201-L205 VanDerWaalsContact O-CG 3.25Å; S201-L205 WeakPolarHBondContact O-CG 3.32Å; S201-L205 PolarHBondContact O-N 3.46Å; S201-L205 WeakPolarHBondContact OG-CD1 3.39Å
202W94.4Very high90.3Very high36 Ų3644.6 Ų44.614%0.13622%0.221CC..Hα-helixtrans-59.8-47.5177.4-179.776.1000111.5V147 L198 L199 Y204 L205 R206 F207 F222 F224 F227V147-W202 HydrophobicContact CG1-CB 4.01Å; L198-W202 WeakPolarHBondContact O-CB 3.41Å; L198-W202 PolarHBondContact O-N 3.08Å; L199-W202 PolarHBondContact O-N 2.87Å; W202-Y204 VanDerWaalsContact C-N 3.33Å; W202-Y204 PolarHBondContact O-N 3.44Å; W202-L205 PolarHBondContact O-N 3.43Å; W202-R206 HydrophobicContact CH2-CG 4.35Å; W202-R206 HydrophobicContact CZ2-CB 4.43Å; W202-R206 HydrophobicContact CZ2-CG 3.93Å; W202-R206 WeakPolarHBondContact O-CB 3.33Å; W202-R206 PolarHBondContact O-N 3.23Å; W202-F207 HydrophobicContact CH2-CE2 4.2Å; W202-F207 HydrophobicContact CH2-CZ 4.48Å; W202-F207 HydrophobicContact CZ3-CE2 4.17Å; W202-F222 AromaticContact CD1-CE1 3.83Å; W202-F222 AromaticContact CD1-CZ 3.69Å; W202-F222 AromaticContact NE1-CE1 3.99Å; W202-F222 PolarHBondContact NE1-O 3.03Å; W202-F224 HydrophobicContact CD2-CB 4.47Å; W202-F224 AromaticContact CD2-CD2 3.98Å; W202-F224 HydrophobicContact CD2-CD2 3.98Å; W202-F224 HydrophobicContact CE3-CD2 4.18Å; W202-F224 HydrophobicContact CG-CD2 4.32Å; W202-F224 HydrophobicContact CH2-CB 4.02Å; W202-F224 HydrophobicContact CZ2-CB 3.69Å; W202-F227 AromaticContact CD1-CE2 3.35Å; W202-F227 AromaticContact CD1-CZ 3.48Å; W202-F227 VanDerWaalsContact CD1-CZ 3.48Å; W202-F227 HydrophobicContact CG-CE2 4.41Å; W202-F227 HydrophobicContact CG-CZ 4.48Å; W202-F227 AromaticContact NE1-CE2 3.51Å
203V92.2Very high89Confident49 Ų4954.9 Ų54.930%0.29726%0.255SS..Hα-helixtrans-60.6-43.4176.5171.60000111.2L199 S200 S201 F207 Y208L199-V203 HydrophobicContact CD1-CG2 4.41Å; L199-V203 WeakPolarHBondContact O-CG2 3.38Å; L199-V203 PolarHBondContact O-N 2.97Å; S200-V203 PolarHBondContact O-N 3.4Å; S201-V203 PolarHBondContact O-N 3.2Å; V203-F207 HydrophobicContact CG1-CD2 4.19Å; V203-F207 WeakPolarHBondContact O-CB 3.47Å; V203-F207 WeakPolarHBondContact O-CD2 3.16Å; V203-F207 PolarHBondContact O-N 2.93Å; V203-Y208 HydrophobicContact CG1-CD2 4.29Å; V203-Y208 HydrophobicContact CG1-CE2 4.04Å
204Y92.9Very high88.1Confident27 Ų2756 Ų5611%0.10627%0.267CS..Iπ-helixtrans-62.8-52.9179.5178.4-97.9000111.8I100 F101 V104 S200 S201 W202 R206 F207 Y208 Q209I100-Y204 WeakPolarHBondContact CG2-OH 3.09Å; F101-Y204 HydrophobicContact CB-CE1 4.32Å; F101-Y204 AromaticContact CD2-CD1 3.57Å; F101-Y204 HydrophobicContact CD2-CD1 3.57Å; F101-Y204 AromaticContact CD2-CE1 3.74Å; F101-Y204 HydrophobicContact CD2-CE1 3.74Å; F101-Y204 HydrophobicContact CE2-CD1 4.1Å; V104-Y204 HydrophobicContact CB-CD2 4.35Å; V104-Y204 HydrophobicContact CB-CE2 4.36Å; V104-Y204 HydrophobicContact CG1-CD2 3.66Å; V104-Y204 HydrophobicContact CG1-CE2 4.1Å; V104-Y204 HydrophobicContact CG1-CG 4.24Å; V104-Y204 HydrophobicContact CG2-CE2 4.12Å; S200-Y204 VanDerWaalsContact O-CB 3.28Å; S200-Y204 WeakPolarHBondContact O-CB 3.47Å; S200-Y204 PolarHBondContact O-N 3.12Å; S201-Y204 PolarHBondContact O-N 3.3Å; W202-Y204 VanDerWaalsContact C-N 3.33Å; W202-Y204 PolarHBondContact O-N 3.44Å; Y204-R206 VanDerWaalsContact C-N 3.34Å; Y204-R206 PolarHBondContact O-N 3.1Å; Y204-F207 PolarHBondContact O-N 3.03Å; Y204-Y208 CarbonylContact O-C 3.53Å; Y204-Y208 WeakPolarHBondContact O-CA 3.19Å; Y204-Y208 PolarHBondContact O-N 2.89Å; Y204-Q209 HydrophobicContact CD1-CB 4.42Å; Y204-Q209 HydrophobicContact CE1-CB 4.09Å; Y204-Q209 HydrophobicContact CE1-CG 4.36Å; Y204-Q209 PolarHBondContact O-N 2.88Å
205L92.2Very high87.2Confident0 Ų064.1 Ų64.10%030%0.297CS..Iπ-helixtrans-66.7-36.5-179.2-62.8172000111.6W93 F101 V147 A148 S201 W202 Q209 G216 D217 F222W93-L205 HydrophobicContact CH2-CD2 3.87Å; W93-L205 HydrophobicContact CZ2-CD2 3.97Å; F101-L205 HydrophobicContact CD2-CD2 4.14Å; F101-L205 HydrophobicContact CE2-CD1 4.16Å; F101-L205 HydrophobicContact CE2-CD2 3.93Å; F101-L205 HydrophobicContact CE2-CG 4.01Å; V147-L205 HydrophobicContact CG1-CD1 3.97Å; A148-L205 HydrophobicContact CB-CD1 3.95Å; S201-L205 WeakPolarHBondContact O-CB 3.29Å; S201-L205 VanDerWaalsContact O-CG 3.25Å; S201-L205 WeakPolarHBondContact O-CG 3.32Å; S201-L205 PolarHBondContact O-N 3.46Å; S201-L205 WeakPolarHBondContact OG-CD1 3.39Å; W202-L205 PolarHBondContact O-N 3.43Å; L205-Q209 HydrophobicContact CD2-CB 4.49Å; L205-Q209 HydrophobicContact CD2-CG 4.43Å; L205-G216 WeakPolarHBondContact O-CA 3.42Å; L205-D217 PolarHBondContact O-N 3.02Å; L205-F222 HydrophobicContact CB-CE1 3.92Å; L205-F222 HydrophobicContact CB-CZ 3.83Å; L205-F222 HydrophobicContact CD1-CZ 4.22Å
206R88Confident86.4Confident24 Ų2463.9 Ų63.99%0.09129%0.294CS..Iπ-helixtrans-70.8-38.8180-167.974.3-176.254.6-9.5111.8W202 Y204 G216 D217 M218 A219 F222W202-R206 HydrophobicContact CH2-CG 4.35Å; W202-R206 HydrophobicContact CZ2-CB 4.43Å; W202-R206 HydrophobicContact CZ2-CG 3.93Å; W202-R206 WeakPolarHBondContact O-CB 3.33Å; W202-R206 PolarHBondContact O-N 3.23Å; Y204-R206 VanDerWaalsContact C-N 3.34Å; Y204-R206 PolarHBondContact O-N 3.1Å; R206-G216 WeakPolarHBondContact O-CA 3.26Å; R206-D217 WeakPolarHBondContact CD-O 3.35Å; R206-D217 PolarHBondContact NE-O 3.43Å; R206-D217 VanDerWaalsContact NE-O 3.13Å; R206-D217 PolarHBondContact NH1-O 3.27Å; R206-D217 PolarHBondContact O-N 3.05Å; R206-M218 VanDerWaalsContact NH1-CA 3.34Å; R206-M218 PolarHBondContact NH1-SD 3.01Å; R206-M218 PolarHBondContact NH2-O 2.92Å; R206-M218 WeakPolarHBondContact O-CE 3.04Å; R206-A219 PolarHBondContact NH2-O 3.27Å; R206-F222 HydrophobicContact CB-CD1 4.38Å; R206-F222 HydrophobicContact CB-CE1 3.99Å; R206-F222 VanDerWaalsContact CD-CD1 3.49Å
207F87.4Confident85.7Confident70 Ų7062.9 Ų62.931%0.30729%0.292SS..Iπ-helixtrans-123.9-28.5-168.2-58.8-69.8000116W202 V203 Y204 M218 T256W202-F207 HydrophobicContact CH2-CE2 4.2Å; W202-F207 HydrophobicContact CH2-CZ 4.48Å; W202-F207 HydrophobicContact CZ3-CE2 4.17Å; V203-F207 HydrophobicContact CG1-CD2 4.19Å; V203-F207 WeakPolarHBondContact O-CB 3.47Å; V203-F207 WeakPolarHBondContact O-CD2 3.16Å; V203-F207 PolarHBondContact O-N 2.93Å; Y204-F207 PolarHBondContact O-N 3.03Å; F207-M218 HydrophobicContact CD1-CE 3.84Å; F207-M218 HydrophobicContact CE1-CE 4.22Å; F207-T256 HydrophobicContact CE1-CG2 4.09Å
208Y86.4Confident84.7Confident138 Ų13866.3 Ų66.354%0.54131%0.309SS..Iπ-helixtrans-109.3-31.2-168.3-71.2-84.2000114.3V203 Y204 R210V203-Y208 HydrophobicContact CG1-CD2 4.29Å; V203-Y208 HydrophobicContact CG1-CE2 4.04Å; Y204-Y208 CarbonylContact O-C 3.53Å; Y204-Y208 WeakPolarHBondContact O-CA 3.19Å; Y204-Y208 PolarHBondContact O-N 2.89Å; Y208-R210 PolarHBondContact O-N 3.43Å
