A0A060XJS4_ONCMY Loading...

Mitochondria-eating protein

AlphaFold DB , UniProt , Accession A0A060XJS4, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene n/a, Length 488 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
1M63.8Low74Confident111 Ų11190.1 Ų90.155%0.54746%0.464SS..  0-580-180-94.7-81.100111.6D3 S4 L5 E64M1-D3 VanDerWaalsContact C-N 3.25Å; M1-D3 PolarHBondContact O-N 3.34Å; M1-S4 PolarHBondContact O-N 3.05Å; M1-S4 VanDerWaalsContact O-N 3.08Å; M1-L5 PolarHBondContact O-N 2.92Å; M1-E64 WeakPolarHBondContact CB-OE1 3.39Å; M1-E64 VanDerWaalsContact CE-OE2 3.26Å; M1-E64 WeakPolarHBondContact CE-OE2 3.35Å
2A67.4Low74.3Confident59 Ų5988.7 Ų88.749%0.48847%0.468SS..Hα-helixtrans-54.8-35.6175.500000114L5 R6A2-L5 PolarHBondContact O-N 3.09Å; A2-R6 WeakPolarHBondContact O-CB 3.29Å; A2-R6 PolarHBondContact O-N 2.88Å
3D71.8Confident74.7Confident93 Ų9384 Ų8450%0.49745%0.447SS..Hα-helixtrans-73.6-26.2178.5-60.9-48.2000114.4M1 R6 R7M1-D3 VanDerWaalsContact C-N 3.25Å; M1-D3 PolarHBondContact O-N 3.34Å; D3-R6 IonicContact OD1-CZ 2.67Å; D3-R6 IonicContact OD1-NH1 3.48Å; D3-R6 PolarHBondContact OD1-NH1 2.95Å; D3-R7 VanDerWaalsContact O-CB 3.31Å; D3-R7 WeakPolarHBondContact O-CB 3.4Å; D3-R7 WeakPolarHBondContact O-CG 3.24Å; D3-R7 PolarHBondContact O-N 3.16Å; D3-R7 PolarHBondContact O-NE 3.2Å
4S72.7Confident75.1Confident30 Ų3085.3 Ų85.321%0.2145%0.447CS..Hα-helixtrans-76.7-38.4174-63.90000111M1 R7 L8M1-S4 PolarHBondContact O-N 3.05Å; M1-S4 VanDerWaalsContact O-N 3.08Å; S4-R7 PolarHBondContact O-N 3.36Å; S4-R7 PolarHBondContact OG-NH2 3.33Å; S4-R7 VanDerWaalsContact OG-NH2 3.1Å; S4-L8 PolarHBondContact O-N 3.48Å
5L75.3Confident75.7Confident88 Ų8883.1 Ų83.146%0.46144%0.442SS..Hα-helixtrans-68.7-42.3173.8-166.8137.6000111.3M1 A2 R7 L8 V9 I57M1-L5 PolarHBondContact O-N 2.92Å; A2-L5 PolarHBondContact O-N 3.09Å; L5-R7 PolarHBondContact O-N 2.81Å; L5-L8 PolarHBondContact O-N 3.02Å; L5-V9 HydrophobicContact CD2-CG2 4.38Å; L5-V9 WeakPolarHBondContact O-CG2 3.34Å; L5-V9 PolarHBondContact O-N 2.84Å; L5-I57 HydrophobicContact CB-CD1 4.44Å
6R78.3Confident76.4Confident144 Ų14481.4 Ų81.454%0.54344%0.435SS..Hα-helixtrans-60.4-42172.8-175.2-176.2-70.5156.7-11.8112A2 D3 V9 N10A2-R6 WeakPolarHBondContact O-CB 3.29Å; A2-R6 PolarHBondContact O-N 2.88Å; D3-R6 IonicContact OD1-CZ 2.67Å; D3-R6 IonicContact OD1-NH1 3.48Å; D3-R6 PolarHBondContact OD1-NH1 2.95Å; R6-V9 PolarHBondContact O-N 3.35Å; R6-N10 VanDerWaalsContact O-CB 3.3Å; R6-N10 WeakPolarHBondContact O-CB 3.33Å; R6-N10 PolarHBondContact O-N 2.9Å; R6-N10 PolarHBondContact O-ND2 2.65Å
7R77.8Confident77.1Confident162 Ų16278.5 Ų78.561%0.61142%0.419SS*.Hα-helixtrans-62.6-43.6173.6-81.7-177.1-65.6167.10.8112D3 S4 L5 V9 N10 T11D3-R7 VanDerWaalsContact O-CB 3.31Å; D3-R7 WeakPolarHBondContact O-CB 3.4Å; D3-R7 WeakPolarHBondContact O-CG 3.24Å; D3-R7 PolarHBondContact O-N 3.16Å; D3-R7 PolarHBondContact O-NE 3.2Å; S4-R7 PolarHBondContact O-N 3.36Å; S4-R7 PolarHBondContact OG-NH2 3.33Å; S4-R7 VanDerWaalsContact OG-NH2 3.1Å; L5-R7 PolarHBondContact O-N 2.81Å; R7-V9 PolarHBondContact O-N 3.4Å; R7-N10 PolarHBondContact O-N 3.39Å; R7-T11 WeakPolarHBondContact O-CB 3.3Å; R7-T11 PolarHBondContact O-N 2.89Å; R7-T11 PolarHBondContact O-OG1 2.82Å
8L77.8Confident77.6Confident14 Ų1480.6 Ų80.67%0.07343%0.426CS..Hα-helixtrans-63.6-40.4178.4-17662.7000112.2S4 L5 F14 Q53 L54 I57S4-L8 PolarHBondContact O-N 3.48Å; L5-L8 PolarHBondContact O-N 3.02Å; L8-F14 HydrophobicContact CD1-CE2 4.17Å; L8-F14 HydrophobicContact CD2-CE2 4.47Å; L8-F14 HydrophobicContact CG-CE2 4.13Å; L8-Q53 HydrophobicContact CD1-CB 3.96Å; L8-L54 HydrophobicContact CD2-CD2 3.58Å; L8-L54 HydrophobicContact CD2-CG 4.12Å; L8-I57 HydrophobicContact CB-CD1 4.38Å; L8-I57 HydrophobicContact CD2-CD1 3.75Å
9V78Confident78.3Confident105 Ų10581.4 Ų81.464%0.63643%0.431SS*.Hα-helixtrans-68.5-38.7176.9172.70000111.9L5 R6 R7 T11L5-V9 HydrophobicContact CD2-CG2 4.38Å; L5-V9 WeakPolarHBondContact O-CG2 3.34Å; L5-V9 PolarHBondContact O-N 2.84Å; R6-V9 PolarHBondContact O-N 3.35Å; R7-V9 PolarHBondContact O-N 3.4Å; V9-T11 VanDerWaalsContact C-N 3.34Å
10N76.9Confident78.9Confident123 Ų12381.5 Ų81.566%0.65843%0.428SS*.Hα-helixtrans-80-17.8-179.7-68.1-10.2000113.3R6 R7 S12R6-N10 VanDerWaalsContact O-CB 3.3Å; R6-N10 WeakPolarHBondContact O-CB 3.33Å; R6-N10 PolarHBondContact O-N 2.9Å; R6-N10 PolarHBondContact O-ND2 2.65Å; R7-N10 PolarHBondContact O-N 3.39Å; N10-S12 PolarHBondContact O-N 3.34Å
11T74.1Confident79.4Confident62 Ų6282 Ų8238%0.3843%0.43SS..SBendtrans-80.7111.2172.1-48.90000106.3R7 V9 S13R7-T11 WeakPolarHBondContact O-CB 3.3Å; R7-T11 PolarHBondContact O-N 2.89Å; R7-T11 PolarHBondContact O-OG1 2.82Å; V9-T11 VanDerWaalsContact C-N 3.34Å; T11-S13 WeakPolarHBondContact CG2-OG 3.43Å; T11-S13 PolarHBondContact O-N 3.15Å
12S77.2Confident80.7Confident73 Ų7380.6 Ų80.651%0.5142%0.422SS..THydrogen-bonded Turntrans-62.321.7-18049.20000114.7N10 F14 S15 V16N10-S12 PolarHBondContact O-N 3.34Å; S12-F14 VanDerWaalsContact C-N 3.27Å; S12-F14 PolarHBondContact O-N 3.5Å; S12-S15 WeakPolarHBondContact CB-OG 3.48Å; S12-S15 PolarHBondContact O-N 2.82Å; S12-S15 VanDerWaalsContact O-N 3.14Å; S12-S15 PolarHBondContact O-OG 2.85Å; S12-V16 VanDerWaalsContact O-CG2 3.32Å; S12-V16 WeakPolarHBondContact O-CG2 3.22Å; S12-V16 PolarHBondContact O-N 2.93Å
13S79.9Confident81.8Confident28 Ų2880.4 Ų80.420%0.19642%0.417CS..Hα-helixtrans-57.9-35.7-178.2-58.20000113.1T11 L17T11-S13 WeakPolarHBondContact CG2-OG 3.43Å; T11-S13 PolarHBondContact O-N 3.15Å; S13-L17 PolarHBondContact O-N 2.65Å
14F80.8Confident82.8Confident102 Ų10278.5 Ų78.545%0.44740%0.403SS..Hα-helixtrans-71.8-38.9176.4-71.9-79.4000112.7L8 S12 L17 Q18 I50L8-F14 HydrophobicContact CD1-CE2 4.17Å; L8-F14 HydrophobicContact CD2-CE2 4.47Å; L8-F14 HydrophobicContact CG-CE2 4.13Å; S12-F14 VanDerWaalsContact C-N 3.27Å; S12-F14 PolarHBondContact O-N 3.5Å; F14-L17 PolarHBondContact O-N 2.73Å; F14-Q18 PolarHBondContact O-N 3.13Å; F14-I50 HydrophobicContact CD1-CD1 4.29Å; F14-I50 HydrophobicContact CD1-CG2 4.37Å; F14-I50 HydrophobicContact CE1-CD1 4.38Å; F14-I50 HydrophobicContact CE1-CG2 3.46Å; F14-I50 VanDerWaalsContact CE1-CG2 3.46Å; F14-I50 HydrophobicContact CE2-CG2 4.13Å; F14-I50 HydrophobicContact CZ-CG2 3.31Å
15S83.9Confident83.6Confident53 Ų5386.1 Ų86.137%0.37143%0.429SS..Hα-helixtrans-69-39.5175.565.90000110.7S12 L17 Q18 D19S12-S15 WeakPolarHBondContact CB-OG 3.48Å; S12-S15 PolarHBondContact O-N 2.82Å; S12-S15 VanDerWaalsContact O-N 3.14Å; S12-S15 PolarHBondContact O-OG 2.85Å; S15-L17 VanDerWaalsContact C-N 3.34Å; S15-L17 PolarHBondContact O-N 2.69Å; S15-Q18 PolarHBondContact O-N 2.95Å; S15-D19 WeakPolarHBondContact O-CB 3.36Å; S15-D19 PolarHBondContact O-N 3.12Å
16V86.4Confident84.3Confident55 Ų5589.2 Ų89.233%0.33344%0.439SS..Hα-helixtrans-62.8-38.6174.5173.60000112S12 K20 L46S12-V16 VanDerWaalsContact O-CG2 3.32Å; S12-V16 WeakPolarHBondContact O-CG2 3.22Å; S12-V16 PolarHBondContact O-N 2.93Å; V16-K20 WeakPolarHBondContact O-CB 3.23Å; V16-K20 WeakPolarHBondContact O-CG 3.25Å; V16-K20 PolarHBondContact O-N 3.49Å; V16-L46 HydrophobicContact CG1-CD1 4.17Å
17L87.8Confident84.9Confident32 Ų3285 Ų8517%0.16843%0.427CS..Hα-helixtrans-60.9-48.3173.6-175.560.7000110.8S13 F14 S15 K20 L21 L43 L46 I50S13-L17 PolarHBondContact O-N 2.65Å; F14-L17 PolarHBondContact O-N 2.73Å; S15-L17 VanDerWaalsContact C-N 3.34Å; S15-L17 PolarHBondContact O-N 2.69Å; L17-K20 PolarHBondContact O-N 2.9Å; L17-L21 WeakPolarHBondContact O-CB 3.33Å; L17-L21 PolarHBondContact O-N 3.18Å; L17-L43 HydrophobicContact CD1-CD2 3.65Å; L17-L46 HydrophobicContact CB-CD2 3.37Å; L17-L46 HydrophobicContact CD1-CB 4.37Å; L17-L46 HydrophobicContact CD1-CD2 3.53Å; L17-L46 HydrophobicContact CD2-CD2 4.5Å; L17-L46 HydrophobicContact CG-CD2 3.94Å; L17-I50 HydrophobicContact CB-CD1 4.45Å; L17-I50 HydrophobicContact CD2-CD1 4.11Å
18Q87.7Confident85.3Confident117 Ų11782.5 Ų82.555%0.54742%0.418SS..Hα-helixtrans-62.4-48.3179.9-177174.1-8.400111.4F14 S15 K20 L21 E22F14-Q18 PolarHBondContact O-N 3.13Å; S15-Q18 PolarHBondContact O-N 2.95Å; Q18-K20 VanDerWaalsContact C-N 3.32Å; Q18-K20 PolarHBondContact O-N 3.4Å; Q18-L21 PolarHBondContact O-N 2.88Å; Q18-L21 VanDerWaalsContact O-N 3.11Å; Q18-E22 HydrophobicContact CG-CG 4.43Å; Q18-E22 WeakPolarHBondContact CG-OE1 3.48Å; Q18-E22 PolarHBondContact NE2-OE1 2.84Å; Q18-E22 WeakPolarHBondContact O-CG 3.43Å; Q18-E22 PolarHBondContact O-N 3.37Å
19D90.1Very high85.7Confident96 Ų9690.1 Ų90.151%0.51345%0.453SS..Hα-helixtrans-59.4-42.5179.1-67.2-24.7000111.6S15 S23S15-D19 WeakPolarHBondContact O-CB 3.36Å; S15-D19 PolarHBondContact O-N 3.12Å; D19-S23 VanDerWaalsContact O-CB 3.24Å; D19-S23 WeakPolarHBondContact O-CB 3.41Å; D19-S23 PolarHBondContact O-N 3.47Å
20K89.7Confident86.1Confident83 Ų8391 Ų9136%0.36146%0.458SS..Hα-helixtrans-66.9-37.2176-79.6-164.7167-156.90112.4V16 L17 Q18 W24 E42 L43V16-K20 WeakPolarHBondContact O-CB 3.23Å; V16-K20 WeakPolarHBondContact O-CG 3.25Å; V16-K20 PolarHBondContact O-N 3.49Å; L17-K20 PolarHBondContact O-N 2.9Å; Q18-K20 VanDerWaalsContact C-N 3.32Å; Q18-K20 PolarHBondContact O-N 3.4Å; K20-W24 VanDerWaalsContact O-CB 3.31Å; K20-W24 WeakPolarHBondContact O-CB 3.31Å; K20-W24 PolarHBondContact O-N 3.32Å; K20-E42 IonicContact NZ-OE2 2.8Å; K20-E42 PolarHBondContact NZ-OE2 3.38Å; K20-L43 HydrophobicContact CB-CD2 3.77Å
21L89.9Confident86.6Confident91 Ų9186.6 Ų86.648%0.47643%0.434SS..Hα-helixtrans-71.8-39.6179.6-158.8135.8000111.3L17 Q18 W24 Y25 L43L17-L21 WeakPolarHBondContact O-CB 3.33Å; L17-L21 PolarHBondContact O-N 3.18Å; Q18-L21 PolarHBondContact O-N 2.88Å; Q18-L21 VanDerWaalsContact O-N 3.11Å; L21-W24 PolarHBondContact O-N 2.88Å; L21-Y25 WeakPolarHBondContact O-CB 3.23Å; L21-Y25 PolarHBondContact O-N 3.5Å; L21-L43 HydrophobicContact CB-CD2 4.39Å; L21-L43 HydrophobicContact CD1-CD1 4.35Å; L21-L43 HydrophobicContact CG-CD1 4.49Å
22E91.1Very high87.3Confident83 Ų8386.4 Ų86.439%0.38844%0.436SS..Hα-helixtrans-66.2-40.8172.9-73-177.8-163.400112.2Q18 Y25 K26Q18-E22 HydrophobicContact CG-CG 4.43Å; Q18-E22 WeakPolarHBondContact CG-OE1 3.48Å; Q18-E22 PolarHBondContact NE2-OE1 2.84Å; Q18-E22 WeakPolarHBondContact O-CG 3.43Å; Q18-E22 PolarHBondContact O-N 3.37Å; E22-Y25 PolarHBondContact O-N 2.85Å; E22-K26 WeakPolarHBondContact O-CG 3.47Å; E22-K26 PolarHBondContact O-N 3.47Å; E22-K26 VanDerWaalsContact O-N 3.09Å
23S90.3Very high87.8Confident55 Ų5587.6 Ų87.639%0.38544%0.443SS..Hα-helixtrans-62.8-44.1173175.90000111.6D19 K26 D27D19-S23 VanDerWaalsContact O-CB 3.24Å; D19-S23 WeakPolarHBondContact O-CB 3.41Å; D19-S23 PolarHBondContact O-N 3.47Å; S23-K26 PolarHBondContact O-N 3.23Å; S23-D27 PolarHBondContact O-N 3.21Å; S23-D27 VanDerWaalsContact O-N 3.11Å