209Q85.3Confident83.9Confident6 Ų667.4 Ų67.43%0.02832%0.318CS..  trans-54.9127.8-177-173.9-177.211.300110.8Y204 L205 H211 G216Y204-Q209 HydrophobicContact CD1-CB 4.42Å; Y204-Q209 HydrophobicContact CE1-CB 4.09Å; Y204-Q209 HydrophobicContact CE1-CG 4.36Å; Y204-Q209 PolarHBondContact O-N 2.88Å; L205-Q209 HydrophobicContact CD2-CB 4.49Å; L205-Q209 HydrophobicContact CD2-CG 4.43Å; Q209-H211 PolarHBondContact NE2-CE1 2.99Å; Q209-H211 PolarHBondContact OE1-CE1 3.29Å; Q209-H211 VanDerWaalsContact OE1-CE1 3.3Å; Q209-G216 PolarHBondContact O-N 3.49Å
210R78.2Confident83.3Confident190 Ų19069.3 Ų69.372%0.71733%0.329SS*.EExtended strand (participates in β ladder)trans-83.2121.6177.1-67.2179-178.6159.5-0.9108.6Y208Y208-R210 PolarHBondContact O-N 3.43Å
211H70.6Confident82.7Confident83 Ų8373.9 Ų73.938%0.38435%0.348SS..EExtended strand (participates in β ladder)trans-112.5154.8166.5-80.288.8000109.1Q209 R213 G214Q209-H211 PolarHBondContact NE2-CE1 2.99Å; Q209-H211 PolarHBondContact OE1-CE1 3.29Å; Q209-H211 VanDerWaalsContact OE1-CE1 3.3Å; H211-R213 PolarHBondContact O-N 3Å; H211-R213 VanDerWaalsContact O-N 3.15Å; H211-G214 CarbonylContact C-O 3.59Å; H211-G214 WeakPolarHBondContact CA-O 3.35Å; H211-G214 PolarHBondContact N-O 2.79Å; H211-G214 PolarHBondContact O-N 3.47Å
212S68.3Low82.3Confident131 Ų13174 Ų7492%0.91635%0.349SS*.THydrogen-bonded Turntrans-55.3-30.2169.254.80000112.3
213R67.2Low81.9Confident238 Ų23873.7 Ų73.790%0.89835%0.354SS*.THydrogen-bonded Turntrans-86.1-6.2179.9-58.5-178.573.8149.31.9114.5H211H211-R213 PolarHBondContact O-N 3Å; H211-R213 VanDerWaalsContact O-N 3.15Å
214G76.6Confident81.7Confident26 Ų2673.8 Ų73.827%0.26835%0.351SS..EExtended strand (participates in β ladder)trans146.6-162.8-177.400000114.8H211H211-G214 CarbonylContact C-O 3.59Å; H211-G214 WeakPolarHBondContact CA-O 3.35Å; H211-G214 PolarHBondContact N-O 2.79Å; H211-G214 PolarHBondContact O-N 3.47Å
215R77.8Confident81.5Confident171 Ų17173.3 Ų73.365%0.64535%0.352SS*.EExtended strand (participates in β ladder)trans-106123.8179.1-68.8178.167.6152.1-0.1110.6
216G81Confident81.3Confident14 Ų1474.8 Ų74.814%0.14436%0.361CS..SBendtrans65.5173.9177.300000114.2L205 R206 Q209L205-G216 WeakPolarHBondContact O-CA 3.42Å; R206-G216 WeakPolarHBondContact O-CA 3.26Å; Q209-G216 PolarHBondContact O-N 3.49Å
217D80.5Confident81.4Confident30 Ų3073.7 Ų73.716%0.1636%0.357CS..  trans-96.5114.9171.7-174.8-4.8000110.2L205 R206 A219 H221 F222L205-D217 PolarHBondContact O-N 3.02Å; R206-D217 WeakPolarHBondContact CD-O 3.35Å; R206-D217 PolarHBondContact NE-O 3.43Å; R206-D217 VanDerWaalsContact NE-O 3.13Å; R206-D217 PolarHBondContact NH1-O 3.27Å; R206-D217 PolarHBondContact O-N 3.05Å; D217-A219 WeakPolarHBondContact OD1-CB 3.36Å; D217-A219 PolarHBondContact OD1-N 3.47Å; D217-H221 IonicContact OD2-NE2 3.78Å; D217-F222 HydrophobicContact CB-CD1 3.99Å
218M77Confident81.5Confident72 Ų7272.1 Ų72.136%0.35535%0.35SS..  trans-913.8178.5-66-65.1119.500114.8R206 F207R206-M218 VanDerWaalsContact NH1-CA 3.34Å; R206-M218 PolarHBondContact NH1-SD 3.01Å; R206-M218 PolarHBondContact NH2-O 2.92Å; R206-M218 WeakPolarHBondContact O-CE 3.04Å; F207-M218 HydrophobicContact CD1-CE 3.84Å; F207-M218 HydrophobicContact CE1-CE 4.22Å
219A80.2Confident81.5Confident28 Ų2868.3 Ų68.323%0.23134%0.343CS..  trans-70.8150.7-172.700000113.4R206 D217 H221 F222R206-A219 PolarHBondContact NH2-O 3.27Å; D217-A219 WeakPolarHBondContact OD1-CB 3.36Å; D217-A219 PolarHBondContact OD1-N 3.47Å; A219-H221 VanDerWaalsContact C-N 3.32Å; A219-H221 WeakPolarHBondContact CB-CE1 3.29Å; A219-H221 WeakPolarHBondContact CB-ND1 3.44Å; A219-F222 PolarHBondContact O-N 3.43Å
220D81.3Confident81.5Confident108 Ų10874 Ų7458%0.57837%0.369SS*.G310 helixtrans-72.3-27.5178.8-66.8-37.7000111.4F222 A223 K258D220-F222 PolarHBondContact O-N 2.93Å; D220-A223 WeakPolarHBondContact O-CB 3.48Å; D220-A223 PolarHBondContact O-N 2.81Å; D220-A223 VanDerWaalsContact O-N 3.14Å; D220-K258 IonicContact OD1-NZ 3.46Å; D220-K258 PolarHBondContact OD1-NZ 3.48Å; D220-K258 IonicContact OD2-NZ 2.84Å
221H83.5Confident81.9Confident111 Ų11172.1 Ų72.151%0.51437%0.372SS..G310 helixtrans-66.7-24.4175.770.3-98.6000113D217 A219 T226D217-H221 IonicContact OD2-NE2 3.78Å; A219-H221 VanDerWaalsContact C-N 3.32Å; A219-H221 WeakPolarHBondContact CB-CE1 3.29Å; A219-H221 WeakPolarHBondContact CB-ND1 3.44Å; H221-T226 PolarHBondContact O-OG1 3Å
222F87.1Confident82.7Confident1 Ų172.2 Ų72.20%0.00438%0.375CS..G310 helixtrans-97.211.6176.7-167.4-117000113V147 Q151 W202 L205 R206 D217 A219 D220 F227V147-F222 HydrophobicContact CG1-CE2 3.96Å; V147-F222 HydrophobicContact CG1-CZ 3.81Å; Q151-F222 HydrophobicContact CB-CD2 4.04Å; Q151-F222 HydrophobicContact CB-CE2 3.74Å; Q151-F222 HydrophobicContact CB-CZ 4.32Å; Q151-F222 HydrophobicContact CG-CD2 4.21Å; Q151-F222 HydrophobicContact CG-CE2 4.14Å; Q151-F222 HydrophobicContact CG-CZ 4.43Å; W202-F222 AromaticContact CD1-CE1 3.83Å; W202-F222 AromaticContact CD1-CZ 3.69Å; W202-F222 AromaticContact NE1-CE1 3.99Å; W202-F222 PolarHBondContact NE1-O 3.03Å; L205-F222 HydrophobicContact CB-CE1 3.92Å; L205-F222 HydrophobicContact CB-CZ 3.83Å; L205-F222 HydrophobicContact CD1-CZ 4.22Å; R206-F222 HydrophobicContact CB-CD1 4.38Å; R206-F222 HydrophobicContact CB-CE1 3.99Å; R206-F222 VanDerWaalsContact CD-CD1 3.49Å; D217-F222 HydrophobicContact CB-CD1 3.99Å; A219-F222 PolarHBondContact O-N 3.43Å; D220-F222 PolarHBondContact O-N 2.93Å; F222-F227 HydrophobicContact CD2-CE2 4.34Å; F222-F227 AromaticContact CD2-CZ 3.98Å; F222-F227 HydrophobicContact CD2-CZ 3.98Å; F222-F227 HydrophobicContact CE2-CE2 4.32Å; F222-F227 AromaticContact CE2-CZ 3.6Å; F222-F227 HydrophobicContact CE2-CZ 3.6Å; F222-F227 HydrophobicContact CZ-CZ 4.26Å
223A87Confident83.7Confident31 Ų3168.8 Ų68.826%0.25634%0.344SS..SBendtrans-61.8149.7172.700000111.6D220 A225 T226 F227D220-A223 WeakPolarHBondContact O-CB 3.48Å; D220-A223 PolarHBondContact O-N 2.81Å; D220-A223 VanDerWaalsContact O-N 3.14Å; A223-A225 PolarHBondContact O-N 3.13Å; A223-A225 VanDerWaalsContact O-N 3.16Å; A223-T226 HydrophobicContact CB-CG2 4.43Å; A223-T226 PolarHBondContact O-N 2.96Å; A223-T226 VanDerWaalsContact O-N 3.09Å; A223-T226 PolarHBondContact O-OG1 3.37Å; A223-F227 WeakPolarHBondContact O-CD2 3.41Å
224F87.6Confident84.8Confident51 Ų5161.4 Ų61.422%0.22433%0.327CS..G310 helixtrans-57.7-34-177.8-171.4-103.2000113.1L198 W202 T226 F227 F228 V236L198-F224 HydrophobicContact CD2-CE2 4.26Å; W202-F224 HydrophobicContact CD2-CB 4.47Å; W202-F224 AromaticContact CD2-CD2 3.98Å; W202-F224 HydrophobicContact CD2-CD2 3.98Å; W202-F224 HydrophobicContact CE3-CD2 4.18Å; W202-F224 HydrophobicContact CG-CD2 4.32Å; W202-F224 HydrophobicContact CH2-CB 4.02Å; W202-F224 HydrophobicContact CZ2-CB 3.69Å; F224-T226 VanDerWaalsContact C-N 3.32Å; F224-T226 PolarHBondContact O-N 3.32Å; F224-F227 WeakPolarHBondContact O-CB 3.21Å; F224-F227 WeakPolarHBondContact O-CD2 3.26Å; F224-F227 PolarHBondContact O-N 3.07Å; F224-F228 HydrophobicContact CD1-CE2 4.13Å; F224-F228 AromaticContact CE1-CE2 3.65Å; F224-F228 HydrophobicContact CE1-CE2 3.65Å; F224-F228 HydrophobicContact CE1-CZ 4.12Å; F224-F228 HydrophobicContact CZ-CE2 4.1Å; F224-F228 HydrophobicContact CZ-CZ 4.46Å; F224-V236 HydrophobicContact CD1-CG1 3.89Å; F224-V236 HydrophobicContact CE1-CG1 4.17Å