24W92.3Very high88.2Confident52 Ų5291.2 Ų91.220%0.19746%0.46CS..Hα-helixtrans-63.5-42.6176.2-174.732.5000112.3K20 L21 K26 D27 Y28 N36 R39 C40 L43K20-W24 VanDerWaalsContact O-CB 3.31Å; K20-W24 WeakPolarHBondContact O-CB 3.31Å; K20-W24 PolarHBondContact O-N 3.32Å; L21-W24 PolarHBondContact O-N 2.88Å; W24-K26 PolarHBondContact O-N 3.41Å; W24-D27 PolarHBondContact O-N 2.82Å; W24-Y28 AromaticContact CE2-CD2 3.92Å; W24-Y28 HydrophobicContact CZ2-CD2 4.1Å; W24-Y28 HydrophobicContact CZ2-CE2 4.01Å; W24-Y28 AromaticContact NE1-CD2 3.7Å; W24-Y28 WeakPolarHBondContact O-CA 3.5Å; W24-Y28 VanDerWaalsContact O-CB 3.32Å; W24-Y28 WeakPolarHBondContact O-CB 3.47Å; W24-Y28 PolarHBondContact O-N 2.88Å; W24-N36 WeakPolarHBondContact CZ2-O 3.46Å; W24-N36 PolarHBondContact NE1-OD1 3.34Å; W24-R39 HydrophobicContact CD2-CB 4.43Å; W24-R39 HydrophobicContact CG-CB 4.14Å; W24-C40 HydrophobicContact CH2-CB 3.68Å; W24-C40 HydrophobicContact CZ2-CB 3.92Å; W24-C40 HydrophobicContact CZ3-CB 4.41Å; W24-L43 HydrophobicContact CD2-CD1 4.06Å; W24-L43 HydrophobicContact CE3-CD1 3.27Å; W24-L43 HydrophobicContact CZ3-CD1 3.73Å
25Y90.2Very high88.5Confident190 Ų19091.2 Ų91.275%0.74546%0.461SS*.Hα-helixtrans-60.4-42.9176.4179.7-103.1000112.6L21 E22 D27L21-Y25 WeakPolarHBondContact O-CB 3.23Å; L21-Y25 PolarHBondContact O-N 3.5Å; E22-Y25 PolarHBondContact O-N 2.85Å; Y25-D27 VanDerWaalsContact C-N 3.34Å; Y25-D27 PolarHBondContact O-N 3.33Å
26K91.1Very high88.8Confident154 Ų15489.6 Ų89.667%0.6745%0.448SS*.Hα-helixtrans-63.5-39.4177.5-73.5171.4-176169.30112.5E22 S23 W24E22-K26 WeakPolarHBondContact O-CG 3.47Å; E22-K26 PolarHBondContact O-N 3.47Å; E22-K26 VanDerWaalsContact O-N 3.09Å; S23-K26 PolarHBondContact O-N 3.23Å; W24-K26 PolarHBondContact O-N 3.41Å
27D89.8Confident88.9Confident56 Ų5691.6 Ų91.630%0.29946%0.457SS..Hα-helixtrans-92.7-7-175.7-66.2-13.1000113.8S23 W24 Y25 H29 V30 I31 R39S23-D27 PolarHBondContact O-N 3.21Å; S23-D27 VanDerWaalsContact O-N 3.11Å; W24-D27 PolarHBondContact O-N 2.82Å; Y25-D27 VanDerWaalsContact C-N 3.34Å; Y25-D27 PolarHBondContact O-N 3.33Å; D27-H29 VanDerWaalsContact C-N 3.3Å; D27-H29 PolarHBondContact O-N 3.21Å; D27-H29 VanDerWaalsContact O-N 3.17Å; D27-V30 WeakPolarHBondContact O-CA 3.35Å; D27-V30 WeakPolarHBondContact O-CB 3.46Å; D27-V30 PolarHBondContact O-N 2.88Å; D27-I31 HydrophobicContact CB-CD1 4.49Å; D27-I31 HydrophobicContact CB-CG2 4.16Å; D27-I31 PolarHBondContact O-N 3.41Å; D27-I31 VanDerWaalsContact O-N 3.08Å; D27-R39 VanDerWaalsContact CB-NH1 3.33Å; D27-R39 IonicContact OD2-CZ 2.52Å; D27-R39 IonicContact OD2-NH1 2.84Å; D27-R39 PolarHBondContact OD2-NH1 3.14Å; D27-R39 IonicContact OD2-NH2 3.69Å; D27-R39 PolarHBondContact OD2-NH2 2.97Å
28Y87.3Confident88.9Confident109 Ų10994 Ų9443%0.42747%0.47SS..THydrogen-bonded Turntrans-53.9-44.2-165.7-179.1-97.8000113.3W24 V30 N36W24-Y28 AromaticContact CE2-CD2 3.92Å; W24-Y28 HydrophobicContact CZ2-CD2 4.1Å; W24-Y28 HydrophobicContact CZ2-CE2 4.01Å; W24-Y28 AromaticContact NE1-CD2 3.7Å; W24-Y28 WeakPolarHBondContact O-CA 3.5Å; W24-Y28 VanDerWaalsContact O-CB 3.32Å; W24-Y28 WeakPolarHBondContact O-CB 3.47Å; W24-Y28 PolarHBondContact O-N 2.88Å; Y28-V30 VanDerWaalsContact C-N 3.32Å; Y28-N36 WeakPolarHBondContact CD2-OD1 3.33Å; Y28-N36 HydrophobicContact CE2-CB 4.48Å; Y28-N36 PolarHBondContact O-ND2 3.4Å
29H84.3Confident89Confident174 Ų17491.9 Ų91.981%0.80646%0.457SS*.THydrogen-bonded Turntrans-82.3-8.8-179.7-65.5-62.4000113.7D27D27-H29 VanDerWaalsContact C-N 3.3Å; D27-H29 PolarHBondContact O-N 3.21Å; D27-H29 VanDerWaalsContact O-N 3.17Å
30V87.4Confident88.9Confident123 Ų12389.5 Ų89.575%0.74545%0.447SS*.THydrogen-bonded Turntrans-96.8-29.5-177.5-175.50000111.4D27 Y28D27-V30 WeakPolarHBondContact O-CA 3.35Å; D27-V30 WeakPolarHBondContact O-CB 3.46Å; D27-V30 PolarHBondContact O-N 2.88Å; Y28-V30 VanDerWaalsContact C-N 3.32Å
31I87.8Confident88.8Confident31 Ų3188.9 Ų88.916%0.15945%0.452CS..SBendtrans-97.5159.8-175.768.8-177.2000113.2D27 Q35 N36D27-I31 HydrophobicContact CB-CD1 4.49Å; D27-I31 HydrophobicContact CB-CG2 4.16Å; D27-I31 PolarHBondContact O-N 3.41Å; D27-I31 VanDerWaalsContact O-N 3.08Å; I31-Q35 HydrophobicContact CB-CB 4.08Å; I31-Q35 HydrophobicContact CD1-CB 4.23Å; I31-Q35 HydrophobicContact CG1-CB 4.29Å; I31-N36 VanDerWaalsContact CD1-OD1 3.23Å; I31-N36 WeakPolarHBondContact CD1-OD1 3.41Å; I31-N36 WeakPolarHBondContact CG1-OD1 3.48Å; I31-N36 PolarHBondContact O-ND2 3.49Å
32S88.5Confident88.8Confident58 Ų5888.8 Ų88.841%0.40645%0.45SS..  trans-69.4161.4-177.378.40000112.7D34 Q35 N36S32-D34 VanDerWaalsContact C-N 3.26Å; S32-D34 PolarHBondContact O-N 2.97Å; S32-Q35 VanDerWaalsContact N-OE1 3.11Å; S32-Q35 PolarHBondContact O-N 3.48Å; S32-Q35 VanDerWaalsContact O-N 3.17Å; S32-Q35 WeakPolarHBondContact OG-CG 3.48Å; S32-Q35 PolarHBondContact OG-N 3.23Å; S32-N36 WeakPolarHBondContact O-CB 3.44Å; S32-N36 PolarHBondContact O-N 3.27Å; S32-N36 PolarHBondContact O-ND2 2.93Å
33C87.7Confident88.7Confident98 Ų9885.5 Ų85.566%0.66244%0.435SS*.Hα-helixtrans-56.7-40.7176-176.90000112.2N36 L37C33-N36 WeakPolarHBondContact O-CB 3.43Å; C33-N36 PolarHBondContact O-N 3.48Å; C33-L37 WeakPolarHBondContact O-CB 3.42Å; C33-L37 WeakPolarHBondContact O-CG 3.46Å; C33-L37 PolarHBondContact O-N 2.99Å
34D87.4Confident88.6Confident104 Ų10487.3 Ų87.356%0.55644%0.443SS*.Hα-helixtrans-66.5-39.9177.3-171.864.3000112.2S32 L37 N38S32-D34 VanDerWaalsContact C-N 3.26Å; S32-D34 PolarHBondContact O-N 2.97Å; D34-L37 PolarHBondContact O-N 2.92Å; D34-N38 WeakPolarHBondContact O-CB 3.48Å; D34-N38 PolarHBondContact O-N 2.65Å; D34-N38 PolarHBondContact O-ND2 3.29Å; D34-N38 PolarHBondContact OD2-ND2 2.99Å
35Q87.9Confident88.4Confident101 Ų10190.2 Ų90.247%0.47246%0.459SS..Hα-helixtrans-67.2-38.3174.2-71.8172.1-2600112.1I31 S32 N38 R39I31-Q35 HydrophobicContact CB-CB 4.08Å; I31-Q35 HydrophobicContact CD1-CB 4.23Å; I31-Q35 HydrophobicContact CG1-CB 4.29Å; S32-Q35 VanDerWaalsContact N-OE1 3.11Å; S32-Q35 PolarHBondContact O-N 3.48Å; S32-Q35 VanDerWaalsContact O-N 3.17Å; S32-Q35 WeakPolarHBondContact OG-CG 3.48Å; S32-Q35 PolarHBondContact OG-N 3.23Å; Q35-N38 PolarHBondContact O-N 2.91Å; Q35-R39 WeakPolarHBondContact O-CG 3.47Å; Q35-R39 PolarHBondContact O-N 3.1Å
36N89.5Confident88.2Confident19 Ų1982.9 Ų82.910%0.10243%0.433CS..Hα-helixtrans-62.9-42.5172.7-84.5-43.3000111.6W24 Y28 I31 S32 C33 R39 C40W24-N36 WeakPolarHBondContact CZ2-O 3.46Å; W24-N36 PolarHBondContact NE1-OD1 3.34Å; Y28-N36 WeakPolarHBondContact CD2-OD1 3.33Å; Y28-N36 HydrophobicContact CE2-CB 4.48Å; Y28-N36 PolarHBondContact O-ND2 3.4Å; I31-N36 VanDerWaalsContact CD1-OD1 3.23Å; I31-N36 WeakPolarHBondContact CD1-OD1 3.41Å; I31-N36 WeakPolarHBondContact CG1-OD1 3.48Å; I31-N36 PolarHBondContact O-ND2 3.49Å; S32-N36 WeakPolarHBondContact O-CB 3.44Å; S32-N36 PolarHBondContact O-N 3.27Å; S32-N36 PolarHBondContact O-ND2 2.93Å; C33-N36 WeakPolarHBondContact O-CB 3.43Å; C33-N36 PolarHBondContact O-N 3.48Å; N36-R39 PolarHBondContact O-N 3.47Å; N36-C40 WeakPolarHBondContact O-CB 3.12Å; N36-C40 PolarHBondContact O-N 2.74Å
37L88.2Confident88Confident97 Ų9777.8 Ų77.851%0.50842%0.415SS..Hα-helixtrans-63.6-45.4175.6-78.9167.1000111.5C33 D34 R39 C40 C41C33-L37 WeakPolarHBondContact O-CB 3.42Å; C33-L37 WeakPolarHBondContact O-CG 3.46Å; C33-L37 PolarHBondContact O-N 2.99Å; D34-L37 PolarHBondContact O-N 2.92Å; L37-R39 PolarHBondContact O-N 3.37Å; L37-C40 WeakPolarHBondContact O-CB 3.45Å; L37-C40 PolarHBondContact O-N 3.32Å; L37-C41 PolarHBondContact O-N 3.34Å; L37-C41 PolarHBondContact O-SG 2.88Å; L37-C41 VanDerWaalsContact O-SG 3.34Å
38N89.4Confident87.8Confident83 Ų8378 Ų7844%0.44442%0.42SS..Hα-helixtrans-61.9-44.5177-77.2-37.5000112.1D34 Q35 C40 C41 E42D34-N38 WeakPolarHBondContact O-CB 3.48Å; D34-N38 PolarHBondContact O-N 2.65Å; D34-N38 PolarHBondContact O-ND2 3.29Å; D34-N38 PolarHBondContact OD2-ND2 2.99Å; Q35-N38 PolarHBondContact O-N 2.91Å; N38-C40 VanDerWaalsContact C-N 3.31Å; N38-C40 PolarHBondContact O-N 2.94Å; N38-C41 PolarHBondContact O-N 3.2Å; N38-E42 WeakPolarHBondContact O-CG 3.19Å; N38-E42 PolarHBondContact O-N 2.8Å
39R89.6Confident87.7Confident72 Ų7279.5 Ų79.527%0.27243%0.429SS..Hα-helixtrans-61.9-38.8174.2-72.6-172.2-174.4-165.37.5112W24 D27 Q35 N36 L37 E42 L43W24-R39 HydrophobicContact CD2-CB 4.43Å; W24-R39 HydrophobicContact CG-CB 4.14Å; D27-R39 VanDerWaalsContact CB-NH1 3.33Å; D27-R39 IonicContact OD2-CZ 2.52Å; D27-R39 IonicContact OD2-NH1 2.84Å; D27-R39 PolarHBondContact OD2-NH1 3.14Å; D27-R39 IonicContact OD2-NH2 3.69Å; D27-R39 PolarHBondContact OD2-NH2 2.97Å; Q35-R39 WeakPolarHBondContact O-CG 3.47Å; Q35-R39 PolarHBondContact O-N 3.1Å; N36-R39 PolarHBondContact O-N 3.47Å; L37-R39 PolarHBondContact O-N 3.37Å; R39-E42 PolarHBondContact O-N 3.22Å; R39-L43 WeakPolarHBondContact O-CG 3.37Å; R39-L43 PolarHBondContact O-N 3.11Å; R39-L43 VanDerWaalsContact O-N 3.07Å
40C87.6Confident87.7Confident47 Ų4771.6 Ų71.632%0.31839%0.393SS..Hα-helixtrans-62.4-46.5174.3-171.40000111.6W24 N36 L37 N38 E42 L43 V44W24-C40 HydrophobicContact CH2-CB 3.68Å; W24-C40 HydrophobicContact CZ2-CB 3.92Å; W24-C40 HydrophobicContact CZ3-CB 4.41Å; N36-C40 WeakPolarHBondContact O-CB 3.12Å; N36-C40 PolarHBondContact O-N 2.74Å; L37-C40 WeakPolarHBondContact O-CB 3.45Å; L37-C40 PolarHBondContact O-N 3.32Å; N38-C40 VanDerWaalsContact C-N 3.31Å; N38-C40 PolarHBondContact O-N 2.94Å; C40-E42 PolarHBondContact O-N 3.48Å; C40-L43 WeakPolarHBondContact O-CB 3.4Å; C40-L43 PolarHBondContact O-N 3.02Å; C40-L43 VanDerWaalsContact O-N 3.14Å; C40-V44 WeakPolarHBondContact O-CG2 3.5Å; C40-V44 PolarHBondContact O-N 3.28Å
41C86.6Confident87.6Confident69 Ų6970.3 Ų70.347%0.46638%0.378SS..Hα-helixtrans-59.3-44.2175.9-70.80000111.8L37 N38 L43 V44 E45L37-C41 PolarHBondContact O-N 3.34Å; L37-C41 PolarHBondContact O-SG 2.88Å; L37-C41 VanDerWaalsContact O-SG 3.34Å; N38-C41 PolarHBondContact O-N 3.2Å; C41-L43 VanDerWaalsContact C-N 3.3Å; C41-L43 PolarHBondContact O-N 3.05Å; C41-V44 PolarHBondContact O-N 3.07Å; C41-E45 WeakPolarHBondContact O-CG 3.46Å; C41-E45 PolarHBondContact O-N 3.21Å
42E89.8Confident87.4Confident90 Ų9070.4 Ų70.442%0.42139%0.387SS..Hα-helixtrans-59.3-39.5174.8-74.1-175.7-156.400112.6K20 N38 R39 C40 E45 L46K20-E42 IonicContact NZ-OE2 2.8Å; K20-E42 PolarHBondContact NZ-OE2 3.38Å; N38-E42 WeakPolarHBondContact O-CG 3.19Å; N38-E42 PolarHBondContact O-N 2.8Å; R39-E42 PolarHBondContact O-N 3.22Å; C40-E42 PolarHBondContact O-N 3.48Å; E42-E45 PolarHBondContact O-N 3.5Å; E42-L46 WeakPolarHBondContact O-CB 3.44Å; E42-L46 PolarHBondContact O-N 3.46Å