225A88Confident85.5Confident16 Ų1664.8 Ų64.813%0.13234%0.342CS..G310 helixtrans-62.8-35.2178.600000113A223 F227 F228 Q233 V236A223-A225 PolarHBondContact O-N 3.13Å; A223-A225 VanDerWaalsContact O-N 3.16Å; A225-F227 PolarHBondContact O-N 2.9Å; A225-F227 VanDerWaalsContact O-N 3.08Å; A225-F228 PolarHBondContact O-N 2.8Å; A225-Q233 WeakPolarHBondContact O-CG 3.38Å; A225-V236 HydrophobicContact CB-CB 4.45Å; A225-V236 HydrophobicContact CB-CG1 4.26Å
226T88.5Confident86Confident32 Ų3257.6 Ų57.620%0.19632%0.317CS..G310 helixtrans-71.9-5.5-176.266.10000113K150 H221 A223 F224K150-T226 PolarHBondContact NZ-O 3.29Å; K150-T226 PolarHBondContact NZ-OG1 3.32Å; H221-T226 PolarHBondContact O-OG1 3Å; A223-T226 HydrophobicContact CB-CG2 4.43Å; A223-T226 PolarHBondContact O-N 2.96Å; A223-T226 VanDerWaalsContact O-N 3.09Å; A223-T226 PolarHBondContact O-OG1 3.37Å; F224-T226 VanDerWaalsContact C-N 3.32Å; F224-T226 PolarHBondContact O-N 3.32Å
227F89.1Confident86.3Confident1 Ų157.7 Ų57.70%0.00432%0.318CS..G310 helixtrans-76.1-18.3172.5-72.6-96.5000112V147 K150 P170 M171 W202 F222 A223 F224 A225V147-F227 HydrophobicContact CB-CE1 4.23Å; V147-F227 HydrophobicContact CG1-CE1 3.92Å; V147-F227 HydrophobicContact CG1-CZ 3.89Å; V147-F227 HydrophobicContact CG2-CE1 3.93Å; K150-F227 HydrophobicContact CB-CE1 4.43Å; K150-F227 HydrophobicContact CD-CD1 3.59Å; K150-F227 HydrophobicContact CD-CD2 4.36Å; K150-F227 HydrophobicContact CD-CE1 3.31Å; K150-F227 HydrophobicContact CD-CE2 4.11Å; K150-F227 HydrophobicContact CD-CG 4.12Å; K150-F227 HydrophobicContact CD-CZ 3.59Å; K150-F227 HydrophobicContact CG-CE1 4.43Å; K150-F227 VanDerWaalsContact NZ-CA 3.27Å; K150-F227 VanDerWaalsContact NZ-CE2 3.29Å; P170-F227 HydrophobicContact CB-CD1 4.14Å; P170-F227 HydrophobicContact CG-CD1 3.92Å; P170-F227 HydrophobicContact CG-CE1 4.17Å; M171-F227 WeakPolarHBondContact CB-O 3.33Å; M171-F227 HydrophobicContact CG-CB 3.58Å; M171-F227 WeakPolarHBondContact CG-O 3.34Å; M171-F227 HydrophobicContact SD-CB 4.46Å; W202-F227 AromaticContact CD1-CE2 3.35Å; W202-F227 AromaticContact CD1-CZ 3.48Å; W202-F227 VanDerWaalsContact CD1-CZ 3.48Å; W202-F227 HydrophobicContact CG-CE2 4.41Å; W202-F227 HydrophobicContact CG-CZ 4.48Å; W202-F227 AromaticContact NE1-CE2 3.51Å; F222-F227 HydrophobicContact CD2-CE2 4.34Å; F222-F227 AromaticContact CD2-CZ 3.98Å; F222-F227 HydrophobicContact CD2-CZ 3.98Å; F222-F227 HydrophobicContact CE2-CE2 4.32Å; F222-F227 AromaticContact CE2-CZ 3.6Å; F222-F227 HydrophobicContact CE2-CZ 3.6Å; F222-F227 HydrophobicContact CZ-CZ 4.26Å; A223-F227 WeakPolarHBondContact O-CD2 3.41Å; F224-F227 WeakPolarHBondContact O-CB 3.21Å; F224-F227 WeakPolarHBondContact O-CD2 3.26Å; F224-F227 PolarHBondContact O-N 3.07Å; A225-F227 PolarHBondContact O-N 2.9Å; A225-F227 VanDerWaalsContact O-N 3.08Å
228F89.3Confident86.6Confident36 Ų3662 Ų6216%0.15834%0.341CS..SBendtrans-92.1154.5179.6-67.6-103.5000110.8M171 F224 A225 L232 Q233 V236M171-F228 HydrophobicContact CE-CD1 4.18Å; M171-F228 HydrophobicContact CE-CE1 3.42Å; M171-F228 VanDerWaalsContact CE-CE1 3.42Å; M171-F228 HydrophobicContact CE-CE2 3.89Å; M171-F228 HydrophobicContact CE-CZ 3.24Å; M171-F228 HydrophobicContact CG-CD2 4.29Å; M171-F228 HydrophobicContact CG-CE2 4.24Å; M171-F228 HydrophobicContact CG-CZ 4.46Å; M171-F228 HydrophobicContact SD-CE2 4.09Å; M171-F228 HydrophobicContact SD-CZ 4.04Å; F224-F228 HydrophobicContact CD1-CE2 4.13Å; F224-F228 AromaticContact CE1-CE2 3.65Å; F224-F228 HydrophobicContact CE1-CE2 3.65Å; F224-F228 HydrophobicContact CE1-CZ 4.12Å; F224-F228 HydrophobicContact CZ-CE2 4.1Å; F224-F228 HydrophobicContact CZ-CZ 4.46Å; A225-F228 PolarHBondContact O-N 2.8Å; F228-L232 HydrophobicContact CB-CB 4.06Å; F228-L232 HydrophobicContact CD1-CB 4.41Å; F228-L232 HydrophobicContact CD1-CD1 4.33Å; F228-Q233 WeakPolarHBondContact O-CG 3.41Å; F228-Q233 PolarHBondContact O-NE2 2.9Å; F228-V236 HydrophobicContact CB-CG2 4.5Å; F228-V236 HydrophobicContact CD1-CG2 3.84Å; F228-V236 HydrophobicContact CD2-CB 4.25Å; F228-V236 HydrophobicContact CD2-CG1 3.81Å; F228-V236 HydrophobicContact CD2-CG2 3.94Å; F228-V236 HydrophobicContact CE1-CG2 3.92Å; F228-V236 HydrophobicContact CE2-CB 4.44Å; F228-V236 HydrophobicContact CE2-CG1 3.67Å; F228-V236 HydrophobicContact CE2-CG2 4.06Å; F228-V236 HydrophobicContact CG-CG2 3.83Å; F228-V236 HydrophobicContact CZ-CG1 4.23Å; F228-V236 HydrophobicContact CZ-CG2 4.02Å
229P86.8Confident87.2Confident59 Ų5963.9 Ų63.938%0.38335%0.351SS..  trans-51.9147168-23.132.8000111.2I231 L232 Q233P229-I231 PolarHBondContact O-N 3.38Å; P229-L232 PolarHBondContact O-N 3.27Å; P229-Q233 WeakPolarHBondContact O-CG 3.33Å; P229-Q233 PolarHBondContact O-N 3.18Å
230E85.4Confident87.4Confident125 Ų12564.1 Ų64.158%0.58435%0.354SS*.THydrogen-bonded Turntrans-48-36.9-174.2-71166.1-145.500113.6R165 L232 Q233 P234R165-E230 IonicContact CZ-OE1 3.22Å; R165-E230 IonicContact NH1-OE1 3.39Å; R165-E230 IonicContact NH2-OE1 2.64Å; R165-E230 PolarHBondContact NH2-OE1 3.31Å; E230-L232 VanDerWaalsContact C-N 3.31Å; E230-L232 PolarHBondContact O-N 2.96Å; E230-Q233 PolarHBondContact O-N 3.14Å; E230-P234 WeakPolarHBondContact O-CD 3.49Å
231I87.9Confident87.6Confident151 Ų15164 Ų6477%0.77435%0.353SS*.THydrogen-bonded Turntrans-62.3-35.1179.4-59.8145.5000112.5P229P229-I231 PolarHBondContact O-N 3.38Å
232L87.3Confident87.7Confident84 Ų8464.3 Ų64.344%0.4436%0.358SS..THydrogen-bonded Turntrans-93.9-15.1-176.6-70.3175000113.2F228 P229 E230 V235 V236F228-L232 HydrophobicContact CB-CB 4.06Å; F228-L232 HydrophobicContact CD1-CB 4.41Å; F228-L232 HydrophobicContact CD1-CD1 4.33Å; P229-L232 PolarHBondContact O-N 3.27Å; E230-L232 VanDerWaalsContact C-N 3.31Å; E230-L232 PolarHBondContact O-N 2.96Å; L232-V235 PolarHBondContact O-N 3.41Å; L232-V236 WeakPolarHBondContact O-CG2 3.38Å; L232-V236 PolarHBondContact O-N 2.84Å
233Q89Confident87.4Confident60 Ų6067.9 Ų67.928%0.2838%0.38SS..Hα-helixtrans-54.2-44.8-178.7-61.4-169.6-200114.7A225 F228 P229 E230 V235 V236 G237A225-Q233 WeakPolarHBondContact O-CG 3.38Å; F228-Q233 WeakPolarHBondContact O-CG 3.41Å; F228-Q233 PolarHBondContact O-NE2 2.9Å; P229-Q233 WeakPolarHBondContact O-CG 3.33Å; P229-Q233 PolarHBondContact O-N 3.18Å; E230-Q233 PolarHBondContact O-N 3.14Å; Q233-V235 PolarHBondContact O-N 3.41Å; Q233-V236 PolarHBondContact O-N 3.32Å; Q233-G237 WeakPolarHBondContact O-CA 3.36Å; Q233-G237 PolarHBondContact O-N 3.04Å
234P89.3Confident87Confident83 Ų8369.3 Ų69.354%0.53938%0.381SS..Hα-helixtrans-65.2-39.718023.8-33.3000112.1E230 G237 L238E230-P234 WeakPolarHBondContact O-CD 3.49Å; P234-G237 PolarHBondContact O-N 3.01Å; P234-L238 WeakPolarHBondContact O-CG 3.21Å; P234-L238 PolarHBondContact O-N 2.72Å