43L89.6Confident87.2Confident13 Ų1371.6 Ų71.67%0.06839%0.386CS..Hα-helixtrans-67.7-39.3176.4-71169.8000111.5L17 K20 L21 W24 R39 C40 C41 L46 T47L17-L43 HydrophobicContact CD1-CD2 3.65Å; K20-L43 HydrophobicContact CB-CD2 3.77Å; L21-L43 HydrophobicContact CB-CD2 4.39Å; L21-L43 HydrophobicContact CD1-CD1 4.35Å; L21-L43 HydrophobicContact CG-CD1 4.49Å; W24-L43 HydrophobicContact CD2-CD1 4.06Å; W24-L43 HydrophobicContact CE3-CD1 3.27Å; W24-L43 HydrophobicContact CZ3-CD1 3.73Å; R39-L43 WeakPolarHBondContact O-CG 3.37Å; R39-L43 PolarHBondContact O-N 3.11Å; R39-L43 VanDerWaalsContact O-N 3.07Å; C40-L43 WeakPolarHBondContact O-CB 3.4Å; C40-L43 PolarHBondContact O-N 3.02Å; C40-L43 VanDerWaalsContact O-N 3.14Å; C41-L43 VanDerWaalsContact C-N 3.3Å; C41-L43 PolarHBondContact O-N 3.05Å; L43-L46 PolarHBondContact O-N 2.94Å; L43-T47 WeakPolarHBondContact O-CB 3.39Å; L43-T47 PolarHBondContact O-N 2.95Å; L43-T47 PolarHBondContact O-OG1 3.14Å
44V87.8Confident87Confident94 Ų9470.9 Ų70.957%0.5738%0.375SS*.Hα-helixtrans-64.2-42.6174.6172.20000110.8C40 C41 L46 T47 S48C40-V44 WeakPolarHBondContact O-CG2 3.5Å; C40-V44 PolarHBondContact O-N 3.28Å; C41-V44 PolarHBondContact O-N 3.07Å; V44-L46 PolarHBondContact O-N 3.1Å; V44-T47 PolarHBondContact O-N 3.25Å; V44-S48 WeakPolarHBondContact O-CB 3.5Å; V44-S48 PolarHBondContact O-N 3.38Å
45E88.1Confident86.9Confident113 Ų11370.4 Ų70.453%0.52837%0.369SS..Hα-helixtrans-62.4-41.7174.7-75.1-175.7-170.900112.6C41 E42 T47 S48 K49C41-E45 WeakPolarHBondContact O-CG 3.46Å; C41-E45 PolarHBondContact O-N 3.21Å; E42-E45 PolarHBondContact O-N 3.5Å; E45-T47 VanDerWaalsContact C-N 3.34Å; E45-S48 PolarHBondContact O-N 2.89Å; E45-S48 PolarHBondContact O-OG 2.67Å; E45-K49 WeakPolarHBondContact O-CG 3.5Å; E45-K49 PolarHBondContact O-N 3.05Å
46L87.1Confident86.6Confident36 Ų3669.2 Ų69.219%0.18837%0.368CS..Hα-helixtrans-68.6-38.5178.1-161.7121.6000111.1V16 L17 E42 L43 V44 K49 I50V16-L46 HydrophobicContact CG1-CD1 4.17Å; L17-L46 HydrophobicContact CB-CD2 3.37Å; L17-L46 HydrophobicContact CD1-CB 4.37Å; L17-L46 HydrophobicContact CD1-CD2 3.53Å; L17-L46 HydrophobicContact CD2-CD2 4.5Å; L17-L46 HydrophobicContact CG-CD2 3.94Å; E42-L46 WeakPolarHBondContact O-CB 3.44Å; E42-L46 PolarHBondContact O-N 3.46Å; L43-L46 PolarHBondContact O-N 2.94Å; V44-L46 PolarHBondContact O-N 3.1Å; L46-K49 PolarHBondContact O-N 3.22Å; L46-I50 HydrophobicContact CD2-CD1 3.94Å; L46-I50 WeakPolarHBondContact O-CG1 3.49Å; L46-I50 PolarHBondContact O-N 3.01Å
47T87.2Confident86.3Confident47 Ų4769.4 Ų69.429%0.28837%0.369SS..Hα-helixtrans-65.5-39.6175.9-55.60000111.6L43 V44 E45 K49 I50 Q51L43-T47 WeakPolarHBondContact O-CB 3.39Å; L43-T47 PolarHBondContact O-N 2.95Å; L43-T47 PolarHBondContact O-OG1 3.14Å; V44-T47 PolarHBondContact O-N 3.25Å; E45-T47 VanDerWaalsContact C-N 3.34Å; T47-K49 PolarHBondContact O-N 3.46Å; T47-I50 PolarHBondContact O-N 3.43Å; T47-Q51 HydrophobicContact CG2-CG 4.33Å; T47-Q51 WeakPolarHBondContact O-CB 3.28Å; T47-Q51 VanDerWaalsContact O-CG 3.26Å; T47-Q51 WeakPolarHBondContact O-CG 3.44Å; T47-Q51 PolarHBondContact O-N 2.86Å
48S85.1Confident86.1Confident59 Ų5967.9 Ų67.941%0.41336%0.361SS..Hα-helixtrans-66.9-36.2178.5720000112.5V44 E45 Q51 G52V44-S48 WeakPolarHBondContact O-CB 3.5Å; V44-S48 PolarHBondContact O-N 3.38Å; E45-S48 PolarHBondContact O-N 2.89Å; E45-S48 PolarHBondContact O-OG 2.67Å; S48-Q51 PolarHBondContact O-N 3.04Å; S48-G52 PolarHBondContact O-N 3.23Å
49K84.4Confident85.6Confident141 Ų14168.1 Ų68.161%0.61336%0.363SS*.Hα-helixtrans-62.1-46172.5-72.1172.3-176168.40111.7E45 L46 T47 G52 Q53E45-K49 WeakPolarHBondContact O-CG 3.5Å; E45-K49 PolarHBondContact O-N 3.05Å; L46-K49 PolarHBondContact O-N 3.22Å; T47-K49 PolarHBondContact O-N 3.46Å; K49-G52 PolarHBondContact O-N 3.14Å; K49-Q53 WeakPolarHBondContact O-CG 3.36Å; K49-Q53 PolarHBondContact O-N 3.42Å; K49-Q53 VanDerWaalsContact O-N 3.14Å
50I85.8Confident85.1Confident9 Ų969.4 Ų69.45%0.04637%0.37CS..Hα-helixtrans-63.2-46176.6-68.4168.5000110.6F14 L17 L46 T47 G52 Q53 L54F14-I50 HydrophobicContact CD1-CD1 4.29Å; F14-I50 HydrophobicContact CD1-CG2 4.37Å; F14-I50 HydrophobicContact CE1-CD1 4.38Å; F14-I50 HydrophobicContact CE1-CG2 3.46Å; F14-I50 VanDerWaalsContact CE1-CG2 3.46Å; F14-I50 HydrophobicContact CE2-CG2 4.13Å; F14-I50 HydrophobicContact CZ-CG2 3.31Å; L17-I50 HydrophobicContact CB-CD1 4.45Å; L17-I50 HydrophobicContact CD2-CD1 4.11Å; L46-I50 HydrophobicContact CD2-CD1 3.94Å; L46-I50 WeakPolarHBondContact O-CG1 3.49Å; L46-I50 PolarHBondContact O-N 3.01Å; T47-I50 PolarHBondContact O-N 3.43Å; I50-G52 VanDerWaalsContact C-N 3.35Å; I50-G52 PolarHBondContact O-N 3Å; I50-Q53 PolarHBondContact O-N 3.36Å; I50-L54 HydrophobicContact CG2-CD1 4.15Å; I50-L54 WeakPolarHBondContact O-CG 3.47Å; I50-L54 PolarHBondContact O-N 3.19Å
51Q84.8Confident84.6Confident95 Ų9570.6 Ų70.644%0.44438%0.376SS..Hα-helixtrans-58.1-45.1176-75.8173.7-15.500111.5T47 S48 Q53 L54 F55T47-Q51 HydrophobicContact CG2-CG 4.33Å; T47-Q51 WeakPolarHBondContact O-CB 3.28Å; T47-Q51 VanDerWaalsContact O-CG 3.26Å; T47-Q51 WeakPolarHBondContact O-CG 3.44Å; T47-Q51 PolarHBondContact O-N 2.86Å; S48-Q51 PolarHBondContact O-N 3.04Å; Q51-Q53 VanDerWaalsContact C-N 3.33Å; Q51-Q53 PolarHBondContact O-N 3.34Å; Q51-L54 PolarHBondContact O-N 2.99Å; Q51-F55 HydrophobicContact CB-CD2 4.46Å; Q51-F55 HydrophobicContact CB-CE2 4.45Å; Q51-F55 WeakPolarHBondContact O-CD2 3.49Å; Q51-F55 PolarHBondContact O-N 2.96Å
52G82.6Confident84Confident34 Ų3468.5 Ų68.535%0.35136%0.364SS..Hα-helixtrans-60.7-39.1177.600000113.4S48 K49 I50 F55 T56S48-G52 PolarHBondContact O-N 3.23Å; K49-G52 PolarHBondContact O-N 3.14Å; I50-G52 VanDerWaalsContact C-N 3.35Å; I50-G52 PolarHBondContact O-N 3Å; G52-F55 PolarHBondContact O-N 3.4Å; G52-T56 PolarHBondContact O-N 3.46Å; G52-T56 PolarHBondContact O-OG1 3.26Å
53Q83.9Confident83.2Confident82 Ų8272.8 Ų72.838%0.38338%0.376SS..Hα-helixtrans-66.3-41.4174.5-69.8176.8-36.500111.8L8 K49 I50 Q51 T56 I57L8-Q53 HydrophobicContact CD1-CB 3.96Å; K49-Q53 WeakPolarHBondContact O-CG 3.36Å; K49-Q53 PolarHBondContact O-N 3.42Å; K49-Q53 VanDerWaalsContact O-N 3.14Å; I50-Q53 PolarHBondContact O-N 3.36Å; Q51-Q53 VanDerWaalsContact C-N 3.33Å; Q51-Q53 PolarHBondContact O-N 3.34Å; Q53-T56 WeakPolarHBondContact O-CB 3.39Å; Q53-T56 PolarHBondContact O-N 2.85Å; Q53-I57 WeakPolarHBondContact O-CG1 3.4Å; Q53-I57 PolarHBondContact O-N 2.94Å; Q53-I57 VanDerWaalsContact O-N 3.12Å
54L85.1Confident82.3Confident83 Ų8378 Ų7844%0.43540%0.4SS..Hα-helixtrans-65.1-41.4175.2-72.2171.5000112.5L8 I50 Q51 T56 I57 L58L8-L54 HydrophobicContact CD2-CD2 3.58Å; L8-L54 HydrophobicContact CD2-CG 4.12Å; I50-L54 HydrophobicContact CG2-CD1 4.15Å; I50-L54 WeakPolarHBondContact O-CG 3.47Å; I50-L54 PolarHBondContact O-N 3.19Å; Q51-L54 PolarHBondContact O-N 2.99Å; L54-T56 VanDerWaalsContact C-N 3.3Å; L54-T56 PolarHBondContact O-N 3.43Å; L54-I57 PolarHBondContact O-N 3.31Å; L54-L58 WeakPolarHBondContact O-CB 3.42Å; L54-L58 PolarHBondContact O-N 3.5Å
55F84.1Confident81.1Confident95 Ų9575.2 Ų75.242%0.41739%0.391SS..Hα-helixtrans-63.3-36.7174.8-83.6-64.4000112.4Q51 G52 I57 L58 N59 L78Q51-F55 HydrophobicContact CB-CD2 4.46Å; Q51-F55 HydrophobicContact CB-CE2 4.45Å; Q51-F55 WeakPolarHBondContact O-CD2 3.49Å; Q51-F55 PolarHBondContact O-N 2.96Å; G52-F55 PolarHBondContact O-N 3.4Å; F55-I57 VanDerWaalsContact C-N 3.34Å; F55-L58 HydrophobicContact CD1-CD2 4.1Å; F55-L58 HydrophobicContact CE1-CD2 4.38Å; F55-L58 PolarHBondContact O-N 2.88Å; F55-N59 WeakPolarHBondContact O-CB 3.38Å; F55-N59 PolarHBondContact O-N 3.03Å; F55-L78 HydrophobicContact CE1-CD1 4.46Å; F55-L78 HydrophobicContact CE1-CD2 4.38Å
56T82.8Confident79.8Confident75 Ų7572.1 Ų72.146%0.4639%0.389SS..Hα-helixtrans-62.6-44174.8-58.80000110.8G52 Q53 L54 N59 F60G52-T56 PolarHBondContact O-N 3.46Å; G52-T56 PolarHBondContact O-OG1 3.26Å; Q53-T56 WeakPolarHBondContact O-CB 3.39Å; Q53-T56 PolarHBondContact O-N 2.85Å; L54-T56 VanDerWaalsContact C-N 3.3Å; L54-T56 PolarHBondContact O-N 3.43Å; T56-N59 PolarHBondContact O-N 3.41Å; T56-F60 HydrophobicContact CG2-CD2 4.02Å; T56-F60 HydrophobicContact CG2-CE2 3.62Å; T56-F60 WeakPolarHBondContact O-CD2 3.47Å; T56-F60 PolarHBondContact O-N 2.94Å
57I83.3Confident78.3Confident23 Ų2379.1 Ų79.112%0.11842%0.42CS..Hα-helixtrans-63-46.9175.1-66.2170.4000110.5L5 L8 Q53 L54 F55 N59 F60 T61L5-I57 HydrophobicContact CB-CD1 4.44Å; L8-I57 HydrophobicContact CB-CD1 4.38Å; L8-I57 HydrophobicContact CD2-CD1 3.75Å; Q53-I57 WeakPolarHBondContact O-CG1 3.4Å; Q53-I57 PolarHBondContact O-N 2.94Å; Q53-I57 VanDerWaalsContact O-N 3.12Å; L54-I57 PolarHBondContact O-N 3.31Å; F55-I57 VanDerWaalsContact C-N 3.34Å; I57-N59 VanDerWaalsContact C-N 3.31Å; I57-N59 PolarHBondContact O-N 3.47Å; I57-F60 PolarHBondContact O-N 3.5Å; I57-F60 VanDerWaalsContact O-N 3.14Å; I57-T61 PolarHBondContact O-N 2.98Å; I57-T61 PolarHBondContact O-OG1 3.4Å; I57-T61 VanDerWaalsContact O-OG1 3.08Å
58L82.8Confident76.9Confident66 Ų6686.2 Ų86.235%0.34644%0.443SS..Hα-helixtrans-55.4-43.8177.6178.666.4000112.4L54 F55 T61 A62 L74 L78L54-L58 WeakPolarHBondContact O-CB 3.42Å; L54-L58 PolarHBondContact O-N 3.5Å; F55-L58 HydrophobicContact CD1-CD2 4.1Å; F55-L58 HydrophobicContact CE1-CD2 4.38Å; F55-L58 PolarHBondContact O-N 2.88Å; L58-T61 PolarHBondContact O-N 3.26Å; L58-A62 WeakPolarHBondContact O-CB 3.48Å; L58-A62 PolarHBondContact O-N 3.23Å; L58-L74 HydrophobicContact CD1-CD2 4.23Å; L58-L74 HydrophobicContact CD2-CD2 3.95Å; L58-L74 HydrophobicContact CG-CD2 4.23Å; L58-L78 HydrophobicContact CD2-CD2 3.99Å
59N79.4Confident75.7Confident88 Ų8886 Ų8647%0.47145%0.445SS..Hα-helixtrans-66-38.4179.1-168.924.2000112.2F55 T56 I57 R63F55-N59 WeakPolarHBondContact O-CB 3.38Å; F55-N59 PolarHBondContact O-N 3.03Å; T56-N59 PolarHBondContact O-N 3.41Å; I57-N59 VanDerWaalsContact C-N 3.31Å; I57-N59 PolarHBondContact O-N 3.47Å; N59-R63 WeakPolarHBondContact O-CG 3.21Å; N59-R63 PolarHBondContact O-N 2.93Å
60F78.9Confident74.7Confident98 Ų9880.6 Ų80.643%0.4343%0.429SS..Hα-helixtrans-65.2-44.2172.5-75.3-57.6000111.7T56 I57 A62 R63 E64T56-F60 HydrophobicContact CG2-CD2 4.02Å; T56-F60 HydrophobicContact CG2-CE2 3.62Å; T56-F60 WeakPolarHBondContact O-CD2 3.47Å; T56-F60 PolarHBondContact O-N 2.94Å; I57-F60 PolarHBondContact O-N 3.5Å; I57-F60 VanDerWaalsContact O-N 3.14Å; F60-A62 PolarHBondContact O-N 3.29Å; F60-R63 PolarHBondContact O-N 2.9Å; F60-E64 PolarHBondContact O-N 3.18Å
61T78.3Confident73.9Confident73 Ų7382.7 Ų82.745%0.44844%0.442SS..Hα-helixtrans-63.9-38.8178.5-54.80000112.4I57 L58 R63 E64I57-T61 PolarHBondContact O-N 2.98Å; I57-T61 PolarHBondContact O-OG1 3.4Å; I57-T61 VanDerWaalsContact O-OG1 3.08Å; L58-T61 PolarHBondContact O-N 3.26Å; T61-R63 VanDerWaalsContact C-N 3.27Å; T61-R63 PolarHBondContact O-N 3.02Å; T61-E64 PolarHBondContact O-N 3.01Å
62A73.8Confident73.2Confident25 Ų2583.8 Ų83.821%0.20745%0.451CS..Hα-helixtrans-67-27.5176.400000113L58 F60 L74L58-A62 WeakPolarHBondContact O-CB 3.48Å; L58-A62 PolarHBondContact O-N 3.23Å; F60-A62 PolarHBondContact O-N 3.29Å; A62-L74 HydrophobicContact CB-CD1 4.23Å