235V91.1Very high86.7Confident97 Ų9770.3 Ų70.359%0.58839%0.394SS*.Hα-helixtrans-65-47.4178.8-178.60000110.5L232 Q233 G237 L238 L239L232-V235 PolarHBondContact O-N 3.41Å; Q233-V235 PolarHBondContact O-N 3.41Å; V235-G237 VanDerWaalsContact C-N 3.34Å; V235-L238 PolarHBondContact O-N 3.13Å; V235-L239 PolarHBondContact O-N 2.97Å; V235-L239 VanDerWaalsContact O-N 3.13Å
236V89Confident86.4Confident20 Ų2074.8 Ų74.812%0.12142%0.415CS..Hα-helixtrans-67.7-37178.3176.80000111.2F224 A225 F228 L232 Q233 L239 A240F224-V236 HydrophobicContact CD1-CG1 3.89Å; F224-V236 HydrophobicContact CE1-CG1 4.17Å; A225-V236 HydrophobicContact CB-CB 4.45Å; A225-V236 HydrophobicContact CB-CG1 4.26Å; F228-V236 HydrophobicContact CB-CG2 4.5Å; F228-V236 HydrophobicContact CD1-CG2 3.84Å; F228-V236 HydrophobicContact CD2-CB 4.25Å; F228-V236 HydrophobicContact CD2-CG1 3.81Å; F228-V236 HydrophobicContact CD2-CG2 3.94Å; F228-V236 HydrophobicContact CE1-CG2 3.92Å; F228-V236 HydrophobicContact CE2-CB 4.44Å; F228-V236 HydrophobicContact CE2-CG1 3.67Å; F228-V236 HydrophobicContact CE2-CG2 4.06Å; F228-V236 HydrophobicContact CG-CG2 3.83Å; F228-V236 HydrophobicContact CZ-CG1 4.23Å; F228-V236 HydrophobicContact CZ-CG2 4.02Å; L232-V236 WeakPolarHBondContact O-CG2 3.38Å; L232-V236 PolarHBondContact O-N 2.84Å; Q233-V236 PolarHBondContact O-N 3.32Å; V236-L239 PolarHBondContact O-N 3.28Å; V236-A240 VanDerWaalsContact O-CB 3.26Å; V236-A240 WeakPolarHBondContact O-CB 3.43Å; V236-A240 PolarHBondContact O-N 3.27Å
237G86.9Confident85.8Confident15 Ų1576.1 Ų76.116%0.15542%0.421CS..Hα-helixtrans-61.3-44.4176.700000112.1Q233 P234 V235 A240 N241Q233-G237 WeakPolarHBondContact O-CA 3.36Å; Q233-G237 PolarHBondContact O-N 3.04Å; P234-G237 PolarHBondContact O-N 3.01Å; V235-G237 VanDerWaalsContact C-N 3.34Å; G237-A240 PolarHBondContact O-N 3.44Å; G237-N241 WeakPolarHBondContact O-CB 3.47Å; G237-N241 PolarHBondContact O-N 3.1Å; G237-N241 PolarHBondContact O-ND2 2.96Å; G237-N241 VanDerWaalsContact O-ND2 3.13Å
238L88.4Confident85.2Confident121 Ų12178.2 Ų78.263%0.63443%0.434SS*.Hα-helixtrans-60-48.6173.1-70.4172.1000111.2P234 V235 A240 N241 L242P234-L238 WeakPolarHBondContact O-CG 3.21Å; P234-L238 PolarHBondContact O-N 2.72Å; V235-L238 PolarHBondContact O-N 3.13Å; L238-A240 PolarHBondContact O-N 3.02Å; L238-N241 PolarHBondContact O-N 2.97Å; L238-L242 WeakPolarHBondContact O-CG 3.24Å; L238-L242 PolarHBondContact O-N 2.78Å
239L87.9Confident84.8Confident111 Ų11185 Ų8558%0.58146%0.463SS*.Hα-helixtrans-63.3-43.2-179.4-171.261.5000112.3V235 V236 N241 L242 V243V235-L239 PolarHBondContact O-N 2.97Å; V235-L239 VanDerWaalsContact O-N 3.13Å; V236-L239 PolarHBondContact O-N 3.28Å; L239-N241 VanDerWaalsContact C-N 3.34Å; L239-N241 PolarHBondContact O-N 3.13Å; L239-L242 PolarHBondContact O-N 3.4Å; L239-V243 WeakPolarHBondContact O-CG2 3.18Å; L239-V243 PolarHBondContact O-N 2.98Å
240A85.3Confident84.6Confident34 Ų3486.5 Ų86.528%0.28147%0.471SS..Hα-helixtrans-62.7-40.817700000111.7V236 G237 L238 V243 H244V236-A240 VanDerWaalsContact O-CB 3.26Å; V236-A240 WeakPolarHBondContact O-CB 3.43Å; V236-A240 PolarHBondContact O-N 3.27Å; G237-A240 PolarHBondContact O-N 3.44Å; L238-A240 PolarHBondContact O-N 3.02Å; A240-V243 PolarHBondContact O-N 3.46Å; A240-H244 WeakPolarHBondContact O-CB 3.39Å; A240-H244 PolarHBondContact O-N 3.39Å
241N84.4Confident83.8Confident104 Ų10489.6 Ų89.656%0.55648%0.482SS*.Hα-helixtrans-66.7-37.1176.6-73.3-25.5000112.4G237 L238 L239 S245G237-N241 WeakPolarHBondContact O-CB 3.47Å; G237-N241 PolarHBondContact O-N 3.1Å; G237-N241 PolarHBondContact O-ND2 2.96Å; G237-N241 VanDerWaalsContact O-ND2 3.13Å; L238-N241 PolarHBondContact O-N 2.97Å; L239-N241 VanDerWaalsContact C-N 3.34Å; L239-N241 PolarHBondContact O-N 3.13Å; N241-S245 VanDerWaalsContact O-CB 3.29Å; N241-S245 WeakPolarHBondContact O-CB 3.09Å; N241-S245 PolarHBondContact O-N 2.84Å; N241-S245 PolarHBondContact O-OG 3.09Å
242L86Confident82.9Confident119 Ų11988.1 Ų88.162%0.62348%0.475SS*.Hα-helixtrans-64.2-47.5174.2-70.1174.7000111.4L238 L239 S245 L246L238-L242 WeakPolarHBondContact O-CG 3.24Å; L238-L242 PolarHBondContact O-N 2.78Å; L239-L242 PolarHBondContact O-N 3.4Å; L242-S245 PolarHBondContact O-N 3.46Å; L242-L246 WeakPolarHBondContact O-CB 3.28Å; L242-L246 PolarHBondContact O-N 3.16Å
243V82.2Confident81.6Confident76 Ų7686.1 Ų86.146%0.46147%0.468SS..Hα-helixtrans-61.6-45.6177.3172.80000110.8L239 A240 S245 L246 L247L239-V243 WeakPolarHBondContact O-CG2 3.18Å; L239-V243 PolarHBondContact O-N 2.98Å; A240-V243 PolarHBondContact O-N 3.46Å; V243-S245 PolarHBondContact O-N 3.23Å; V243-L246 PolarHBondContact O-N 3.14Å; V243-L247 HydrophobicContact CG1-CD1 3.72Å; V243-L247 WeakPolarHBondContact O-CB 3.16Å; V243-L247 WeakPolarHBondContact O-CD1 3.4Å; V243-L247 WeakPolarHBondContact O-CG 3.26Å; V243-L247 PolarHBondContact O-N 3.07Å
244H77.9Confident80.3Confident60 Ų6092 Ų9228%0.27850%0.495SS..Hα-helixtrans-61.4-43.2176.2179.7-92.3000111.8A240 L246 L247 V248A240-H244 WeakPolarHBondContact O-CB 3.39Å; A240-H244 PolarHBondContact O-N 3.39Å; H244-L246 VanDerWaalsContact C-N 3.31Å; H244-L246 PolarHBondContact O-N 3.3Å; H244-L247 PolarHBondContact O-N 3.08Å; H244-V248 VanDerWaalsContact O-CG2 3.32Å; H244-V248 WeakPolarHBondContact O-CG2 3.41Å; H244-V248 PolarHBondContact O-N 3.38Å
245S80.4Confident78.8Confident73 Ų7394.8 Ų94.851%0.5150%0.499SS..Hα-helixtrans-62.7-39.4177.4-60.20000111.9N241 L242 V243 K249N241-S245 VanDerWaalsContact O-CB 3.29Å; N241-S245 WeakPolarHBondContact O-CB 3.09Å; N241-S245 PolarHBondContact O-N 2.84Å; N241-S245 PolarHBondContact O-OG 3.09Å; L242-S245 PolarHBondContact O-N 3.46Å; V243-S245 PolarHBondContact O-N 3.23Å; S245-K249 WeakPolarHBondContact O-CB 3.46Å; S245-K249 PolarHBondContact O-N 3.47Å
246L81.6Confident77.3Confident110 Ų11092.9 Ų92.958%0.57649%0.487SS*.Hα-helixtrans-64.6-46.9174.6-173.667.5000111.3L242 V243 H244 V248 K249 V250L242-L246 WeakPolarHBondContact O-CB 3.28Å; L242-L246 PolarHBondContact O-N 3.16Å; V243-L246 PolarHBondContact O-N 3.14Å; H244-L246 VanDerWaalsContact C-N 3.31Å; H244-L246 PolarHBondContact O-N 3.3Å; L246-V248 PolarHBondContact O-N 2.86Å; L246-K249 WeakPolarHBondContact O-CB 3.35Å; L246-K249 PolarHBondContact O-N 3.12Å; L246-K249 VanDerWaalsContact O-N 3.14Å; L246-V250 WeakPolarHBondContact O-CG2 3.49Å; L246-V250 PolarHBondContact O-N 3.05Å
247L76.6Confident75.6Confident59 Ų5995.5 Ų95.531%0.30950%0.503SS..Hα-helixtrans-62.1-39.7178.7-78.4157.2000113V243 H244 K249 V250 K251 I252 C253V243-L247 HydrophobicContact CG1-CD1 3.72Å; V243-L247 WeakPolarHBondContact O-CB 3.16Å; V243-L247 WeakPolarHBondContact O-CD1 3.4Å; V243-L247 WeakPolarHBondContact O-CG 3.26Å; V243-L247 PolarHBondContact O-N 3.07Å; H244-L247 PolarHBondContact O-N 3.08Å; L247-K249 VanDerWaalsContact C-N 3.35Å; L247-V250 PolarHBondContact O-N 3.19Å; L247-K251 PolarHBondContact O-N 2.61Å; L247-I252 HydrophobicContact CD2-CB 4.13Å; L247-I252 HydrophobicContact CD2-CD1 4.35Å; L247-I252 HydrophobicContact CD2-CG2 4.02Å; L247-I252 PolarHBondContact O-N 3.12Å; L247-C253 HydrophobicContact CB-CB 4.13Å; L247-C253 PolarHBondContact O-N 3.31Å
248V77.1Confident74Confident45 Ų4599.3 Ų99.327%0.27352%0.516SS..Hα-helixtrans-66.5-39174.1172.30000110.6H244 L246 V250 K251 C253H244-V248 VanDerWaalsContact O-CG2 3.32Å; H244-V248 WeakPolarHBondContact O-CG2 3.41Å; H244-V248 PolarHBondContact O-N 3.38Å; L246-V248 PolarHBondContact O-N 2.86Å; V248-V250 VanDerWaalsContact C-N 3.35Å; V248-V250 PolarHBondContact O-N 2.99Å; V248-K251 WeakPolarHBondContact O-CA 3.27Å; V248-K251 PolarHBondContact O-N 3.12Å; V248-C253 HydrophobicContact CG2-CB 4.07Å
249K79.6Confident72.1Confident179 Ų179104.1 Ų104.178%0.77853%0.525SS*.Hα-helixtrans-65.1-37.4176.7-171.5175.5-179.7178.70112.4S245 L246 L247 K251S245-K249 WeakPolarHBondContact O-CB 3.46Å; S245-K249 PolarHBondContact O-N 3.47Å; L246-K249 WeakPolarHBondContact O-CB 3.35Å; L246-K249 PolarHBondContact O-N 3.12Å; L246-K249 VanDerWaalsContact O-N 3.14Å; L247-K249 VanDerWaalsContact C-N 3.35Å; K249-K251 PolarHBondContact O-N 2.65Å
250V82.8Confident70.1Confident90 Ų90103.5 Ų103.555%0.54552%0.516SS..THydrogen-bonded Turntrans-77.41.1174.4-171.90000111.7L246 L247 V248 I252L246-V250 WeakPolarHBondContact O-CG2 3.49Å; L246-V250 PolarHBondContact O-N 3.05Å; L247-V250 PolarHBondContact O-N 3.19Å; V248-V250 VanDerWaalsContact C-N 3.35Å; V248-V250 PolarHBondContact O-N 2.99Å; V250-I252 HydrophobicContact CB-CD1 4.09Å; V250-I252 HydrophobicContact CB-CG1 4.18Å; V250-I252 HydrophobicContact CG1-CD1 3.59Å; V250-I252 HydrophobicContact CG1-CG1 3.84Å; V250-I252 PolarHBondContact O-N 3.23Å
251K70Confident68.2Low190 Ų190108.1 Ų108.183%0.82654%0.536SS*.THydrogen-bonded Turntrans59.817.3-177.1-61.3-177.5172.3177.80114.7L247 V248 K249L247-K251 PolarHBondContact O-N 2.61Å; V248-K251 WeakPolarHBondContact O-CA 3.27Å; V248-K251 PolarHBondContact O-N 3.12Å; K249-K251 PolarHBondContact O-N 2.65Å
252I67.6Low66.6Low120 Ų120109 Ų10962%0.61554%0.544SS*.SBendtrans-75.8-35.4175.6-62.7171.7000109.8L247 V250L247-I252 HydrophobicContact CD2-CB 4.13Å; L247-I252 HydrophobicContact CD2-CD1 4.35Å; L247-I252 HydrophobicContact CD2-CG2 4.02Å; L247-I252 PolarHBondContact O-N 3.12Å; V250-I252 HydrophobicContact CB-CD1 4.09Å; V250-I252 HydrophobicContact CB-CG1 4.18Å; V250-I252 HydrophobicContact CG1-CD1 3.59Å; V250-I252 HydrophobicContact CG1-CG1 3.84Å; V250-I252 PolarHBondContact O-N 3.23Å
253C60.7Low64.8Low43 Ų43106.4 Ų106.429%0.29155%0.547SS..SBendtrans-107.4136.2175.4-67.10000111.4L247 V248L247-C253 HydrophobicContact CB-CB 4.13Å; L247-C253 PolarHBondContact O-N 3.31Å; V248-C253 HydrophobicContact CG2-CB 4.07Å
254Q61.3Low63.1Low182 Ų182105.5 Ų105.585%0.8555%0.548SS*.  trans-74.2140.8165.4-65-167.9-7.500109.3T256Q254-T256 PolarHBondContact O-N 2.91Å
255K57.9Low61.4Low142 Ų142109.2 Ų109.262%0.61758%0.577SS**  trans-55.6116.6173.2-166.5172.7-177.6-177.90107.5V257 P273K255-V257 PolarHBondContact O-N 3.34Å; K255-P273 HydrophobicContact CD-CB 4.16Å; K255-P273 HydrophobicContact CD-CG 3.98Å; K255-P273 HydrophobicContact CG-CG 4.34Å
256T59Low59.8Low57 Ų57108.6 Ų108.635%0.3557%0.572SS.*  trans-59108.1-178.944.40000108.7F207 Q254 K258F207-T256 HydrophobicContact CE1-CG2 4.09Å; Q254-T256 PolarHBondContact O-N 2.91Å; T256-K258 VanDerWaalsContact C-N 3.32Å; T256-K258 PolarHBondContact O-N 3.44Å
257V53.5Low58Low76 Ų76108.7 Ų108.746%0.46158%0.583SS.*  trans-72.995.5172.4-177.90000105.8K255 R259 L272 P273K255-V257 PolarHBondContact O-N 3.34Å; V257-R259 PolarHBondContact O-N 3.33Å; V257-L272 HydrophobicContact CG1-CD1 4.22Å; V257-P273 HydrophobicContact CG2-CG 4.14Å
258K54.1Low56.7Low95 Ų95110.5 Ų110.541%0.41359%0.591SS.*  trans-58.3107.3167.5-74.6-167.5173.2-159.50106.8D220 T256 Y260D220-K258 IonicContact OD1-NZ 3.46Å; D220-K258 PolarHBondContact OD1-NZ 3.48Å; D220-K258 IonicContact OD2-NZ 2.84Å; T256-K258 VanDerWaalsContact C-N 3.32Å; T256-K258 PolarHBondContact O-N 3.44Å; K258-Y260 HydrophobicContact CB-CD2 4.09Å; K258-Y260 HydrophobicContact CB-CE2 3.51Å; K258-Y260 HydrophobicContact CD-CE2 4.34Å; K258-Y260 WeakPolarHBondContact CD-OH 3.49Å; K258-Y260 WeakPolarHBondContact O-CD2 3.35Å; K258-Y260 PolarHBondContact O-N 2.98Å; K258-Y260 VanDerWaalsContact O-N 3.1Å
259R47.8Very low55.5Low221 Ų221113.1 Ų113.183%0.83461%0.608SS**  trans-73.199.6169.2-77-170.1178.6161.7-1.2106.8V257V257-R259 PolarHBondContact O-N 3.33Å
260Y45.9Very low54.2Low99 Ų99107.6 Ų107.639%0.38859%0.586SS.*  trans-77120.5164-66.2-86.3000106.9K258 V262 I270K258-Y260 HydrophobicContact CB-CD2 4.09Å; K258-Y260 HydrophobicContact CB-CE2 3.51Å; K258-Y260 HydrophobicContact CD-CE2 4.34Å; K258-Y260 WeakPolarHBondContact CD-OH 3.49Å; K258-Y260 WeakPolarHBondContact O-CD2 3.35Å; K258-Y260 PolarHBondContact O-N 2.98Å; K258-Y260 VanDerWaalsContact O-N 3.1Å; Y260-V262 PolarHBondContact O-N 3.01Å; Y260-V262 VanDerWaalsContact O-N 3.15Å; Y260-I270 HydrophobicContact CD2-CG1 4.45Å
261D46.2Very low52.5Low131 Ų131108 Ų10870%0.70159%0.593SS**  trans-65.7111169.5-170.8-5.7000107.7G263D261-G263 PolarHBondContact O-N 3.19Å; D261-G263 VanDerWaalsContact O-N 3.16Å; D261-G263 PolarHBondContact OD1-N 2.79Å; D261-G263 VanDerWaalsContact OD1-N 3.1Å
262V49.7Very low51.7Low121 Ų121103.1 Ų103.173%0.73358%0.576SS**THydrogen-bonded Turntrans-69.8-2179.4-72.70000112.7Y260 I270Y260-V262 PolarHBondContact O-N 3.01Å; Y260-V262 VanDerWaalsContact O-N 3.15Å; V262-I270 HydrophobicContact CG1-CD1 3.35Å
263G48Very low50.7Low66 Ų66100.5 Ų100.568%0.6857%0.566SS**THydrogen-bonded Turntrans-76.1-17.6176.500000115.1D261D261-G263 PolarHBondContact O-N 3.19Å; D261-G263 VanDerWaalsContact O-N 3.16Å; D261-G263 PolarHBondContact OD1-N 2.79Å; D261-G263 VanDerWaalsContact OD1-N 3.1Å
264A47.4Very low50.5Low57 Ų57102.6 Ų102.647%0.47160%0.595SS.*SBendtrans-101.6130.9173.300000109.7S266A264-S266 PolarHBondContact O-N 2.88Å
265P41.3Very low50.4Low138 Ų13895.9 Ų95.990%0.89657%0.566SS**  trans-74.669.7179.933.6-34.3000109.2
266S47.4Very low50.6Low59 Ų5993.3 Ų93.341%0.41356%0.559SS.*  trans-89.9126.7162.257.40000107.1A264 I268A264-S266 PolarHBondContact O-N 2.88Å; S266-I268 PolarHBondContact O-N 3.19Å
267S45.1Very low51Low113 Ų11394.9 Ų94.979%0.7957%0.571SS**  trans-67.519.5179.949.50000113.8T269S267-T269 PolarHBondContact O-N 3.3Å
268I49.4Very low52Low96 Ų9698.3 Ų98.349%0.49258%0.582SS.*  trans-88.5106.9-175.3-58.9173.9000108.3S266 I270S266-I268 PolarHBondContact O-N 3.19Å; I268-I270 PolarHBondContact O-N 3.21Å
269T51.2Low53Low100 Ų10097.1 Ų97.161%0.61358%0.58SS**  trans-54.1114.7170.2220000111.1S267 S271S267-T269 PolarHBondContact O-N 3.3Å; T269-S271 PolarHBondContact O-N 3.23Å
270I51.6Low54.2Low63 Ų6388.3 Ų88.332%0.32355%0.554SS.*  trans-72.7105.8178.9-62.9173.2000108.9Y260 V262 I268 L272Y260-I270 HydrophobicContact CD2-CG1 4.45Å; V262-I270 HydrophobicContact CG1-CD1 3.35Å; I268-I270 PolarHBondContact O-N 3.21Å; I270-L272 HydrophobicContact CG2-CD1 3.93Å; I270-L272 PolarHBondContact O-N 3.15Å