63R71.4Confident72.7Confident180 Ų18086.2 Ų86.268%0.67946%0.459SS*.Hα-helixtrans-80.4-24.1179.5-78.5174.8157.4-170.7-6.3114.1N59 F60 T61 G65N59-R63 WeakPolarHBondContact O-CG 3.21Å; N59-R63 PolarHBondContact O-N 2.93Å; F60-R63 PolarHBondContact O-N 2.9Å; T61-R63 VanDerWaalsContact C-N 3.27Å; T61-R63 PolarHBondContact O-N 3.02Å; R63-G65 PolarHBondContact O-N 3.44Å
64E70.7Confident72.3Confident121 Ų12184.9 Ų84.957%0.56545%0.454SS*.THydrogen-bonded Turntrans-68.6-12.8179.2-74.3177.2177.500113M1 F60 T61M1-E64 WeakPolarHBondContact CB-OE1 3.39Å; M1-E64 VanDerWaalsContact CE-OE2 3.26Å; M1-E64 WeakPolarHBondContact CE-OE2 3.35Å; F60-E64 PolarHBondContact O-N 3.18Å; T61-E64 PolarHBondContact O-N 3.01Å
65G62.5Low71.8Confident37 Ų3787 Ų8738%0.38146%0.46SS..THydrogen-bonded Turntrans-864.8-17900000117.2R63 A69R63-G65 PolarHBondContact O-N 3.44Å; G65-A69 WeakPolarHBondContact O-CB 3.49Å; G65-A69 PolarHBondContact O-N 3.11Å
66G61.8Low71.3Confident47 Ų4786.3 Ų86.349%0.48547%0.467SS..THydrogen-bonded Turntrans76.5-171.8-171.400000112.9Y68G66-Y68 PolarHBondContact O-N 3.14Å
67H56Low71Confident183 Ų18391.7 Ų91.785%0.84748%0.479SS*.THydrogen-bonded Turntrans-61.8-15.5-169.5-88.823.8000115.7
68Y56.7Low70.8Confident196 Ų19692.9 Ų92.977%0.76949%0.485SS*.THydrogen-bonded Turntrans-135.4-12.5-175.2-68.6-80.9000116.1G66G66-Y68 PolarHBondContact O-N 3.14Å
69A60.3Low70.4Confident54 Ų5494.8 Ų94.845%0.44650%0.495SS..THydrogen-bonded Turntrans-83137.2-178.400000111.6G65G65-A69 WeakPolarHBondContact O-CB 3.49Å; G65-A69 PolarHBondContact O-N 3.11Å
70G64.1Low70.3Confident28 Ų2893.8 Ų93.829%0.28949%0.494SS..THydrogen-bonded Turntrans97.9-18.6-174.200000114.5D72 V73 L74G70-D72 VanDerWaalsContact C-N 3.33Å; G70-D72 PolarHBondContact O-N 2.98Å; G70-V73 PolarHBondContact O-N 3.46Å; G70-L74 WeakPolarHBondContact O-CG 3.36Å; G70-L74 PolarHBondContact O-N 3.23Å
71V68.4Low70.1Confident53 Ų5396 Ų9632%0.32150%0.499SS..Hα-helixtrans-63.1-38.8176.71770000111.5V73 L74 K75V71-V73 PolarHBondContact O-N 3.48Å; V71-L74 PolarHBondContact O-N 2.85Å; V71-K75 HydrophobicContact CG1-CD 3.93Å; V71-K75 HydrophobicContact CG1-CG 4.29Å; V71-K75 WeakPolarHBondContact O-CB 3.49Å; V71-K75 WeakPolarHBondContact O-CG 3.24Å; V71-K75 PolarHBondContact O-N 3.4Å
72D69.4Low69.7Low118 Ų11895 Ų9563%0.63149%0.491SS*.Hα-helixtrans-68.3-34.8-179.9-64.5-31.9000112.5G70 K75 S76G70-D72 VanDerWaalsContact C-N 3.33Å; G70-D72 PolarHBondContact O-N 2.98Å; D72-K75 PolarHBondContact O-N 3.22Å; D72-S76 VanDerWaalsContact O-CB 3.22Å; D72-S76 WeakPolarHBondContact O-CB 3.27Å; D72-S76 PolarHBondContact O-N 3Å; D72-S76 PolarHBondContact O-OG 3.42Å
73V73.1Confident69.2Low86 Ų8695.9 Ų95.952%0.52150%0.502SS..Hα-helixtrans-69.8-39.5176.1-179.20000110.7G70 V71 R77G70-V73 PolarHBondContact O-N 3.46Å; V71-V73 PolarHBondContact O-N 3.48Å; V73-R77 WeakPolarHBondContact O-CB 3.44Å; V73-R77 PolarHBondContact O-N 2.93Å
74L76.2Confident68.8Low53 Ų5391.6 Ų91.628%0.27750%0.496SS..Iπ-helixtrans-64.7-44.8174.6-68.3171.9000111.6L58 A62 G70 V71 L78 L79L58-L74 HydrophobicContact CD1-CD2 4.23Å; L58-L74 HydrophobicContact CD2-CD2 3.95Å; L58-L74 HydrophobicContact CG-CD2 4.23Å; A62-L74 HydrophobicContact CB-CD1 4.23Å; G70-L74 WeakPolarHBondContact O-CG 3.36Å; G70-L74 PolarHBondContact O-N 3.23Å; V71-L74 PolarHBondContact O-N 2.85Å; L74-L78 HydrophobicContact CD2-CB 4.4Å; L74-L78 HydrophobicContact CD2-CD2 3.74Å; L74-L78 WeakPolarHBondContact O-CB 3.37Å; L74-L78 PolarHBondContact O-N 3.23Å; L74-L78 VanDerWaalsContact O-N 3.15Å; L74-L79 PolarHBondContact O-N 3.29Å; L74-L79 VanDerWaalsContact O-N 3.1Å
75K73.4Confident68.1Low129 Ų12989 Ų8956%0.56149%0.49SS*.Iπ-helixtrans-68.7-40179.7-74.9-179.6179.4176.40113.3V71 D72 L79 P80V71-K75 HydrophobicContact CG1-CD 3.93Å; V71-K75 HydrophobicContact CG1-CG 4.29Å; V71-K75 WeakPolarHBondContact O-CB 3.49Å; V71-K75 WeakPolarHBondContact O-CG 3.24Å; V71-K75 PolarHBondContact O-N 3.4Å; D72-K75 PolarHBondContact O-N 3.22Å; K75-L79 HydrophobicContact CG-CD1 4.23Å; K75-P80 VanDerWaalsContact O-CD 3.31Å; K75-P80 WeakPolarHBondContact O-CD 3.47Å
76S74.9Confident67.6Low79 Ų7995.4 Ų95.455%0.55251%0.508SS*.Iπ-helixtrans-84.9-27-175.259.90000114.2D72D72-S76 VanDerWaalsContact O-CB 3.22Å; D72-S76 WeakPolarHBondContact O-CB 3.27Å; D72-S76 PolarHBondContact O-N 3Å; D72-S76 PolarHBondContact O-OG 3.42Å
77R76.1Confident67.1Low189 Ų18997.7 Ų97.771%0.71352%0.516SS*.Iπ-helixtrans-115.7-46-174.7-61-175.366.4-163.5-0.9114.2V73 W81V73-R77 WeakPolarHBondContact O-CB 3.44Å; V73-R77 PolarHBondContact O-N 2.93Å; R77-W81 WeakPolarHBondContact O-CB 3.35Å
78L77.8Confident66.8Low47 Ų4796.8 Ų96.825%0.24652%0.515CS..Iπ-helixtrans-79.5-46.6-173.3-173.570.6000112.1F55 L58 L74 W81 L82F55-L78 HydrophobicContact CE1-CD1 4.46Å; F55-L78 HydrophobicContact CE1-CD2 4.38Å; L58-L78 HydrophobicContact CD2-CD2 3.99Å; L74-L78 HydrophobicContact CD2-CB 4.4Å; L74-L78 HydrophobicContact CD2-CD2 3.74Å; L74-L78 WeakPolarHBondContact O-CB 3.37Å; L74-L78 PolarHBondContact O-N 3.23Å; L74-L78 VanDerWaalsContact O-N 3.15Å; L78-W81 HydrophobicContact CD1-CE3 4.46Å; L78-W81 PolarHBondContact O-N 3.31Å; L78-L82 HydrophobicContact CG-CD1 4.11Å; L78-L82 WeakPolarHBondContact O-CG 3.41Å; L78-L82 PolarHBondContact O-N 3.35Å
79L74.6Confident66.2Low106 Ų10691.3 Ų91.356%0.55551%0.51SS*.Hα-helixtrans-64.5-44.6-177.6-67.8177.7000113.6L74 K75 W81 L82 G83L74-L79 PolarHBondContact O-N 3.29Å; L74-L79 VanDerWaalsContact O-N 3.1Å; K75-L79 HydrophobicContact CG-CD1 4.23Å; L79-W81 VanDerWaalsContact C-N 3.31Å; L79-W81 PolarHBondContact O-N 2.89Å; L79-L82 PolarHBondContact O-N 3.29Å; L79-G83 PolarHBondContact O-N 3.34Å
80P76.9Confident65.4Low68 Ų6895.5 Ų95.544%0.44253%0.53SS..Hα-helixtrans-64.8-36.3176.6-23.836.7000112.4K75 G83 T84K75-P80 VanDerWaalsContact O-CD 3.31Å; K75-P80 WeakPolarHBondContact O-CD 3.47Å; P80-G83 PolarHBondContact O-N 2.73Å; P80-T84 PolarHBondContact O-N 3.03Å; P80-T84 VanDerWaalsContact O-N 3.08Å; P80-T84 PolarHBondContact O-OG1 3.37Å
81W74.9Confident64.3Low144 Ų144100.2 Ų100.255%0.54556%0.558SS.*Hα-helixtrans-63.3-47.9175.5179.781.2000111.5R77 L78 L79 G83 T84 C85R77-W81 WeakPolarHBondContact O-CB 3.35Å; L78-W81 HydrophobicContact CD1-CE3 4.46Å; L78-W81 PolarHBondContact O-N 3.31Å; L79-W81 VanDerWaalsContact C-N 3.31Å; L79-W81 PolarHBondContact O-N 2.89Å; W81-G83 PolarHBondContact O-N 3.49Å; W81-T84 PolarHBondContact O-N 2.99Å; W81-C85 VanDerWaalsContact CE2-SG 3.59Å; W81-C85 PolarHBondContact O-N 2.89Å; W81-C85 VanDerWaalsContact O-N 3.07Å; W81-C85 PolarHBondContact O-SG 3.08Å; W81-C85 VanDerWaalsContact O-SG 3.35Å
82L70.8Confident63.3Low53 Ų53102.7 Ų102.728%0.27758%0.578SS.*Hα-helixtrans-59.4-45.7175.3-71.6171.7000111.6L78 L79 T84 C85 F86L78-L82 HydrophobicContact CG-CD1 4.11Å; L78-L82 WeakPolarHBondContact O-CG 3.41Å; L78-L82 PolarHBondContact O-N 3.35Å; L79-L82 PolarHBondContact O-N 3.29Å; L82-T84 PolarHBondContact O-N 3.34Å; L82-C85 PolarHBondContact O-N 2.75Å; L82-F86 HydrophobicContact CD2-CE2 4.2Å; L82-F86 WeakPolarHBondContact O-CD2 3.42Å; L82-F86 PolarHBondContact O-N 3.09Å
83G62.3Low62.2Low42 Ų42102.7 Ų102.743%0.43358%0.582SS.*Hα-helixtrans-60.3-32.8178.600000113.7L79 P80 W81 S87L79-G83 PolarHBondContact O-N 3.34Å; P80-G83 PolarHBondContact O-N 2.73Å; W81-G83 PolarHBondContact O-N 3.49Å; G83-S87 PolarHBondContact O-OG 3.03Å
84T64.6Low61.1Low91 Ų91102.7 Ų102.756%0.55858%0.582SS**Hα-helixtrans-78.3-39.3179.9-48.60000111.9P80 W81 L82 F86 S87P80-T84 PolarHBondContact O-N 3.03Å; P80-T84 VanDerWaalsContact O-N 3.08Å; P80-T84 PolarHBondContact O-OG1 3.37Å; W81-T84 PolarHBondContact O-N 2.99Å; L82-T84 PolarHBondContact O-N 3.34Å; T84-F86 VanDerWaalsContact C-N 3.32Å; T84-F86 PolarHBondContact O-N 3.36Å; T84-S87 PolarHBondContact O-N 3.08Å
85C55.3Low60Low66 Ų66106.7 Ų106.745%0.44660%0.604SS.*Hα-helixtrans-66.4-28.8-177.9-70.80000114.1W81 L82W81-C85 VanDerWaalsContact CE2-SG 3.59Å; W81-C85 PolarHBondContact O-N 2.89Å; W81-C85 VanDerWaalsContact O-N 3.07Å; W81-C85 PolarHBondContact O-SG 3.08Å; W81-C85 VanDerWaalsContact O-SG 3.35Å; L82-C85 PolarHBondContact O-N 2.75Å
86F52.7Low59Low171 Ų171106.6 Ų106.675%0.7561%0.61SS**THydrogen-bonded Turntrans-91-8.7177.7-65.3-69.3000114L82 T84L82-F86 HydrophobicContact CD2-CE2 4.2Å; L82-F86 WeakPolarHBondContact O-CD2 3.42Å; L82-F86 PolarHBondContact O-N 3.09Å; T84-F86 VanDerWaalsContact C-N 3.32Å; T84-F86 PolarHBondContact O-N 3.36Å
87S51.5Low58Low95 Ų95106.1 Ų106.166%0.66460%0.604SS**SBendtrans-94.1-3.2-178.3-60.20000113.9G83 T84 A89G83-S87 PolarHBondContact O-OG 3.03Å; T84-S87 PolarHBondContact O-N 3.08Å; S87-A89 VanDerWaalsContact C-N 3.31Å; S87-A89 PolarHBondContact O-N 3.05Å
88M47.9Very low57.1Low165 Ų16599.2 Ų99.281%0.81359%0.585SS**  trans-84.17.2-174.2-72.5-135.969.800115.4
89A46Very low56.3Low80 Ų80102.4 Ų102.466%0.66160%0.601SS**  trans-120.593.3175.500000110.4S87S87-A89 VanDerWaalsContact C-N 3.31Å; S87-A89 PolarHBondContact O-N 3.05Å
90T42Very low56.1Low142 Ų142102.6 Ų102.687%0.87160%0.603SS**  trans168.485.3141.539.10000110.4
91S41.6Very low55.9Low127 Ų127104.1 Ų104.189%0.88861%0.607SS**  trans-87.399.1162.155.20000109.4
92S46.7Very low56Low106 Ų106101.7 Ų101.774%0.74160%0.603SS**  trans176.589.7156.7164.90000109.6
93V46.4Very low56.4Low118 Ų118104.4 Ų104.472%0.71562%0.615SS**  trans-93.2116.7173.2-179.60000108.9
94T50.8Low57.3Low85 Ų85106.5 Ų106.552%0.52161%0.613SS.*  trans-89.3142.5163.249.50000109.7D96 T97T94-D96 PolarHBondContact O-N 2.8Å; T94-D96 VanDerWaalsContact O-N 3.08Å; T94-T97 PolarHBondContact O-N 3.12Å; T94-T97 VanDerWaalsContact O-N 3.07Å; T94-T97 PolarHBondContact O-OG1 3.22Å; T94-T97 PolarHBondContact OG1-OG1 3.25Å
95N53.3Low58Low137 Ų137104.9 Ų104.973%0.73361%0.606SS**Hα-helixtrans-56.9-27-169.3-71.5-20.6000114.9S98N95-S98 PolarHBondContact O-N 3.43Å; N95-S98 PolarHBondContact O-OG 3.22Å
96D51.6Low59.5Low128 Ų128104.9 Ų104.968%0.68460%0.603SS**Hα-helixtrans-77-22.9-179.5-61-28.9000113.5T94 S98T94-D96 PolarHBondContact O-N 2.8Å; T94-D96 VanDerWaalsContact O-N 3.08Å; D96-S98 VanDerWaalsContact C-N 3.3Å
97T54.6Low61Low69 Ų69101.6 Ų101.642%0.42359%0.591SS.*Hα-helixtrans-71.6-30.7174.2-44.20000110.9T94 L101T94-T97 PolarHBondContact O-N 3.12Å; T94-T97 VanDerWaalsContact O-N 3.07Å; T94-T97 PolarHBondContact O-OG1 3.22Å; T94-T97 PolarHBondContact OG1-OG1 3.25Å; T97-L101 HydrophobicContact CG2-CD1 4.03Å; T97-L101 HydrophobicContact CG2-CG 4.43Å; T97-L101 WeakPolarHBondContact O-CB 3.32Å; T97-L101 VanDerWaalsContact O-CG 3.25Å; T97-L101 WeakPolarHBondContact O-CG 3.47Å; T97-L101 PolarHBondContact O-N 3.15Å; T97-L101 VanDerWaalsContact O-N 3.09Å
98S57.1Low62.7Low44 Ų44102.6 Ų102.631%0.30858%0.583SS.*Hα-helixtrans-67-39.8-179.176.40000112.6N95 D96 L101 I102N95-S98 PolarHBondContact O-N 3.43Å; N95-S98 PolarHBondContact O-OG 3.22Å; D96-S98 VanDerWaalsContact C-N 3.3Å; S98-L101 PolarHBondContact O-N 3.06Å; S98-I102 WeakPolarHBondContact O-CB 3.37Å; S98-I102 WeakPolarHBondContact O-CD1 3.34Å; S98-I102 WeakPolarHBondContact O-CG1 3.42Å; S98-I102 PolarHBondContact O-N 3.18Å
99L61Low64.5Low114 Ų114100.1 Ų100.160%0.59757%0.569SS**Hα-helixtrans-69.8-40.1178.9-86.5171.8000112.7I102 Q103L99-I102 PolarHBondContact O-N 3.36Å; L99-Q103 WeakPolarHBondContact O-CB 3.36Å; L99-Q103 PolarHBondContact O-N 3.28Å
100N70.7Confident66.7Low109 Ų109103.2 Ų103.258%0.58356%0.564SS**Hα-helixtrans-64.9-40.7175.1-78.1-32.4000111.9Q103 E104N100-Q103 PolarHBondContact O-N 3.16Å; N100-E104 WeakPolarHBondContact O-CB 3.44Å; N100-E104 PolarHBondContact O-N 3.24Å
101L72.5Confident69.1Low101 Ų101102.9 Ų102.953%0.52955%0.55SS.*Hα-helixtrans-67.1-36.7175.1-71171.2000112.1T97 S98 S105T97-L101 HydrophobicContact CG2-CD1 4.03Å; T97-L101 HydrophobicContact CG2-CG 4.43Å; T97-L101 WeakPolarHBondContact O-CB 3.32Å; T97-L101 VanDerWaalsContact O-CG 3.25Å; T97-L101 WeakPolarHBondContact O-CG 3.47Å; T97-L101 PolarHBondContact O-N 3.15Å; T97-L101 VanDerWaalsContact O-N 3.09Å; S98-L101 PolarHBondContact O-N 3.06Å; L101-S105 VanDerWaalsContact O-CB 3.25Å; L101-S105 WeakPolarHBondContact O-CB 3.36Å; L101-S105 PolarHBondContact O-N 2.83Å; L101-S105 PolarHBondContact O-OG 2.9Å
102I76.4Confident71.4Confident92 Ų92102.2 Ų102.247%0.47254%0.535SS..Hα-helixtrans-64.6-47.1173.6-70.7161.9000110S98 L99 E104 S105 V106S98-I102 WeakPolarHBondContact O-CB 3.37Å; S98-I102 WeakPolarHBondContact O-CD1 3.34Å; S98-I102 WeakPolarHBondContact O-CG1 3.42Å; S98-I102 PolarHBondContact O-N 3.18Å; L99-I102 PolarHBondContact O-N 3.36Å; I102-E104 PolarHBondContact O-N 3.34Å; I102-S105 WeakPolarHBondContact CA-OG 3.1Å; I102-S105 PolarHBondContact O-N 3.08Å; I102-S105 PolarHBondContact O-OG 3.36Å; I102-V106 WeakPolarHBondContact O-CG2 3.26Å; I102-V106 PolarHBondContact O-N 3.36Å
103Q80Confident73.6Confident111 Ų111104.2 Ų104.252%0.51953%0.527SS..Hα-helixtrans-60.8-47.2176.9-177176.6-18.400111.7L99 N100 S105 V106 E107L99-Q103 WeakPolarHBondContact O-CB 3.36Å; L99-Q103 PolarHBondContact O-N 3.28Å; N100-Q103 PolarHBondContact O-N 3.16Å; Q103-S105 VanDerWaalsContact C-N 3.28Å; Q103-S105 PolarHBondContact O-N 3.44Å; Q103-V106 PolarHBondContact O-N 3.26Å; Q103-E107 PolarHBondContact NE2-OE1 2.93Å; Q103-E107 WeakPolarHBondContact O-CG 3.38Å; Q103-E107 PolarHBondContact O-N 2.97Å
104E79.9Confident75.9Confident85 Ų85104.2 Ų104.240%0.39752%0.519SS..Hα-helixtrans-62.6-35.6177.2-168.1-174.3171.300111.5N100 I102 K108N100-E104 WeakPolarHBondContact O-CB 3.44Å; N100-E104 PolarHBondContact O-N 3.24Å; I102-E104 PolarHBondContact O-N 3.34Å; E104-K108 HydrophobicContact CG-CD 4.3Å; E104-K108 WeakPolarHBondContact O-CB 3.47Å; E104-K108 VanDerWaalsContact O-CG 3.28Å; E104-K108 WeakPolarHBondContact O-CG 3.42Å; E104-K108 PolarHBondContact O-N 2.9Å; E104-K108 WeakPolarHBondContact OE1-CE 3.37Å; E104-K108 IonicContact OE1-NZ 2.97Å; E104-K108 PolarHBondContact OE1-NZ 3.01Å
105S79.9Confident77.9Confident58 Ų58105.1 Ų105.141%0.40652%0.52SS..Hα-helixtrans-65.7-42.5175.176.40000112.2L101 I102 Q103 K108 E109L101-S105 VanDerWaalsContact O-CB 3.25Å; L101-S105 WeakPolarHBondContact O-CB 3.36Å; L101-S105 PolarHBondContact O-N 2.83Å; L101-S105 PolarHBondContact O-OG 2.9Å; I102-S105 WeakPolarHBondContact CA-OG 3.1Å; I102-S105 PolarHBondContact O-N 3.08Å; I102-S105 PolarHBondContact O-OG 3.36Å; Q103-S105 VanDerWaalsContact C-N 3.28Å; Q103-S105 PolarHBondContact O-N 3.44Å; S105-K108 PolarHBondContact O-N 3.49Å; S105-E109 VanDerWaalsContact O-CB 3.26Å; S105-E109 WeakPolarHBondContact O-CB 3.3Å; S105-E109 PolarHBondContact O-N 2.82Å
106V86.8Confident79.7Confident65 Ų65101.7 Ų101.739%0.39451%0.507SS..Hα-helixtrans-67.6-38.1178.3171.60000111.1I102 Q103 E109 R110I102-V106 WeakPolarHBondContact O-CG2 3.26Å; I102-V106 PolarHBondContact O-N 3.36Å; Q103-V106 PolarHBondContact O-N 3.26Å; V106-E109 PolarHBondContact O-N 3.46Å; V106-R110 WeakPolarHBondContact O-CB 3.41Å; V106-R110 PolarHBondContact O-N 3.36Å
107E85Confident81.8Confident103 Ų10398.2 Ų98.248%0.48150%0.496SS..Hα-helixtrans-67.6-43.2174.7-73.8175.3-166.100112Q103 E109 R110 K111Q103-E107 PolarHBondContact NE2-OE1 2.93Å; Q103-E107 WeakPolarHBondContact O-CG 3.38Å; Q103-E107 PolarHBondContact O-N 2.97Å; E107-E109 VanDerWaalsContact C-N 3.35Å; E107-R110 WeakPolarHBondContact O-CB 3.47Å; E107-R110 PolarHBondContact O-N 2.94Å; E107-K111 WeakPolarHBondContact O-CB 3.48Å; E107-K111 PolarHBondContact O-N 3.46Å
108K87.1Confident83.7Confident116 Ų11697.5 Ų97.550%0.50449%0.494SS..Hα-helixtrans-62.8-41.6173.3-76.4174.8-177.1167.20111.5E104 S105 R110 K111 I112E104-K108 HydrophobicContact CG-CD 4.3Å; E104-K108 WeakPolarHBondContact O-CB 3.47Å; E104-K108 VanDerWaalsContact O-CG 3.28Å; E104-K108 WeakPolarHBondContact O-CG 3.42Å; E104-K108 PolarHBondContact O-N 2.9Å; E104-K108 WeakPolarHBondContact OE1-CE 3.37Å; E104-K108 IonicContact OE1-NZ 2.97Å; E104-K108 PolarHBondContact OE1-NZ 3.01Å; S105-K108 PolarHBondContact O-N 3.49Å; K108-R110 VanDerWaalsContact C-N 3.34Å; K108-R110 PolarHBondContact O-N 3.4Å; K108-K111 PolarHBondContact O-N 2.97Å; K108-I112 WeakPolarHBondContact O-CB 3.42Å; K108-I112 VanDerWaalsContact O-CG1 3.23Å; K108-I112 WeakPolarHBondContact O-CG1 3.19Å; K108-I112 PolarHBondContact O-N 3.47Å
109E85.2Confident85.5Confident113 Ų113101.5 Ų101.553%0.52851%0.507SS..Hα-helixtrans-68.3-33.3177.9-171.9164.1-153.400112.4S105 V106 E107 R113S105-E109 VanDerWaalsContact O-CB 3.26Å; S105-E109 WeakPolarHBondContact O-CB 3.3Å; S105-E109 PolarHBondContact O-N 2.82Å; V106-E109 PolarHBondContact O-N 3.46Å; E107-E109 VanDerWaalsContact C-N 3.35Å; E109-R113 WeakPolarHBondContact O-CG 3.21Å; E109-R113 PolarHBondContact O-N 2.97Å; E109-R113 VanDerWaalsContact O-N 3.09Å; E109-R113 PolarHBondContact O-NE 3.5Å
110R91.7Very high87.1Confident144 Ų144101 Ų10154%0.54350%0.502SS..Hα-helixtrans-62.6-48.8168.3-175.3-172.9-60.1-1711.6110.9V106 E107 K108 I112 R113 E114V106-R110 WeakPolarHBondContact O-CB 3.41Å; V106-R110 PolarHBondContact O-N 3.36Å; E107-R110 WeakPolarHBondContact O-CB 3.47Å; E107-R110 PolarHBondContact O-N 2.94Å; K108-R110 VanDerWaalsContact C-N 3.34Å; K108-R110 PolarHBondContact O-N 3.4Å; R110-I112 VanDerWaalsContact C-N 3.33Å; R110-I112 PolarHBondContact O-N 2.88Å; R110-R113 WeakPolarHBondContact O-CB 3.5Å; R110-R113 PolarHBondContact O-N 3.04Å; R110-R113 VanDerWaalsContact O-N 3.15Å; R110-E114 WeakPolarHBondContact CG-OE1 3.4Å; R110-E114 PolarHBondContact O-N 3.34Å
111K92.6Very high88.4Confident136 Ų136100.5 Ų100.559%0.59150%0.499SS*.Hα-helixtrans-64.3-37.1-179.4-165.8169.8-172.9173.70112.4E107 K108 E114 L115E107-K111 WeakPolarHBondContact O-CB 3.48Å; E107-K111 PolarHBondContact O-N 3.46Å; K108-K111 PolarHBondContact O-N 2.97Å; K111-E114 PolarHBondContact O-N 2.96Å; K111-L115 HydrophobicContact CG-CD1 4.23Å; K111-L115 WeakPolarHBondContact O-CB 3.36Å; K111-L115 VanDerWaalsContact O-CG 3.29Å; K111-L115 WeakPolarHBondContact O-CG 3.3Å; K111-L115 PolarHBondContact O-N 2.87Å
112I90.9Very high89.4Confident112 Ų112100.2 Ų100.257%0.57450%0.498SS*.Hα-helixtrans-61.9-45.3173.3-71.8164.4000110.1K108 R110 L115 S116K108-I112 WeakPolarHBondContact O-CB 3.42Å; K108-I112 VanDerWaalsContact O-CG1 3.23Å; K108-I112 WeakPolarHBondContact O-CG1 3.19Å; K108-I112 PolarHBondContact O-N 3.47Å; R110-I112 VanDerWaalsContact C-N 3.33Å; R110-I112 PolarHBondContact O-N 2.88Å; I112-L115 PolarHBondContact O-N 3.33Å; I112-S116 WeakPolarHBondContact O-CB 3.31Å; I112-S116 PolarHBondContact O-N 2.85Å; I112-S116 PolarHBondContact O-OG 3.18Å
113R92.6Very high90.3Very high148 Ų148100.4 Ų100.456%0.55850%0.499SS*.Hα-helixtrans-63.8-39.9177.2-78.4-176.4-74.2169.5-8.2113.2E109 R110 S116 A117E109-R113 WeakPolarHBondContact O-CG 3.21Å; E109-R113 PolarHBondContact O-N 2.97Å; E109-R113 VanDerWaalsContact O-N 3.09Å; E109-R113 PolarHBondContact O-NE 3.5Å; R110-R113 WeakPolarHBondContact O-CB 3.5Å; R110-R113 PolarHBondContact O-N 3.04Å; R110-R113 VanDerWaalsContact O-N 3.15Å; R113-S116 WeakPolarHBondContact CA-OG 3.47Å; R113-S116 PolarHBondContact O-OG 2.85Å; R113-A117 WeakPolarHBondContact O-CB 3.28Å; R113-A117 PolarHBondContact O-N 3.35Å
114E93.6Very high91.1Very high118 Ų118100 Ų10055%0.55150%0.497SS*.Hα-helixtrans-65.6-46.2175.9-73.7171.3-168.900111.5R110 K111 S116 A117 S118R110-E114 WeakPolarHBondContact CG-OE1 3.4Å; R110-E114 PolarHBondContact O-N 3.34Å; K111-E114 PolarHBondContact O-N 2.96Å; E114-S116 VanDerWaalsContact C-N 3.35Å; E114-S116 PolarHBondContact O-N 3.31Å; E114-A117 PolarHBondContact O-N 3.26Å; E114-S118 PolarHBondContact O-N 2.96Å; E114-S118 PolarHBondContact O-OG 2.8Å
115L92.8Very high91.9Very high105 Ų105101.6 Ų101.655%0.5550%0.502SS..Hα-helixtrans-65.7-36.4177-72.8172.6000112.4K111 I112 S118 H119K111-L115 HydrophobicContact CG-CD1 4.23Å; K111-L115 WeakPolarHBondContact O-CB 3.36Å; K111-L115 VanDerWaalsContact O-CG 3.29Å; K111-L115 WeakPolarHBondContact O-CG 3.3Å; K111-L115 PolarHBondContact O-N 2.87Å; I112-L115 PolarHBondContact O-N 3.33Å; L115-S118 WeakPolarHBondContact CA-OG 3.48Å; L115-S118 PolarHBondContact O-OG 2.73Å; L115-H119 VanDerWaalsContact O-CB 3.28Å; L115-H119 WeakPolarHBondContact O-CB 3.49Å; L115-H119 PolarHBondContact O-N 3.29Å
116S92.6Very high92.6Very high64 Ų64104.7 Ų104.745%0.44851%0.512SS..Hα-helixtrans-66.7-42.5175.364.70000111I112 R113 E114 H119 E120I112-S116 WeakPolarHBondContact O-CB 3.31Å; I112-S116 PolarHBondContact O-N 2.85Å; I112-S116 PolarHBondContact O-OG 3.18Å; R113-S116 WeakPolarHBondContact CA-OG 3.47Å; R113-S116 PolarHBondContact O-OG 2.85Å; E114-S116 VanDerWaalsContact C-N 3.35Å; E114-S116 PolarHBondContact O-N 3.31Å; S116-H119 PolarHBondContact O-N 3.07Å; S116-E120 WeakPolarHBondContact O-CB 3.45Å; S116-E120 PolarHBondContact O-N 2.65Å
117A94.4Very high93Very high55 Ų55107.2 Ų107.246%0.45552%0.519SS..Hα-helixtrans-66.3-39.1177.200000112.3R113 E114 E120 N121R113-A117 WeakPolarHBondContact O-CB 3.28Å; R113-A117 PolarHBondContact O-N 3.35Å; E114-A117 PolarHBondContact O-N 3.26Å; A117-E120 PolarHBondContact O-N 3.39Å; A117-N121 WeakPolarHBondContact O-CB 3.49Å; A117-N121 PolarHBondContact O-N 3.05Å
118S95Very high93.6Very high55 Ų55106.7 Ų106.739%0.38552%0.523SS..Hα-helixtrans-66-43.117565.90000111.8E114 L115 E120 N121 D122E114-S118 PolarHBondContact O-N 2.96Å; E114-S118 PolarHBondContact O-OG 2.8Å; L115-S118 WeakPolarHBondContact CA-OG 3.48Å; L115-S118 PolarHBondContact O-OG 2.73Å; S118-E120 VanDerWaalsContact C-N 3.35Å; S118-E120 PolarHBondContact O-N 2.62Å; S118-N121 PolarHBondContact O-N 3.41Å; S118-D122 PolarHBondContact O-N 2.91Å