271S47.5Very low55.9Low100 Ų10087.1 Ų87.170%0.69955%0.552SS**  trans-85.689.5166.446.60000109.1T269T269-S271 PolarHBondContact O-N 3.23Å
272L53Low57.7Low87 Ų8789.1 Ų89.146%0.45555%0.55SS..  trans-67.1127.7169.1-135.472.5000108.4V257 I270 G274 T275V257-L272 HydrophobicContact CG1-CD1 4.22Å; I270-L272 HydrophobicContact CG2-CD1 3.93Å; I270-L272 PolarHBondContact O-N 3.15Å; L272-G274 PolarHBondContact O-N 3.35Å; L272-T275 PolarHBondContact O-N 3.1Å
273P46.5Very low59.2Low65 Ų6591.7 Ų91.742%0.42255%0.547SS..THydrogen-bonded Turntrans-60.2111.8175.8-22.533.9000110.3K255 V257K255-P273 HydrophobicContact CD-CB 4.16Å; K255-P273 HydrophobicContact CD-CG 3.98Å; K255-P273 HydrophobicContact CG-CG 4.34Å; V257-P273 HydrophobicContact CG2-CG 4.14Å
274G57.7Low60.8Low87 Ų8794.6 Ų94.690%0.89754%0.537SS*.THydrogen-bonded Turntrans105.3-8.6-178.700000115.2L272L272-G274 PolarHBondContact O-N 3.35Å
275T57.9Low62.9Low40 Ų4096.3 Ų96.325%0.24554%0.535CS..SBendtrans-101.1116.5167.5-55.20000107.9L272 D279 A280L272-T275 PolarHBondContact O-N 3.1Å; T275-D279 HydrophobicContact CG2-CB 4.25Å; T275-A280 HydrophobicContact CG2-CB 4.29Å
276D63Low65.3Low88 Ų8895.4 Ų95.447%0.47152%0.522SS..  trans-56.6129.8175.8-146.4-43.9000108.6Q278 D279 A280D276-Q278 PolarHBondContact O-N 3.16Å; D276-D279 HydrophobicContact CB-CB 4.46Å; D276-D279 WeakPolarHBondContact O-CB 3.48Å; D276-D279 PolarHBondContact O-N 2.72Å; D276-A280 PolarHBondContact O-N 3.08Å
277P66.4Low67.3Low90 Ų9095.4 Ų95.458%0.58453%0.526SS*.Hα-helixtrans-50.3-30.2177.217.9-34.1000113A280 E281P277-A280 PolarHBondContact O-N 2.86Å; P277-E281 WeakPolarHBondContact O-CB 3.42Å; P277-E281 PolarHBondContact O-N 3.42Å
278Q74.3Confident69.5Low149 Ų14994.2 Ų94.270%0.69651%0.51SS*.Hα-helixtrans-65.5-39175.4-64.6-172.7-35.400112.8D276 E281 R282D276-Q278 PolarHBondContact O-N 3.16Å; Q278-E281 PolarHBondContact O-N 3.49Å; Q278-R282 VanDerWaalsContact O-CB 3.27Å; Q278-R282 WeakPolarHBondContact O-CB 3.27Å; Q278-R282 PolarHBondContact O-N 3.02Å
279D75Confident71.6Confident70 Ų7096.8 Ų96.837%0.37452%0.518SS..Hα-helixtrans-71.2-37.6177.4-81.8-26.2000112T275 D276 R282 R283T275-D279 HydrophobicContact CG2-CB 4.25Å; D276-D279 HydrophobicContact CB-CB 4.46Å; D276-D279 WeakPolarHBondContact O-CB 3.48Å; D276-D279 PolarHBondContact O-N 2.72Å; D279-R282 PolarHBondContact O-N 3.47Å; D279-R283 WeakPolarHBondContact O-CB 3.44Å; D279-R283 VanDerWaalsContact O-CG 3.27Å; D279-R283 WeakPolarHBondContact O-CG 3.42Å; D279-R283 PolarHBondContact O-N 3.42Å
280A73.4Confident73.6Confident36 Ų3693.9 Ų93.930%0.29850%0.504SS..Hα-helixtrans-63-45.1174.600000111T275 D276 P277 R283 R284T275-A280 HydrophobicContact CG2-CB 4.29Å; D276-A280 PolarHBondContact O-N 3.08Å; P277-A280 PolarHBondContact O-N 2.86Å; A280-R283 PolarHBondContact O-N 3.36Å; A280-R284 WeakPolarHBondContact O-CB 3.46Å; A280-R284 PolarHBondContact O-N 2.93Å
281E82.8Confident75.5Confident74 Ų7495.3 Ų95.335%0.34651%0.512SS..Hα-helixtrans-65.2-41.8176.1-173.954.8-147.300111.5P277 Q278 R283 R284 Q285P277-E281 WeakPolarHBondContact O-CB 3.42Å; P277-E281 PolarHBondContact O-N 3.42Å; Q278-E281 PolarHBondContact O-N 3.49Å; E281-R283 PolarHBondContact O-N 2.91Å; E281-R284 WeakPolarHBondContact O-CB 3.42Å; E281-R284 PolarHBondContact O-N 3.18Å; E281-Q285 WeakPolarHBondContact O-CG 3.37Å; E281-Q285 PolarHBondContact O-N 3.33Å; E281-Q285 PolarHBondContact OE1-NE2 3.06Å; E281-Q285 VanDerWaalsContact OE1-NE2 3.17Å
282R82.8Confident77.8Confident172 Ų17295.7 Ų95.765%0.64951%0.506SS*.Hα-helixtrans-58.3-45.2174-176.5-176.4176.3-163.90.5112Q278 D279 Q285 L286Q278-R282 VanDerWaalsContact O-CB 3.27Å; Q278-R282 WeakPolarHBondContact O-CB 3.27Å; Q278-R282 PolarHBondContact O-N 3.02Å; D279-R282 PolarHBondContact O-N 3.47Å; R282-Q285 PolarHBondContact O-N 3.39Å; R282-L286 WeakPolarHBondContact O-CB 3.26Å; R282-L286 PolarHBondContact O-N 2.95Å
283R81.6Confident79.6Confident176 Ų17696.3 Ų96.366%0.66451%0.506SS*.Hα-helixtrans-65-39.5176.5-72.8175-172.1-168.63.6111.5D279 A280 E281 L286 A287D279-R283 WeakPolarHBondContact O-CB 3.44Å; D279-R283 VanDerWaalsContact O-CG 3.27Å; D279-R283 WeakPolarHBondContact O-CG 3.42Å; D279-R283 PolarHBondContact O-N 3.42Å; A280-R283 PolarHBondContact O-N 3.36Å; E281-R283 PolarHBondContact O-N 2.91Å; R283-L286 PolarHBondContact O-N 2.99Å; R283-A287 WeakPolarHBondContact O-CB 3.47Å; R283-A287 PolarHBondContact O-N 3.45Å
284R82.2Confident81.7Confident127 Ų127101.7 Ų101.748%0.47952%0.518SS..Hα-helixtrans-63.7-45.5176.5-162-178.8-167.9172.14.5111.3A280 E281 L286 A287 L288A280-R284 WeakPolarHBondContact O-CB 3.46Å; A280-R284 PolarHBondContact O-N 2.93Å; E281-R284 WeakPolarHBondContact O-CB 3.42Å; E281-R284 PolarHBondContact O-N 3.18Å; R284-L286 PolarHBondContact O-N 3.3Å; R284-A287 PolarHBondContact O-N 3.17Å; R284-L288 HydrophobicContact CG-CD1 4.33Å; R284-L288 WeakPolarHBondContact O-CB 3.36Å; R284-L288 VanDerWaalsContact O-CG 3.31Å; R284-L288 WeakPolarHBondContact O-CG 3.4Å; R284-L288 PolarHBondContact O-N 3.48Å
285Q91.2Very high83.1Confident93 Ų93102.4 Ų102.444%0.43550%0.501SS..Hα-helixtrans-63.7-39.5176.4-71.8177.68.200112.3E281 R282 L288 K289E281-Q285 WeakPolarHBondContact O-CG 3.37Å; E281-Q285 PolarHBondContact O-N 3.33Å; E281-Q285 PolarHBondContact OE1-NE2 3.06Å; E281-Q285 VanDerWaalsContact OE1-NE2 3.17Å; R282-Q285 PolarHBondContact O-N 3.39Å; Q285-L288 PolarHBondContact O-N 3.2Å; Q285-K289 WeakPolarHBondContact O-CB 3.31Å; Q285-K289 VanDerWaalsContact O-CG 3.26Å; Q285-K289 WeakPolarHBondContact O-CG 3.46Å; Q285-K289 PolarHBondContact O-N 3.37Å
286L90.5Very high84.5Confident119 Ų119106.6 Ų106.662%0.62352%0.516SS*.Hα-helixtrans-66.7-41.2176.4-169140.7000111.7R282 R283 R284 K289 A290R282-L286 WeakPolarHBondContact O-CB 3.26Å; R282-L286 PolarHBondContact O-N 2.95Å; R283-L286 PolarHBondContact O-N 2.99Å; R284-L286 PolarHBondContact O-N 3.3Å; L286-K289 PolarHBondContact O-N 3.1Å; L286-A290 WeakPolarHBondContact O-CB 3.42Å; L286-A290 PolarHBondContact O-N 2.87Å
287A90.4Very high85.5Confident58 Ų58109.3 Ų109.348%0.47952%0.519SS..Hα-helixtrans-64.9-41.6174.600000112.2R283 R284 A290 L291R283-A287 WeakPolarHBondContact O-CB 3.47Å; R283-A287 PolarHBondContact O-N 3.45Å; R284-A287 PolarHBondContact O-N 3.17Å; A287-A290 PolarHBondContact O-N 3.45Å; A287-L291 WeakPolarHBondContact O-CB 3.34Å; A287-L291 PolarHBondContact O-N 2.64Å
288L91.9Very high86.4Confident89 Ų89109.6 Ų109.647%0.46652%0.52SS..Hα-helixtrans-65.2-39.1175.1-74.4171.3000112R284 Q285 L291 N292R284-L288 HydrophobicContact CG-CD1 4.33Å; R284-L288 WeakPolarHBondContact O-CB 3.36Å; R284-L288 VanDerWaalsContact O-CG 3.31Å; R284-L288 WeakPolarHBondContact O-CG 3.4Å; R284-L288 PolarHBondContact O-N 3.48Å; Q285-L288 PolarHBondContact O-N 3.2Å; L288-L291 PolarHBondContact O-N 3.39Å; L288-N292 WeakPolarHBondContact O-CB 3.4Å; L288-N292 PolarHBondContact O-N 3.41Å