119H94.9Very high94.1Very high127 Ų127106.2 Ų106.259%0.58852%0.523SS*.Hα-helixtrans-63.8-39.7177.2179.8-89.4000112L115 S116 D122 M123L115-H119 VanDerWaalsContact O-CB 3.28Å; L115-H119 WeakPolarHBondContact O-CB 3.49Å; L115-H119 PolarHBondContact O-N 3.29Å; S116-H119 PolarHBondContact O-N 3.07Å; H119-D122 PolarHBondContact O-N 3.24Å; H119-M123 WeakPolarHBondContact O-CB 3.26Å; H119-M123 PolarHBondContact O-N 3.47Å
120E95.6Very high94.6Very high103 Ų103105.6 Ų105.648%0.48152%0.522SS..Hα-helixtrans-63.4-41.7175.4-172.3173.1-170.500111.9S116 A117 S118 M123 Q124S116-E120 WeakPolarHBondContact O-CB 3.45Å; S116-E120 PolarHBondContact O-N 2.65Å; A117-E120 PolarHBondContact O-N 3.39Å; S118-E120 VanDerWaalsContact C-N 3.35Å; S118-E120 PolarHBondContact O-N 2.62Å; E120-M123 PolarHBondContact O-N 3.31Å; E120-Q124 WeakPolarHBondContact O-CG 3.49Å; E120-Q124 PolarHBondContact O-N 3.33Å
121N96.2Very high94.9Very high99 Ų99102 Ų10253%0.52952%0.519SS..Hα-helixtrans-63.5-46.5174.7-171.3-18.1000111.9A117 S118 M123 Q124 K125A117-N121 WeakPolarHBondContact O-CB 3.49Å; A117-N121 PolarHBondContact O-N 3.05Å; S118-N121 PolarHBondContact O-N 3.41Å; N121-M123 VanDerWaalsContact C-N 3.29Å; N121-M123 PolarHBondContact O-N 3.16Å; N121-Q124 PolarHBondContact O-N 3.44Å; N121-K125 WeakPolarHBondContact O-CB 3.48Å; N121-K125 PolarHBondContact O-N 3.01Å
122D95.4Very high95.1Very high96 Ų9698.1 Ų98.151%0.51351%0.509SS..Hα-helixtrans-61.4-38.9177.3-75.5-21.7000111.8S118 H119 K125 M126S118-D122 PolarHBondContact O-N 2.91Å; H119-D122 PolarHBondContact O-N 3.24Å; D122-K125 PolarHBondContact O-N 2.84Å; D122-M126 WeakPolarHBondContact O-CG 3.36Å; D122-M126 PolarHBondContact O-N 3.12Å
123M95.3Very high95.3Very high96 Ų9696 Ų9647%0.47350%0.501SS..Hα-helixtrans-63.5-46.9175.3-173.9177.863.800111.7H119 E120 N121 K125 M126 E127H119-M123 WeakPolarHBondContact O-CB 3.26Å; H119-M123 PolarHBondContact O-N 3.47Å; E120-M123 PolarHBondContact O-N 3.31Å; N121-M123 VanDerWaalsContact C-N 3.29Å; N121-M123 PolarHBondContact O-N 3.16Å; M123-K125 VanDerWaalsContact C-N 3.29Å; M123-K125 PolarHBondContact O-N 3.02Å; M123-M126 PolarHBondContact O-N 3.4Å; M123-E127 WeakPolarHBondContact O-CB 3.33Å; M123-E127 PolarHBondContact O-N 3.01Å
124Q95.9Very high95.5Very high103 Ų10394.2 Ų94.248%0.48150%0.499SS..Hα-helixtrans-61.2-38.9175-72.7175.5500111.8E120 N121 E127 T128E120-Q124 WeakPolarHBondContact O-CG 3.49Å; E120-Q124 PolarHBondContact O-N 3.33Å; N121-Q124 PolarHBondContact O-N 3.44Å; Q124-E127 PolarHBondContact O-N 3.24Å; Q124-T128 WeakPolarHBondContact O-CG2 3.46Å; Q124-T128 PolarHBondContact O-N 3.28Å; Q124-T128 PolarHBondContact O-OG1 3.46Å; Q124-T128 VanDerWaalsContact O-OG1 3.09Å
125K96.9Very high95.7Very high117 Ų11794.6 Ų94.651%0.50950%0.504SS..Hα-helixtrans-64.9-42.6175.8-172.8179.3178-176.50111.9N121 D122 M123 E127 T128 Q129N121-K125 WeakPolarHBondContact O-CB 3.48Å; N121-K125 PolarHBondContact O-N 3.01Å; D122-K125 PolarHBondContact O-N 2.84Å; M123-K125 VanDerWaalsContact C-N 3.29Å; M123-K125 PolarHBondContact O-N 3.02Å; K125-E127 VanDerWaalsContact C-N 3.34Å; K125-T128 WeakPolarHBondContact CA-OG1 3.48Å; K125-T128 PolarHBondContact O-OG1 3.25Å; K125-Q129 WeakPolarHBondContact O-CB 3.32Å; K125-Q129 VanDerWaalsContact O-CG 3.3Å; K125-Q129 WeakPolarHBondContact O-CG 3.37Å; K125-Q129 PolarHBondContact O-N 3.13Å
126M94.5Very high95.9Very high124 Ų12495.7 Ų95.761%0.61151%0.506SS*.Hα-helixtrans-65.8-38.3174.4-71.1-144.6-60.900112.1D122 M123 Q129 L130D122-M126 WeakPolarHBondContact O-CG 3.36Å; D122-M126 PolarHBondContact O-N 3.12Å; M123-M126 PolarHBondContact O-N 3.4Å; M126-Q129 PolarHBondContact O-N 3.04Å; M126-L130 WeakPolarHBondContact O-CB 3.43Å; M126-L130 WeakPolarHBondContact O-CG 3.43Å; M126-L130 PolarHBondContact O-N 3.12Å
127E95.5Very high96.1Very high118 Ų11896.6 Ų96.655%0.55151%0.506SS*.Hα-helixtrans-64.4-46.2177.5-171.7169.4-162.200111.8M123 Q124 K125 Q129 L130 C131M123-E127 WeakPolarHBondContact O-CB 3.33Å; M123-E127 PolarHBondContact O-N 3.01Å; Q124-E127 PolarHBondContact O-N 3.24Å; K125-E127 VanDerWaalsContact C-N 3.34Å; E127-Q129 VanDerWaalsContact C-N 3.32Å; E127-Q129 PolarHBondContact O-N 3.4Å; E127-L130 PolarHBondContact O-N 3.31Å; E127-C131 PolarHBondContact O-N 3.45Å; E127-C131 PolarHBondContact O-SG 3.07Å; E127-C131 VanDerWaalsContact O-SG 3.37Å
128T96.6Very high96.3Very high92 Ų9298.1 Ų98.156%0.56451%0.506SS*.Hα-helixtrans-62.1-39.2174.952.90000112.4Q124 K125 S132Q124-T128 WeakPolarHBondContact O-CG2 3.46Å; Q124-T128 PolarHBondContact O-N 3.28Å; Q124-T128 PolarHBondContact O-OG1 3.46Å; Q124-T128 VanDerWaalsContact O-OG1 3.09Å; K125-T128 WeakPolarHBondContact CA-OG1 3.48Å; K125-T128 PolarHBondContact O-OG1 3.25Å; T128-S132 WeakPolarHBondContact O-CB 3.4Å; T128-S132 PolarHBondContact O-N 2.86Å
129Q97.3Very high96.4Very high105 Ų10598.3 Ų98.349%0.49151%0.508SS..Hα-helixtrans-63.3-46.4173-75-179.5-7.800111.5K125 M126 E127 C131 S132 T133K125-Q129 WeakPolarHBondContact O-CB 3.32Å; K125-Q129 VanDerWaalsContact O-CG 3.3Å; K125-Q129 WeakPolarHBondContact O-CG 3.37Å; K125-Q129 PolarHBondContact O-N 3.13Å; M126-Q129 PolarHBondContact O-N 3.04Å; E127-Q129 VanDerWaalsContact C-N 3.32Å; E127-Q129 PolarHBondContact O-N 3.4Å; Q129-C131 PolarHBondContact O-N 3.48Å; Q129-S132 PolarHBondContact O-N 2.95Å; Q129-S132 VanDerWaalsContact O-N 3.16Å; Q129-S132 PolarHBondContact O-OG 3.27Å; Q129-T133 VanDerWaalsContact O-CG2 3.3Å; Q129-T133 WeakPolarHBondContact O-CG2 3.43Å; Q129-T133 PolarHBondContact O-N 3.12Å; Q129-T133 PolarHBondContact O-OG1 2.8Å
130L97.1Very high96.5Very high100 Ų10096.6 Ų96.652%0.52451%0.506SS..Hα-helixtrans-58.2-48.9176.3-82.6170.1000111.5M126 E127 S132 T133 H134M126-L130 WeakPolarHBondContact O-CB 3.43Å; M126-L130 WeakPolarHBondContact O-CG 3.43Å; M126-L130 PolarHBondContact O-N 3.12Å; E127-L130 PolarHBondContact O-N 3.31Å; L130-S132 VanDerWaalsContact C-N 3.3Å; L130-S132 PolarHBondContact O-N 3.24Å; L130-T133 WeakPolarHBondContact CA-OG1 2.89Å; L130-T133 PolarHBondContact O-N 3.22Å; L130-T133 PolarHBondContact O-OG1 3.07Å; L130-H134 WeakPolarHBondContact O-CB 3.25Å; L130-H134 PolarHBondContact O-CD2 3.38Å; L130-H134 PolarHBondContact O-N 3.02Å
131C96.5Very high96.6Very high70 Ų7097.7 Ų97.747%0.47351%0.509SS..Hα-helixtrans-57.2-43.7175.2-68.90000111.9E127 Q129 T133 H134 L135E127-C131 PolarHBondContact O-N 3.45Å; E127-C131 PolarHBondContact O-SG 3.07Å; E127-C131 VanDerWaalsContact O-SG 3.37Å; Q129-C131 PolarHBondContact O-N 3.48Å; C131-T133 PolarHBondContact O-N 3Å; C131-H134 PolarHBondContact O-N 3.49Å; C131-L135 WeakPolarHBondContact O-CG 3.31Å; C131-L135 PolarHBondContact O-N 3.28Å
132S97.3Very high96.7Very high54 Ų5498.2 Ų98.238%0.37851%0.508SS..Hα-helixtrans-63.9-41.317877.30000112.6T128 Q129 L130 L135 Q136T128-S132 WeakPolarHBondContact O-CB 3.4Å; T128-S132 PolarHBondContact O-N 2.86Å; Q129-S132 PolarHBondContact O-N 2.95Å; Q129-S132 VanDerWaalsContact O-N 3.16Å; Q129-S132 PolarHBondContact O-OG 3.27Å; L130-S132 VanDerWaalsContact C-N 3.3Å; L130-S132 PolarHBondContact O-N 3.24Å; S132-L135 PolarHBondContact O-N 3.05Å; S132-Q136 WeakPolarHBondContact O-CG 3.44Å; S132-Q136 PolarHBondContact O-N 2.95Å
133T95.8Very high96.8Very high66 Ų6699.2 Ų99.241%0.40551%0.51SS..Hα-helixtrans-69.4-35.9178.959.30000111.5Q129 L130 C131 Q136 L137Q129-T133 VanDerWaalsContact O-CG2 3.3Å; Q129-T133 WeakPolarHBondContact O-CG2 3.43Å; Q129-T133 PolarHBondContact O-N 3.12Å; Q129-T133 PolarHBondContact O-OG1 2.8Å; L130-T133 WeakPolarHBondContact CA-OG1 2.89Å; L130-T133 PolarHBondContact O-N 3.22Å; L130-T133 PolarHBondContact O-OG1 3.07Å; C131-T133 PolarHBondContact O-N 3Å; T133-Q136 PolarHBondContact O-N 2.9Å; T133-L137 VanDerWaalsContact O-CB 3.26Å; T133-L137 WeakPolarHBondContact O-CB 3.46Å; T133-L137 PolarHBondContact O-N 3.36Å
134H97.3Very high96.9Very high112 Ų11299.5 Ų99.552%0.51951%0.513SS..Hα-helixtrans-62.5-46.5173.4-90.7-68000111.5L130 C131 Q136 L137 D138L130-H134 WeakPolarHBondContact O-CB 3.25Å; L130-H134 PolarHBondContact O-CD2 3.38Å; L130-H134 PolarHBondContact O-N 3.02Å; C131-H134 PolarHBondContact O-N 3.49Å; H134-Q136 VanDerWaalsContact C-N 3.35Å; H134-Q136 PolarHBondContact O-N 3.06Å; H134-L137 PolarHBondContact O-N 3.32Å; H134-D138 PolarHBondContact O-N 2.95Å
135L97.5Very high96.9Very high125 Ų12597.1 Ų97.165%0.65451%0.51SS*.Hα-helixtrans-62-41.2176.8-70.5172.2000112.4C131 S132 D138 S139C131-L135 WeakPolarHBondContact O-CG 3.31Å; C131-L135 PolarHBondContact O-N 3.28Å; S132-L135 PolarHBondContact O-N 3.05Å; L135-D138 PolarHBondContact O-N 3.33Å; L135-S139 WeakPolarHBondContact O-CB 3.33Å; L135-S139 PolarHBondContact O-N 3.11Å
136Q97.3Very high96.9Very high128 Ų12895 Ų9560%0.59851%0.505SS*.Hα-helixtrans-63.6-42174.8-73.9177.5-3.500111.9S132 T133 H134 D138 S139 V140S132-Q136 WeakPolarHBondContact O-CG 3.44Å; S132-Q136 PolarHBondContact O-N 2.95Å; T133-Q136 PolarHBondContact O-N 2.9Å; H134-Q136 VanDerWaalsContact C-N 3.35Å; H134-Q136 PolarHBondContact O-N 3.06Å; Q136-D138 VanDerWaalsContact C-N 3.34Å; Q136-S139 WeakPolarHBondContact O-CB 3.45Å; Q136-S139 PolarHBondContact O-N 3.45Å; Q136-V140 WeakPolarHBondContact O-CG2 3.42Å; Q136-V140 PolarHBondContact O-N 2.96Å
137L96.8Very high96.9Very high84 Ų8491.6 Ų91.644%0.4450%0.496SS..Hα-helixtrans-65.3-39.5178.8-175.6149.5000111.4T133 H134 V140 K141T133-L137 VanDerWaalsContact O-CB 3.26Å; T133-L137 WeakPolarHBondContact O-CB 3.46Å; T133-L137 PolarHBondContact O-N 3.36Å; H134-L137 PolarHBondContact O-N 3.32Å; L137-V140 PolarHBondContact O-N 3.2Å; L137-K141 HydrophobicContact CD2-CD 3.75Å; L137-K141 HydrophobicContact CD2-CG 4.33Å; L137-K141 WeakPolarHBondContact O-CB 3.43Å; L137-K141 VanDerWaalsContact O-CG 3.31Å; L137-K141 WeakPolarHBondContact O-CG 3.48Å; L137-K141 PolarHBondContact O-N 3.36Å
138D97.6Very high97Very high86 Ų8691 Ų9146%0.4649%0.493SS..Hα-helixtrans-67-39174.7-69.8-21.9000111.6H134 L135 Q136 K141 Q142H134-D138 PolarHBondContact O-N 2.95Å; L135-D138 PolarHBondContact O-N 3.33Å; Q136-D138 VanDerWaalsContact C-N 3.34Å; D138-K141 PolarHBondContact O-N 3Å; D138-Q142 PolarHBondContact O-N 3.12Å
139S97.6Very high97Very high60 Ų6092.5 Ų92.542%0.4250%0.497SS..Hα-helixtrans-60-49.6172.4-168.10000111.9L135 Q136 K141 Q142 E143L135-S139 WeakPolarHBondContact O-CB 3.33Å; L135-S139 PolarHBondContact O-N 3.11Å; Q136-S139 WeakPolarHBondContact O-CB 3.45Å; Q136-S139 PolarHBondContact O-N 3.45Å; S139-K141 VanDerWaalsContact C-N 3.32Å; S139-K141 PolarHBondContact O-N 3.03Å; S139-Q142 WeakPolarHBondContact O-CB 3.23Å; S139-Q142 PolarHBondContact O-N 3.47Å; S139-Q142 VanDerWaalsContact O-N 3.16Å; S139-E143 WeakPolarHBondContact O-CG 3.42Å; S139-E143 PolarHBondContact O-N 2.88Å