289K92.1Very high86.8Confident149 Ų149108 Ų10865%0.64851%0.512SS*.Hα-helixtrans-63.1-47.7173.1-77.5175.7-178.7-178.40111.6Q285 L286 L291 N292 E293Q285-K289 WeakPolarHBondContact O-CB 3.31Å; Q285-K289 VanDerWaalsContact O-CG 3.26Å; Q285-K289 WeakPolarHBondContact O-CG 3.46Å; Q285-K289 PolarHBondContact O-N 3.37Å; L286-K289 PolarHBondContact O-N 3.1Å; K289-L291 VanDerWaalsContact C-N 3.28Å; K289-L291 PolarHBondContact O-N 3.39Å; K289-N292 PolarHBondContact O-N 2.87Å; K289-E293 WeakPolarHBondContact O-CB 3.33Å; K289-E293 PolarHBondContact O-N 3.1Å
290A93.1Very high87Confident39 Ų39108.9 Ų108.932%0.32252%0.517SS..Hα-helixtrans-63-35.2177.500000112.2L286 A287 R294L286-A290 WeakPolarHBondContact O-CB 3.42Å; L286-A290 PolarHBondContact O-N 2.87Å; A287-A290 PolarHBondContact O-N 3.45Å; A290-R294 WeakPolarHBondContact O-CG 3.35Å; A290-R294 PolarHBondContact O-N 2.84Å; A290-R294 VanDerWaalsContact O-N 3.1Å
291L93.3Very high87Confident94 Ų94115 Ų11549%0.49254%0.539SS..Hα-helixtrans-67.9-48.6174.2-175.566.5000111.2A287 L288 K289 E293 R294 L295A287-L291 WeakPolarHBondContact O-CB 3.34Å; A287-L291 PolarHBondContact O-N 2.64Å; L288-L291 PolarHBondContact O-N 3.39Å; K289-L291 VanDerWaalsContact C-N 3.28Å; K289-L291 PolarHBondContact O-N 3.39Å; L291-E293 VanDerWaalsContact C-N 3.27Å; L291-E293 PolarHBondContact O-N 2.9Å; L291-R294 PolarHBondContact O-N 3.39Å; L291-R294 VanDerWaalsContact O-N 3.14Å; L291-L295 WeakPolarHBondContact O-CB 3.34Å; L291-L295 PolarHBondContact O-N 2.87Å
292N93.9Very high86.2Confident108 Ų108114.9 Ų114.958%0.57855%0.546SS*.Hα-helixtrans-61.5-36177.1-82.1-4.2000112.1L288 K289 L295 K296L288-N292 WeakPolarHBondContact O-CB 3.4Å; L288-N292 PolarHBondContact O-N 3.41Å; K289-N292 PolarHBondContact O-N 2.87Å; N292-L295 PolarHBondContact O-N 2.85Å; N292-K296 WeakPolarHBondContact O-CB 3.43Å; N292-K296 PolarHBondContact O-N 3.43Å
293E92Very high84.8Confident99 Ų99112.6 Ų112.646%0.46355%0.546SS..Hα-helixtrans-65.6-41.5174.8-171.7-175.9166.800111.6K289 L291 R297K289-E293 WeakPolarHBondContact O-CB 3.33Å; K289-E293 PolarHBondContact O-N 3.1Å; L291-E293 VanDerWaalsContact C-N 3.27Å; L291-E293 PolarHBondContact O-N 2.9Å; E293-R297 WeakPolarHBondContact O-CB 3.21Å; E293-R297 WeakPolarHBondContact O-CG 3.45Å; E293-R297 PolarHBondContact O-N 3.29Å; E293-R297 IonicContact OE1-CZ 3.86Å; E293-R297 IonicContact OE1-NH1 3.23Å; E293-R297 PolarHBondContact OE1-NH1 2.96Å; E293-R297 IonicContact OE1-NH2 3.89Å; E293-R297 PolarHBondContact OE1-NH2 3.02Å
294R89.6Confident83.4Confident178 Ų178114.8 Ų114.867%0.67255%0.554SS**Hα-helixtrans-65.8-42.4173.4-74176.6-178.4-170.6-0.5111.8A290 L291 R297 V298A290-R294 WeakPolarHBondContact O-CG 3.35Å; A290-R294 PolarHBondContact O-N 2.84Å; A290-R294 VanDerWaalsContact O-N 3.1Å; L291-R294 PolarHBondContact O-N 3.39Å; L291-R294 VanDerWaalsContact O-N 3.14Å; R294-R297 PolarHBondContact O-N 2.88Å; R294-V298 WeakPolarHBondContact O-CG2 3.47Å; R294-V298 PolarHBondContact O-N 3.38Å
295L87.7Confident81.8Confident103 Ų103114.3 Ų114.354%0.53957%0.568SS.*Hα-helixtrans-66.9-41.4-178.7-149141000110.6L291 N292 V298 E299L291-L295 WeakPolarHBondContact O-CB 3.34Å; L291-L295 PolarHBondContact O-N 2.87Å; N292-L295 PolarHBondContact O-N 2.85Å; L295-V298 PolarHBondContact O-N 2.72Å; L295-E299 WeakPolarHBondContact O-CB 3.35Å; L295-E299 PolarHBondContact O-N 3.14Å
296K88.1Confident79.6Confident127 Ų127114.5 Ų114.555%0.55258%0.579SS**Hα-helixtrans-64-42.2172.3-172.4178.3177.6-176.40112.4N292 V298 E299 D300N292-K296 WeakPolarHBondContact O-CB 3.43Å; N292-K296 PolarHBondContact O-N 3.43Å; K296-V298 VanDerWaalsContact C-N 3.26Å; K296-V298 PolarHBondContact O-N 2.88Å; K296-E299 PolarHBondContact O-N 3.37Å; K296-E299 VanDerWaalsContact O-N 3.16Å; K296-D300 WeakPolarHBondContact O-CB 3.45Å; K296-D300 PolarHBondContact O-N 3.4Å
297R83.8Confident77.3Confident145 Ų145117.5 Ų117.555%0.54759%0.592SS.*Hα-helixtrans-59.9-37.1174-79.8179.7179.71357.1112.7E293 R294 Q301E293-R297 WeakPolarHBondContact O-CB 3.21Å; E293-R297 WeakPolarHBondContact O-CG 3.45Å; E293-R297 PolarHBondContact O-N 3.29Å; E293-R297 IonicContact OE1-CZ 3.86Å; E293-R297 IonicContact OE1-NH1 3.23Å; E293-R297 PolarHBondContact OE1-NH1 2.96Å; E293-R297 IonicContact OE1-NH2 3.89Å; E293-R297 PolarHBondContact OE1-NH2 3.02Å; R294-R297 PolarHBondContact O-N 2.88Å; R297-Q301 PolarHBondContact O-N 3.32Å; R297-Q301 VanDerWaalsContact O-N 3.16Å
298V84.2Confident75.1Confident97 Ų97120.9 Ų120.959%0.58860%0.602SS**Hα-helixtrans-70.7-39.4175.4171.90000110.8R294 L295 K296 Q301 S302R294-V298 WeakPolarHBondContact O-CG2 3.47Å; R294-V298 PolarHBondContact O-N 3.38Å; L295-V298 PolarHBondContact O-N 2.72Å; K296-V298 VanDerWaalsContact C-N 3.26Å; K296-V298 PolarHBondContact O-N 2.88Å; V298-Q301 PolarHBondContact O-N 2.8Å; V298-S302 PolarHBondContact O-N 3.23Å; V298-S302 VanDerWaalsContact O-N 3.08Å
299E83.3Confident72.6Confident114 Ų114124 Ų12453%0.53362%0.62SS.*Hα-helixtrans-65-45.8175.6-169.7171.3-16700111.8L295 K296 Q301 S302 I303L295-E299 WeakPolarHBondContact O-CB 3.35Å; L295-E299 PolarHBondContact O-N 3.14Å; K296-E299 PolarHBondContact O-N 3.37Å; K296-E299 VanDerWaalsContact O-N 3.16Å; E299-Q301 VanDerWaalsContact C-N 3.28Å; E299-Q301 PolarHBondContact O-N 3.16Å; E299-S302 WeakPolarHBondContact CA-OG 3.49Å; E299-S302 WeakPolarHBondContact O-CA 3.44Å; E299-S302 WeakPolarHBondContact O-CB 3.43Å; E299-S302 PolarHBondContact O-N 3.46Å; E299-S302 PolarHBondContact O-OG 3.14Å; E299-I303 PolarHBondContact O-N 2.82Å
300D79.6Confident70.2Confident89 Ų89124.5 Ų124.548%0.47663%0.629SS.*Hα-helixtrans-61.6-34.4175.9-70-24.1000111.6K296 S302K296-D300 WeakPolarHBondContact O-CB 3.45Å; K296-D300 PolarHBondContact O-N 3.4Å; D300-S302 VanDerWaalsContact C-N 3.32Å
301Q73.2Confident67.6Low166 Ų166132.4 Ų132.478%0.77666%0.659SS**Hα-helixtrans-71.3-24.6171.4-87.6-176.8-18.300113.6R297 V298 E299R297-Q301 PolarHBondContact O-N 3.32Å; R297-Q301 VanDerWaalsContact O-N 3.16Å; V298-Q301 PolarHBondContact O-N 2.8Å; E299-Q301 VanDerWaalsContact C-N 3.28Å; E299-Q301 PolarHBondContact O-N 3.16Å
302S65.8Low65Low70 Ų70136.8 Ų136.849%0.4968%0.677SS.*Hα-helixtrans-84.1-11.5179.374.50000113.6V298 E299 D300 W304V298-S302 PolarHBondContact O-N 3.23Å; V298-S302 VanDerWaalsContact O-N 3.08Å; E299-S302 WeakPolarHBondContact CA-OG 3.49Å; E299-S302 WeakPolarHBondContact O-CA 3.44Å; E299-S302 WeakPolarHBondContact O-CB 3.43Å; E299-S302 PolarHBondContact O-N 3.46Å; E299-S302 PolarHBondContact O-OG 3.14Å; D300-S302 VanDerWaalsContact C-N 3.32Å; S302-W304 VanDerWaalsContact C-N 3.25Å; S302-W304 VanDerWaalsContact O-CD1 3.25Å; S302-W304 PolarHBondContact O-N 3.36Å
303I53.4Low62Low124 Ų124140.3 Ų140.364%0.63669%0.69SS**SBendtrans-78.485.2167.8-59.6168.3000106.5E299E299-I303 PolarHBondContact O-N 2.82Å