140V97.1Very high96.9Very high90 Ų9094 Ų9455%0.54550%0.504SS..Hα-helixtrans-64.8-37.4179.7171.20000111.4Q136 L137 Q142 E143 L144Q136-V140 WeakPolarHBondContact O-CG2 3.42Å; Q136-V140 PolarHBondContact O-N 2.96Å; L137-V140 PolarHBondContact O-N 3.2Å; V140-Q142 VanDerWaalsContact C-N 3.32Å; V140-Q142 PolarHBondContact O-N 2.91Å; V140-E143 PolarHBondContact O-N 3.47Å; V140-L144 WeakPolarHBondContact O-CB 3.35Å; V140-L144 PolarHBondContact O-N 3.35Å
141K97.4Very high96.8Very high126 Ų12694.1 Ų94.155%0.54851%0.505SS..Hα-helixtrans-62-41173.5-81.5177.6176.4167.40112L137 D138 S139 L144 A145L137-K141 HydrophobicContact CD2-CD 3.75Å; L137-K141 HydrophobicContact CD2-CG 4.33Å; L137-K141 WeakPolarHBondContact O-CB 3.43Å; L137-K141 VanDerWaalsContact O-CG 3.31Å; L137-K141 WeakPolarHBondContact O-CG 3.48Å; L137-K141 PolarHBondContact O-N 3.36Å; D138-K141 PolarHBondContact O-N 3Å; S139-K141 VanDerWaalsContact C-N 3.32Å; S139-K141 PolarHBondContact O-N 3.03Å; K141-L144 PolarHBondContact O-N 3.38Å; K141-A145 PolarHBondContact O-N 2.79Å
142Q97.8Very high96.7Very high110 Ų11094.9 Ų94.951%0.51450%0.504SS..Hα-helixtrans-65.8-47176.9-173.859.84400111.1D138 S139 V140 L144 A145 D146D138-Q142 PolarHBondContact O-N 3.12Å; S139-Q142 WeakPolarHBondContact O-CB 3.23Å; S139-Q142 PolarHBondContact O-N 3.47Å; S139-Q142 VanDerWaalsContact O-N 3.16Å; V140-Q142 VanDerWaalsContact C-N 3.32Å; V140-Q142 PolarHBondContact O-N 2.91Å; Q142-L144 VanDerWaalsContact C-N 3.26Å; Q142-L144 PolarHBondContact O-N 3.31Å; Q142-A145 WeakPolarHBondContact O-CB 3.13Å; Q142-A145 PolarHBondContact O-N 3.32Å; Q142-A145 VanDerWaalsContact O-N 3.1Å; Q142-D146 PolarHBondContact NE2-OD1 2.63Å; Q142-D146 VanDerWaalsContact NE2-OD1 3.07Å; Q142-D146 PolarHBondContact O-N 2.93Å
143E97.1Very high96.7Very high118 Ų11897 Ų9755%0.55151%0.512SS*.Hα-helixtrans-58.6-38.9175.9-72.8174.3-159.200112.1S139 V140 D146 A147S139-E143 WeakPolarHBondContact O-CG 3.42Å; S139-E143 PolarHBondContact O-N 2.88Å; V140-E143 PolarHBondContact O-N 3.47Å; E143-D146 PolarHBondContact O-N 3.31Å; E143-A147 WeakPolarHBondContact O-CB 3.44Å; E143-A147 PolarHBondContact O-N 3.47Å
144L97.1Very high96.6Very high102 Ų10297.9 Ų97.953%0.53452%0.517SS..Hα-helixtrans-64.5-42.1175.6-177.265.4000111.9V140 K141 Q142 A147 H148V140-L144 WeakPolarHBondContact O-CB 3.35Å; V140-L144 PolarHBondContact O-N 3.35Å; K141-L144 PolarHBondContact O-N 3.38Å; Q142-L144 VanDerWaalsContact C-N 3.26Å; Q142-L144 PolarHBondContact O-N 3.31Å; L144-A147 PolarHBondContact O-N 3.14Å; L144-H148 PolarHBondContact O-CD2 3.04Å; L144-H148 VanDerWaalsContact O-CD2 3.24Å; L144-H148 PolarHBondContact O-N 3.37Å
145A97.1Very high96.5Very high52 Ų5299 Ų9943%0.4352%0.52SS..Hα-helixtrans-64.1-42.5176.500000111.7K141 Q142 H148 L149K141-A145 PolarHBondContact O-N 2.79Å; Q142-A145 WeakPolarHBondContact O-CB 3.13Å; Q142-A145 PolarHBondContact O-N 3.32Å; Q142-A145 VanDerWaalsContact O-N 3.1Å; A145-H148 PolarHBondContact O-N 3.45Å; A145-L149 PolarHBondContact O-N 3.01Å
146D97.3Very high96.4Very high74 Ų7497.8 Ų97.840%0.39651%0.514SS..Hα-helixtrans-65.9-41.4177.9-66.7-17.9000111.4Q142 E143 H148 L149 Q150Q142-D146 PolarHBondContact NE2-OD1 2.63Å; Q142-D146 VanDerWaalsContact NE2-OD1 3.07Å; Q142-D146 PolarHBondContact O-N 2.93Å; E143-D146 PolarHBondContact O-N 3.31Å; D146-H148 VanDerWaalsContact C-N 3.35Å; D146-H148 PolarHBondContact O-N 3.33Å; D146-L149 PolarHBondContact O-N 3.43Å; D146-Q150 WeakPolarHBondContact O-CG 3.47Å; D146-Q150 PolarHBondContact O-N 3.16Å
147A95Very high96.2Very high52 Ų5296.7 Ų96.743%0.4351%0.511SS..Hα-helixtrans-63.2-39.9175.100000112.1E143 L144 Q150 L151E143-A147 WeakPolarHBondContact O-CB 3.44Å; E143-A147 PolarHBondContact O-N 3.47Å; L144-A147 PolarHBondContact O-N 3.14Å; A147-Q150 PolarHBondContact O-N 2.88Å; A147-L151 WeakPolarHBondContact O-CB 3.25Å; A147-L151 PolarHBondContact O-N 3.02Å
148H95.7Very high96Very high104 Ų10496 Ų9648%0.48151%0.513SS..Hα-helixtrans-61.1-44.4173.8-90.3-63.9000112.1L144 A145 D146 Q150 L151 D152L144-H148 PolarHBondContact O-CD2 3.04Å; L144-H148 VanDerWaalsContact O-CD2 3.24Å; L144-H148 PolarHBondContact O-N 3.37Å; A145-H148 PolarHBondContact O-N 3.45Å; D146-H148 VanDerWaalsContact C-N 3.35Å; D146-H148 PolarHBondContact O-N 3.33Å; H148-Q150 VanDerWaalsContact C-N 3.34Å; H148-Q150 PolarHBondContact O-N 2.95Å; H148-L151 PolarHBondContact O-N 3.26Å; H148-D152 PolarHBondContact O-N 3.28Å
149L97.1Very high95.8Very high124 Ų12494.3 Ų94.365%0.64951%0.51SS*.Hα-helixtrans-62.4-41.1177.7-174.267.8000112A145 D146 D152 N153A145-L149 PolarHBondContact O-N 3.01Å; D146-L149 PolarHBondContact O-N 3.43Å; L149-D152 PolarHBondContact O-N 3.42Å; L149-N153 WeakPolarHBondContact O-CB 3.35Å; L149-N153 PolarHBondContact O-N 3.17Å
150Q96Very high95.6Very high136 Ų13695 Ų9564%0.63651%0.512SS*.Hα-helixtrans-65.1-41175.6-70.7-178.720.600112D146 A147 H148 N153 T154D146-Q150 WeakPolarHBondContact O-CG 3.47Å; D146-Q150 PolarHBondContact O-N 3.16Å; A147-Q150 PolarHBondContact O-N 2.88Å; H148-Q150 VanDerWaalsContact C-N 3.34Å; H148-Q150 PolarHBondContact O-N 2.95Å; Q150-N153 PolarHBondContact O-N 3.28Å; Q150-T154 WeakPolarHBondContact O-CG2 3.44Å; Q150-T154 PolarHBondContact O-N 3.39Å; Q150-T154 PolarHBondContact O-OG1 2.97Å; Q150-T154 VanDerWaalsContact O-OG1 3.07Å
151L94.9Very high95.4Very high104 Ų10494.8 Ų94.855%0.54551%0.511SS..Hα-helixtrans-62.8-45177-177.462.8000111.4A147 H148 N153 T154 K155A147-L151 WeakPolarHBondContact O-CB 3.25Å; A147-L151 PolarHBondContact O-N 3.02Å; H148-L151 PolarHBondContact O-N 3.26Å; L151-N153 VanDerWaalsContact C-N 3.33Å; L151-N153 PolarHBondContact O-N 3.27Å; L151-T154 WeakPolarHBondContact CA-OG1 3.36Å; L151-T154 PolarHBondContact O-N 3.15Å; L151-T154 PolarHBondContact O-OG1 3.12Å; L151-K155 VanDerWaalsContact O-CB 3.3Å; L151-K155 WeakPolarHBondContact O-CB 3.49Å; L151-K155 PolarHBondContact O-N 3.43Å
152D94.8Very high95.2Very high86 Ų8693.6 Ų93.646%0.4651%0.51SS..Hα-helixtrans-64.6-39.3177.4-78.1-20.1000111.8H148 L149 K155 N156H148-D152 PolarHBondContact O-N 3.28Å; L149-D152 PolarHBondContact O-N 3.42Å; D152-K155 PolarHBondContact O-N 2.95Å; D152-N156 WeakPolarHBondContact O-CB 3.48Å; D152-N156 VanDerWaalsContact O-CG 3.23Å; D152-N156 PolarHBondContact O-N 2.92Å; D152-N156 PolarHBondContact O-ND2 2.94Å
153N95.8Very high94.9Very high99 Ų9993.1 Ų93.153%0.52951%0.511SS..Hα-helixtrans-64.4-45.2175.6-167.519.5000112.1L149 Q150 L151 K155 N156 M157L149-N153 WeakPolarHBondContact O-CB 3.35Å; L149-N153 PolarHBondContact O-N 3.17Å; Q150-N153 PolarHBondContact O-N 3.28Å; L151-N153 VanDerWaalsContact C-N 3.33Å; L151-N153 PolarHBondContact O-N 3.27Å; N153-K155 VanDerWaalsContact C-N 3.33Å; N153-K155 PolarHBondContact O-N 3.26Å; N153-N156 PolarHBondContact O-N 3.46Å; N153-M157 WeakPolarHBondContact O-CG 3.47Å; N153-M157 PolarHBondContact O-N 3.17Å
154T94.8Very high94.6Very high84 Ų8490.3 Ų90.352%0.51551%0.508SS..Hα-helixtrans-65.5-36.2176.954.80000112.2Q150 L151 M157 S158Q150-T154 WeakPolarHBondContact O-CG2 3.44Å; Q150-T154 PolarHBondContact O-N 3.39Å; Q150-T154 PolarHBondContact O-OG1 2.97Å; Q150-T154 VanDerWaalsContact O-OG1 3.07Å; L151-T154 WeakPolarHBondContact CA-OG1 3.36Å; L151-T154 PolarHBondContact O-N 3.15Å; L151-T154 PolarHBondContact O-OG1 3.12Å; T154-M157 PolarHBondContact O-N 3.32Å; T154-S158 WeakPolarHBondContact O-CB 3.42Å; T154-S158 PolarHBondContact O-N 2.74Å; T154-S158 PolarHBondContact O-OG 2.86Å
155K95.4Very high94.4Very high136 Ų13688.5 Ų88.559%0.59150%0.501SS*.Hα-helixtrans-63.5-43.2173.3-173.7179.7177.6-175.50111.6L151 D152 N153 S158 A159L151-K155 VanDerWaalsContact O-CB 3.3Å; L151-K155 WeakPolarHBondContact O-CB 3.49Å; L151-K155 PolarHBondContact O-N 3.43Å; D152-K155 PolarHBondContact O-N 2.95Å; N153-K155 VanDerWaalsContact C-N 3.33Å; N153-K155 PolarHBondContact O-N 3.26Å; K155-S158 WeakPolarHBondContact CA-OG 3.45Å; K155-S158 PolarHBondContact O-OG 3.04Å; K155-A159 WeakPolarHBondContact O-CB 3.46Å; K155-A159 PolarHBondContact O-N 3.24Å
156N94Very high94.2Very high99 Ų9990.7 Ų90.753%0.52950%0.502SS..Hα-helixtrans-65.7-44.4176.9-70.8-19.8000111.6D152 N153 A159 T160D152-N156 WeakPolarHBondContact O-CB 3.48Å; D152-N156 VanDerWaalsContact O-CG 3.23Å; D152-N156 PolarHBondContact O-N 2.92Å; D152-N156 PolarHBondContact O-ND2 2.94Å; N153-N156 PolarHBondContact O-N 3.46Å; N156-A159 PolarHBondContact O-N 3.44Å; N156-T160 WeakPolarHBondContact O-CG2 3.3Å; N156-T160 PolarHBondContact O-N 3Å; N156-T160 PolarHBondContact O-OG1 2.52Å
157M94.1Very high94Very high105 Ų10592.3 Ų92.352%0.51751%0.511SS..Hα-helixtrans-65.2-39.1177.6-69.7-70.38400113.6N153 T154 T160 T161N153-M157 WeakPolarHBondContact O-CG 3.47Å; N153-M157 PolarHBondContact O-N 3.17Å; T154-M157 PolarHBondContact O-N 3.32Å; M157-T160 WeakPolarHBondContact CA-OG1 3.42Å; M157-T160 HydrophobicContact CE-CG2 4.48Å; M157-T160 PolarHBondContact O-OG1 2.87Å; M157-T161 WeakPolarHBondContact O-CB 3.33Å; M157-T161 PolarHBondContact O-N 3.1Å; M157-T161 PolarHBondContact O-OG1 3.47Å
158S92.6Very high94Very high70 Ų7095.3 Ų95.349%0.4952%0.516SS..Hα-helixtrans-68.3-39.6175.253.40000111.7T154 K155 T161 L162T154-S158 WeakPolarHBondContact O-CB 3.42Å; T154-S158 PolarHBondContact O-N 2.74Å; T154-S158 PolarHBondContact O-OG 2.86Å; K155-S158 WeakPolarHBondContact CA-OG 3.45Å; K155-S158 PolarHBondContact O-OG 3.04Å; S158-T161 PolarHBondContact O-N 3.49Å; S158-L162 WeakPolarHBondContact O-CB 3.2Å; S158-L162 PolarHBondContact O-N 3.48Å
159A93.6Very high93.9Very high49 Ų4994.4 Ų94.441%0.40551%0.514SS..Hα-helixtrans-61.7-44.6174.600000112.3K155 N156 T161 L162 L163K155-A159 WeakPolarHBondContact O-CB 3.46Å; K155-A159 PolarHBondContact O-N 3.24Å; N156-A159 PolarHBondContact O-N 3.44Å; A159-T161 VanDerWaalsContact C-N 3.35Å; A159-T161 PolarHBondContact O-N 3.02Å; A159-L162 PolarHBondContact O-N 2.87Å; A159-L163 WeakPolarHBondContact O-CG 3.37Å; A159-L163 PolarHBondContact O-N 2.91Å; A159-L163 VanDerWaalsContact O-N 3.08Å
160T92.9Very high93.7Very high74 Ų7493 Ų9345%0.45451%0.507SS..Hα-helixtrans-65.3-38.8176.853.70000112.3N156 M157 A164N156-T160 WeakPolarHBondContact O-CG2 3.3Å; N156-T160 PolarHBondContact O-N 3Å; N156-T160 PolarHBondContact O-OG1 2.52Å; M157-T160 WeakPolarHBondContact CA-OG1 3.42Å; M157-T160 HydrophobicContact CE-CG2 4.48Å; M157-T160 PolarHBondContact O-OG1 2.87Å; T160-A164 PolarHBondContact O-N 2.92Å; T160-A164 VanDerWaalsContact O-N 3.11Å
161T93.1Very high93.8Very high86 Ų8692.2 Ų92.253%0.52850%0.503SS..Hα-helixtrans-65.7-42.2177.4-54.60000110.8M157 S158 A159 A164 T165M157-T161 WeakPolarHBondContact O-CB 3.33Å; M157-T161 PolarHBondContact O-N 3.1Å; M157-T161 PolarHBondContact O-OG1 3.47Å; S158-T161 PolarHBondContact O-N 3.49Å; A159-T161 VanDerWaalsContact C-N 3.35Å; A159-T161 PolarHBondContact O-N 3.02Å; T161-A164 PolarHBondContact O-N 2.88Å; T161-T165 WeakPolarHBondContact O-CG2 3.47Å; T161-T165 PolarHBondContact O-N 3.47Å; T161-T165 PolarHBondContact O-OG1 3.21Å