304W51.6Low59.2Low222 Ų222141.5 Ų141.584%0.84171%0.71SS**PPolyproline II helixtrans-50140.6174.6-77.377.6000110.6S302 S306S302-W304 VanDerWaalsContact C-N 3.25Å; S302-W304 VanDerWaalsContact O-CD1 3.25Å; S302-W304 PolarHBondContact O-N 3.36Å; W304-S306 PolarHBondContact O-N 2.8Å
305P49.8Very low56.5Low118 Ų118136.4 Ų136.477%0.76671%0.713SS**PPolyproline II helixtrans-59117.1174.4-15.327.8000108.7M307P305-M307 PolarHBondContact O-N 3.36Å
306S44.4Very low53.8Low97 Ų97136.1 Ų136.168%0.67873%0.725SS**PPolyproline II helixtrans-63116.8167.3-165.60000106.9W304 D308W304-S306 PolarHBondContact O-N 2.8Å; S306-D308 PolarHBondContact O-N 3.16Å
307M42.6Very low51.2Low182 Ų182139.2 Ų139.290%0.89774%0.738SS**  trans-7964.8175.9-169.4170.382.400108.6P305P305-M307 PolarHBondContact O-N 3.36Å
308D43.7Very low48.7Very low129 Ų129137.9 Ų137.969%0.6975%0.746SS**  trans-13579.3169.7-74.4-48.6000105.9S306S306-D308 PolarHBondContact O-N 3.16Å
309D39.8Very low46.2Very low155 Ų155139.9 Ų139.983%0.82975%0.754SS**  trans-171.895156.3-86-29.8000105.3
310D41.6Very low43.5Very low159 Ų159139.5 Ų139.585%0.8576%0.764SS**SBendtrans159.174.8147-78.1-24.6000108.9
311E39.1Very low41.7Very low205 Ų205140.3 Ų140.396%0.95877%0.774SS**  trans-161.347.8148.6-107167.7-145.600109.6
312E37Very low39.4Very low185 Ų185140.1 Ų140.186%0.86478%0.777SS**  trans-77.6123.5155.4-84-166.6164.300109.4
313E31.9Very low38.1Very low182 Ų182142.6 Ų142.685%0.8579%0.792SS**  trans54.4105.1147-63.8-168.2145.700119.2
314S33.7Very low36.8Very low125 Ų125142 Ų14287%0.87480%0.799SS**  -177.8119.6122.3156.60000112
315G32.4Very low35.7Very low71 Ų71139.2 Ų139.273%0.73280%0.8SS**  trans108.287.7133.900000117.1
316A31.5Very low34.7Very low97 Ų97143.1 Ų143.180%0.80281%0.805SS**  trans-50.9135153.600000113
317K32.4Very low34Very low191 Ų191142.8 Ų142.883%0.8381%0.808SS**  trans158.2112.6131.6-89.7173.5178.4177.90110.3
318V31.5Very low33.6Very low118 Ų118139.7 Ų139.772%0.71580%0.801SS**  92.6122.498.8170.80000112.8
319D31.5Very low32.8Very low139 Ų139139.6 Ų139.674%0.74381%0.806SS**  trans66109.5157.9-66.2-30.2000121.7
320S26.4Very low32.7Very low106 Ų106137.7 Ų137.774%0.74180%0.802SS**  19163114-38.80000119.7
321P43.4Very low32.8Very low106 Ų106136.1 Ų136.169%0.68880%0.801SS**  -132.6158.9-52.536.5-20.6000113.1
322L24.9Very low32.5Very low161 Ų161130 Ų13084%0.84379%0.792SS**  trans62.6158.9162.6-68146.7000116.5
323P36.7Very low32.2Very low123 Ų123131.4 Ų131.480%0.79980%0.795SS**  cis-124.7152.16.737.7-20.9000114.6
324S28.1Very low32.1Very low112 Ų112126.6 Ų126.678%0.78380%0.795SS**  trans-95.5109.2170.152.50000110
325D27.8Very low32Very low163 Ų163125.3 Ų125.387%0.87279%0.792SS**  trans-151.7143.2159-135.8-13.8000111.2
326K29.3Very low32Very low200 Ų200126 Ų12687%0.8779%0.791SS**  trans87.5113.2171.5-107.4169.5-179172.40121.5
327A28.5Very low32.2Very low90 Ų90127.5 Ų127.574%0.74479%0.792SS**  trans-55.4167.9159.800000113.6
328P35.2Very low32.3Very low116 Ų116127.3 Ų127.375%0.75379%0.794SS**  -149.7158.559.836.9-14.1000119.1
329T25.7Very low32.4Very low128 Ų128127.3 Ų127.379%0.78580%0.799SS**  trans6.7171.1148.9520000123.2
330P39.4Very low32.8Very low114 Ų114126 Ų12674%0.7480%0.801SS**  cis-134.8-138.7-26.531.6-6.1000111.2
331P43.7Very low33.2Very low127 Ų127128 Ų12883%0.82580%0.803SS**  -114.7166.3-80.935.7-18.5000114.7
332G32.2Very low33.1Very low76 Ų76130.2 Ų130.278%0.78481%0.807SS**  trans-167.2109.3167.100000113.7G334G332-G334 PolarHBondContact O-N 2.89Å
333K30.2Very low33.5Very low214 Ų214128 Ų12893%0.9380%0.801SS**  trans-54.2122.1177.5-78.2169.8169.9175.50111.6A335K333-A335 PolarHBondContact O-N 3.26Å
334G29.4Very low33.4Very low81 Ų81131.8 Ų131.884%0.83581%0.805SS**  trans-66.9110.916600000110.3G332 A336G332-G334 PolarHBondContact O-N 2.89Å; G334-A336 PolarHBondContact O-N 3.33Å
335A31.6Very low33.8Very low99 Ų99135.6 Ų135.682%0.81881%0.81SS**  trans-81.8106.2165.100000107.7K333K333-A335 PolarHBondContact O-N 3.26Å
336A33.8Very low34.3Very low85 Ų85132.2 Ų132.270%0.70281%0.805SS**  trans-65.7136.8164.400000108.8G334 E338G334-A336 PolarHBondContact O-N 3.33Å; A336-E338 PolarHBondContact O-N 3.39Å; A336-E338 VanDerWaalsContact O-N 3.14Å
337P35.8Very low35.1Very low129 Ų129127.1 Ų127.184%0.83880%0.8SS**  trans-74.910618028.4-30.9000109.6S339P337-S339 PolarHBondContact O-N 2.92Å
338E32.7Very low35.6Very low187 Ų187128.3 Ų128.387%0.87480%0.8SS**  trans-68.1123.9165.9-77.8-173154.200109.6A336 S340A336-E338 PolarHBondContact O-N 3.39Å; A336-E338 VanDerWaalsContact O-N 3.14Å; E338-S340 PolarHBondContact O-N 3.08Å
339S35Very low35.9Very low117 Ų117128.8 Ų128.882%0.81880%0.804SS**  trans-56102.516850.40000110.7P337 L341P337-S339 PolarHBondContact O-N 2.92Å; S339-L341 PolarHBondContact O-N 2.65Å; S339-L341 VanDerWaalsContact O-N 3.1Å
340S38.4Very low37.1Very low111 Ų111129.2 Ų129.278%0.77681%0.806SS**  trans-75.3101.3172.256.30000110E338 I342E338-S340 PolarHBondContact O-N 3.08Å; S340-I342 PolarHBondContact O-N 3.21Å
341L35.2Very low37.6Very low150 Ų150135.5 Ų135.579%0.78583%0.832SS**  trans-54.3113.5169-162.2144.9000109.7S339 T343S339-L341 PolarHBondContact O-N 2.65Å; S339-L341 VanDerWaalsContact O-N 3.1Å; L341-T343 PolarHBondContact O-N 2.99Å; L341-T343 VanDerWaalsContact O-N 3.08Å
342I41Very low37.3Very low151 Ų151135.9 Ų135.977%0.77483%0.833SS**  trans-66.6107.7177.3-63.3167.2000107.8S340S340-I342 PolarHBondContact O-N 3.21Å
343T33.5Very low37.6Very low116 Ų116139.1 Ų139.171%0.71284%0.835SS**  trans-79.3130.7173.8-61.10000108.6L341 E345L341-T343 PolarHBondContact O-N 2.99Å; L341-T343 VanDerWaalsContact O-N 3.08Å; T343-E345 PolarHBondContact O-N 2.94Å; T343-E345 VanDerWaalsContact O-N 3.12Å
344F35.2Very low38Very low201 Ų201134.9 Ų134.988%0.88283%0.83SS**  trans-70.1103.9176.9-69.5-89.4000109.9A346F344-A346 PolarHBondContact O-N 3.05Å
345E37.5Very low38.5Very low192 Ų192138.1 Ų138.190%0.89783%0.83SS**PPolyproline II helixtrans-75.3121.8173.3-164.4160.1-179.900109.9T343T343-E345 PolarHBondContact O-N 2.94Å; T343-E345 VanDerWaalsContact O-N 3.12Å
346A37Very low39Very low92 Ų92140.5 Ų140.576%0.7683%0.83SS**PPolyproline II helixtrans-71134.5179.100000110.5F344F344-A346 PolarHBondContact O-N 3.05Å
347A45.9Very low39.3Very low94 Ų94144.2 Ų144.278%0.77784%0.839SS**PPolyproline II helixtrans-61.7141.5179.500000112.1
348P38.7Very low39.6Very low114 Ų114145.3 Ų145.374%0.7484%0.839SS**PPolyproline II helixtrans-71.9152.5-173.927.9-33.7000112.8T350P348-T350 PolarHBondContact O-N 3.19Å
349P42.8Very low40.1Very low127 Ų127142.1 Ų142.183%0.82584%0.836SS**PPolyproline II helixtrans-74.2122.3-178.629.8-32000110.6
350T51.3Low40.5Very low137 Ų137144.2 Ų144.284%0.8484%0.838SS**PPolyproline II helixtrans-75.9120165.649.60000108.8P348P348-T350 PolarHBondContact O-N 3.19Å
351L49.8Very low40.7Very low245 Ų245147.2 Ų147.2100%1.28384%0.843SS**  trans-56.40166.9-76.2166.4000112.2

Retrieved 351 of 351 residues in 159 ms (Link to these results)