162L93.7Very high93.8Very high102 Ų10291.6 Ų91.653%0.53450%0.5SS..Hα-helixtrans-60.1-48.5177.6-171.3157.8000111S158 A159 A164 T165 E166S158-L162 WeakPolarHBondContact O-CB 3.2Å; S158-L162 PolarHBondContact O-N 3.48Å; A159-L162 PolarHBondContact O-N 2.87Å; L162-A164 VanDerWaalsContact C-N 3.33Å; L162-A164 PolarHBondContact O-N 2.95Å; L162-T165 PolarHBondContact O-N 3.34Å; L162-T165 PolarHBondContact O-OG1 2.84Å; L162-E166 WeakPolarHBondContact O-CB 3.33Å; L162-E166 PolarHBondContact O-N 2.91Å
163L90.9Very high93.9Very high100 Ų10093.4 Ų93.452%0.52450%0.503SS..Hα-helixtrans-59-43.5177.8-70.4173.1000112A159 T165 E166 D167A159-L163 WeakPolarHBondContact O-CG 3.37Å; A159-L163 PolarHBondContact O-N 2.91Å; A159-L163 VanDerWaalsContact O-N 3.08Å; L163-T165 VanDerWaalsContact C-N 3.35Å; L163-T165 PolarHBondContact O-N 2.83Å; L163-E166 PolarHBondContact O-N 3.04Å; L163-D167 PolarHBondContact O-N 3.14Å
164A90.6Very high93.9Very high59 Ų5990.9 Ų90.949%0.48850%0.496SS..Hα-helixtrans-61.4-42.3176.600000112.3T160 T161 L162 E168T160-A164 PolarHBondContact O-N 2.92Å; T160-A164 VanDerWaalsContact O-N 3.11Å; T161-A164 PolarHBondContact O-N 2.88Å; L162-A164 VanDerWaalsContact C-N 3.33Å; L162-A164 PolarHBondContact O-N 2.95Å; A164-E168 PolarHBondContact O-N 2.78Å; A164-E168 VanDerWaalsContact O-N 3.14Å
165T93.5Very high94Very high64 Ų6491.8 Ų91.839%0.39350%0.495SS..Hα-helixtrans-70-31.6176.459.20000112.8T161 L162 L163 E168 I169T161-T165 WeakPolarHBondContact O-CG2 3.47Å; T161-T165 PolarHBondContact O-N 3.47Å; T161-T165 PolarHBondContact O-OG1 3.21Å; L162-T165 PolarHBondContact O-N 3.34Å; L162-T165 PolarHBondContact O-OG1 2.84Å; L163-T165 VanDerWaalsContact C-N 3.35Å; L163-T165 PolarHBondContact O-N 2.83Å; T165-E168 PolarHBondContact O-N 2.79Å; T165-I169 WeakPolarHBondContact O-CD1 3.43Å; T165-I169 VanDerWaalsContact O-CG1 3.24Å; T165-I169 WeakPolarHBondContact O-CG1 3.37Å; T165-I169 PolarHBondContact O-N 2.88Å
166E92.6Very high94Very high97 Ų9789.4 Ų89.445%0.45349%0.488SS..Hα-helixtrans-67.4-44.5176.3-175170-168.800111L162 L163 E168 I169 L170L162-E166 WeakPolarHBondContact O-CB 3.33Å; L162-E166 PolarHBondContact O-N 2.91Å; L163-E166 PolarHBondContact O-N 3.04Å; E166-E168 VanDerWaalsContact C-N 3.34Å; E166-E168 PolarHBondContact O-N 2.98Å; E166-I169 PolarHBondContact O-N 2.71Å; E166-L170 WeakPolarHBondContact O-CG 3.41Å; E166-L170 PolarHBondContact O-N 2.95Å
167D92.9Very high94.1Very high108 Ų10892.2 Ų92.258%0.57849%0.491SS*.Hα-helixtrans-60-42.6174.4-77.2-19.1000111.7L163 L170 Q171L163-D167 PolarHBondContact O-N 3.14Å; D167-L170 PolarHBondContact O-N 3.37Å; D167-Q171 PolarHBondContact O-N 3.03Å
168E95.5Very high94.3Very high115 Ų11589.6 Ų89.654%0.53749%0.486SS..Hα-helixtrans-62.1-43.8175.3-173.4179.7-175.300111.8A164 T165 E166 L170 Q171 L172A164-E168 PolarHBondContact O-N 2.78Å; A164-E168 VanDerWaalsContact O-N 3.14Å; T165-E168 PolarHBondContact O-N 2.79Å; E166-E168 VanDerWaalsContact C-N 3.34Å; E166-E168 PolarHBondContact O-N 2.98Å; E168-L170 VanDerWaalsContact C-N 3.31Å; E168-L170 PolarHBondContact O-N 3.28Å; E168-Q171 PolarHBondContact O-N 3.38Å; E168-L172 HydrophobicContact CG-CD1 4.17Å; E168-L172 WeakPolarHBondContact O-CB 3.34Å; E168-L172 WeakPolarHBondContact O-CG 3.39Å; E168-L172 PolarHBondContact O-N 3.44Å
169I93.4Very high94.4Very high86 Ų8688.6 Ų88.644%0.44148%0.482SS..Hα-helixtrans-62.3-40.4176.2-71165.5000110.9T165 E166 L172 K173T165-I169 WeakPolarHBondContact O-CD1 3.43Å; T165-I169 VanDerWaalsContact O-CG1 3.24Å; T165-I169 WeakPolarHBondContact O-CG1 3.37Å; T165-I169 PolarHBondContact O-N 2.88Å; E166-I169 PolarHBondContact O-N 2.71Å; I169-L172 PolarHBondContact O-N 2.85Å; I169-K173 HydrophobicContact CG2-CD 4.05Å; I169-K173 HydrophobicContact CG2-CG 4.44Å; I169-K173 WeakPolarHBondContact O-CB 3.29Å; I169-K173 VanDerWaalsContact O-CG 3.27Å; I169-K173 WeakPolarHBondContact O-CG 3.2Å; I169-K173 PolarHBondContact O-N 3.42Å
170L93.4Very high94.5Very high94 Ų9494.1 Ų94.149%0.49249%0.492SS..Hα-helixtrans-63.9-42.6176.9-72.9173.9000111.4E166 D167 E168 K173 A174E166-L170 WeakPolarHBondContact O-CG 3.41Å; E166-L170 PolarHBondContact O-N 2.95Å; D167-L170 PolarHBondContact O-N 3.37Å; E168-L170 VanDerWaalsContact C-N 3.31Å; E168-L170 PolarHBondContact O-N 3.28Å; L170-K173 PolarHBondContact O-N 3.24Å; L170-A174 PolarHBondContact O-N 3.47Å
171Q96.7Very high94.7Very high119 Ų11995.7 Ų95.756%0.55650%0.498SS*.Hα-helixtrans-61.9-51175-177.6174.7-9.100111.4D167 E168 K173 A174 E175D167-Q171 PolarHBondContact O-N 3.03Å; E168-Q171 PolarHBondContact O-N 3.38Å; Q171-K173 VanDerWaalsContact C-N 3.28Å; Q171-K173 PolarHBondContact O-N 2.86Å; Q171-A174 WeakPolarHBondContact O-CA 3.21Å; Q171-A174 WeakPolarHBondContact O-CB 3.49Å; Q171-A174 PolarHBondContact O-N 2.86Å; Q171-E175 PolarHBondContact NE2-OE1 2.9Å; Q171-E175 PolarHBondContact O-N 3.13Å
172L96.3Very high94.8Very high91 Ų9197.2 Ų97.248%0.47650%0.499SS..Hα-helixtrans-60.1-37.3178.5-71.1173.2000112.1E168 I169 A174 E175 L176E168-L172 HydrophobicContact CG-CD1 4.17Å; E168-L172 WeakPolarHBondContact O-CB 3.34Å; E168-L172 WeakPolarHBondContact O-CG 3.39Å; E168-L172 PolarHBondContact O-N 3.44Å; I169-L172 PolarHBondContact O-N 2.85Å; L172-A174 VanDerWaalsContact C-N 3.34Å; L172-A174 PolarHBondContact O-N 3.26Å; L172-E175 PolarHBondContact O-N 3.22Å; L172-L176 WeakPolarHBondContact O-CB 3.42Å; L172-L176 PolarHBondContact O-N 3.5Å
173K95.2Very high94.9Very high124 Ų12496.9 Ų96.954%0.53950%0.501SS..Hα-helixtrans-66.3-33.6173.7-79176.1178.8174.60112.8I169 L170 Q171 R177I169-K173 HydrophobicContact CG2-CD 4.05Å; I169-K173 HydrophobicContact CG2-CG 4.44Å; I169-K173 WeakPolarHBondContact O-CB 3.29Å; I169-K173 VanDerWaalsContact O-CG 3.27Å; I169-K173 WeakPolarHBondContact O-CG 3.2Å; I169-K173 PolarHBondContact O-N 3.42Å; L170-K173 PolarHBondContact O-N 3.24Å; Q171-K173 VanDerWaalsContact C-N 3.28Å; Q171-K173 PolarHBondContact O-N 2.86Å; K173-R177 WeakPolarHBondContact O-CG 3.42Å; K173-R177 PolarHBondContact O-N 3.43Å; K173-R177 PolarHBondContact O-NE 3.05Å
174A96.1Very high95.1Very high46 Ų4696.1 Ų96.138%0.3850%0.495SS..Hα-helixtrans-70.1-46.4175.100000110.9L170 Q171 L172 L176 R177 A178L170-A174 PolarHBondContact O-N 3.47Å; Q171-A174 WeakPolarHBondContact O-CA 3.21Å; Q171-A174 WeakPolarHBondContact O-CB 3.49Å; Q171-A174 PolarHBondContact O-N 2.86Å; L172-A174 VanDerWaalsContact C-N 3.34Å; L172-A174 PolarHBondContact O-N 3.26Å; A174-L176 PolarHBondContact O-N 2.83Å; A174-R177 PolarHBondContact O-N 3.47Å; A174-A178 PolarHBondContact O-N 3.06Å
175E96.8Very high95.4Very high103 Ų10396.2 Ų96.248%0.48149%0.49SS..Hα-helixtrans-61.2-42.3176.6-70.1177-166.800112Q171 L172 R177 A178 A179Q171-E175 PolarHBondContact NE2-OE1 2.9Å; Q171-E175 PolarHBondContact O-N 3.13Å; L172-E175 PolarHBondContact O-N 3.22Å; E175-R177 VanDerWaalsContact C-N 3.33Å; E175-R177 PolarHBondContact O-N 3.45Å; E175-A178 PolarHBondContact O-N 2.76Å; E175-A179 WeakPolarHBondContact O-CB 2.98Å; E175-A179 PolarHBondContact O-N 3.24Å
176L96.4Very high95.5Very high86 Ų86100.1 Ų100.145%0.4550%0.498SS..Hα-helixtrans-63.5-37.9177.1-170.9163.1000111.9L172 A174 R180L172-L176 WeakPolarHBondContact O-CB 3.42Å; L172-L176 PolarHBondContact O-N 3.5Å; A174-L176 PolarHBondContact O-N 2.83Å; L176-R180 HydrophobicContact CD2-CG 4.16Å; L176-R180 VanDerWaalsContact CD2-NE 3.26Å; L176-R180 WeakPolarHBondContact O-CG 3.43Å; L176-R180 PolarHBondContact O-N 3.45Å
177R96.4Very high95.7Very high159 Ų159101 Ų10160%0.650%0.5SS*.Hα-helixtrans-64-47.8172.6-81.4-175.5-74.9167.4-3.6111.5K173 A174 E175 A179 R180 D181K173-R177 WeakPolarHBondContact O-CG 3.42Å; K173-R177 PolarHBondContact O-N 3.43Å; K173-R177 PolarHBondContact O-NE 3.05Å; A174-R177 PolarHBondContact O-N 3.47Å; E175-R177 VanDerWaalsContact C-N 3.33Å; E175-R177 PolarHBondContact O-N 3.45Å; R177-A179 VanDerWaalsContact C-N 3.3Å; R177-A179 PolarHBondContact O-N 2.67Å; R177-R180 WeakPolarHBondContact O-CB 3.34Å; R177-R180 PolarHBondContact O-N 3.1Å; R177-R180 VanDerWaalsContact O-N 3.14Å; R177-D181 PolarHBondContact O-N 3.39Å
178A96.7Very high95.9Very high49 Ų49102.9 Ų102.941%0.40550%0.499SS..Hα-helixtrans-59.4-41.2177.400000112.1A174 E175 D181 Q182A174-A178 PolarHBondContact O-N 3.06Å; E175-A178 PolarHBondContact O-N 2.76Å; A178-D181 PolarHBondContact O-N 2.79Å; A178-Q182 WeakPolarHBondContact O-CG 3.5Å; A178-Q182 PolarHBondContact O-N 3.4Å
179A95.8Very high95.9Very high49 Ų49103.3 Ų103.341%0.40550%0.499SS..Hα-helixtrans-63.7-40.9175.600000112.2E175 R177 Q182 V183E175-A179 WeakPolarHBondContact O-CB 2.98Å; E175-A179 PolarHBondContact O-N 3.24Å; R177-A179 VanDerWaalsContact C-N 3.3Å; R177-A179 PolarHBondContact O-N 2.67Å; A179-Q182 WeakPolarHBondContact O-CB 3.1Å; A179-Q182 PolarHBondContact O-N 3.41Å; A179-V183 WeakPolarHBondContact O-CG2 3.02Å; A179-V183 PolarHBondContact O-N 3.28Å
180R95.8Very high96Very high165 Ų165102.8 Ų102.862%0.62350%0.5SS*.Hα-helixtrans-62-42.9174.6-77.5178.1176.8168.33.1112.2L176 R177 Q182 V183 E184L176-R180 HydrophobicContact CD2-CG 4.16Å; L176-R180 VanDerWaalsContact CD2-NE 3.26Å; L176-R180 WeakPolarHBondContact O-CG 3.43Å; L176-R180 PolarHBondContact O-N 3.45Å; R177-R180 WeakPolarHBondContact O-CB 3.34Å; R177-R180 PolarHBondContact O-N 3.1Å; R177-R180 VanDerWaalsContact O-N 3.14Å; R180-Q182 VanDerWaalsContact C-N 3.29Å; R180-Q182 PolarHBondContact O-N 3.03Å; R180-V183 PolarHBondContact O-N 2.91Å; R180-E184 PolarHBondContact O-N 3.18Å
181D96.2Very high96.1Very high108 Ų108102.2 Ų102.258%0.57850%0.497SS*.Hα-helixtrans-64.3-36.3177.8-67.7-20.9000111.8R177 A178 T185R177-D181 PolarHBondContact O-N 3.39Å; A178-D181 PolarHBondContact O-N 2.79Å; D181-T185 WeakPolarHBondContact O-CB 3.33Å; D181-T185 PolarHBondContact O-N 3.11Å; D181-T185 PolarHBondContact O-OG1 3.19Å
182Q96.1Very high96Very high118 Ų11899.9 Ų99.955%0.55149%0.491SS*.Hα-helixtrans-63.7-45.8171.9-72.2179.911.200111.7A178 A179 R180 E184 T185 Y186A178-Q182 WeakPolarHBondContact O-CG 3.5Å; A178-Q182 PolarHBondContact O-N 3.4Å; A179-Q182 WeakPolarHBondContact O-CB 3.1Å; A179-Q182 PolarHBondContact O-N 3.41Å; R180-Q182 VanDerWaalsContact C-N 3.29Å; R180-Q182 PolarHBondContact O-N 3.03Å; Q182-E184 PolarHBondContact O-N 2.88Å; Q182-T185 WeakPolarHBondContact O-CA 3.3Å; Q182-T185 WeakPolarHBondContact O-CB 3.27Å; Q182-T185 PolarHBondContact O-N 2.98Å; Q182-T185 VanDerWaalsContact O-N 3.11Å; Q182-Y186 HydrophobicContact CB-CE2 4.49Å; Q182-Y186 WeakPolarHBondContact O-CD2 3.37Å; Q182-Y186 PolarHBondContact O-N 2.91Å
183V95.8Very high96Very high94 Ų94100.9 Ų100.957%0.5750%0.497SS*.Hα-helixtrans-59.8-44.8177.4170.20000111.4A179 R180 T185 Y186 K187A179-V183 WeakPolarHBondContact O-CG2 3.02Å; A179-V183 PolarHBondContact O-N 3.28Å; R180-V183 PolarHBondContact O-N 2.91Å; V183-T185 VanDerWaalsContact C-N 3.27Å; V183-T185 PolarHBondContact O-N 3.37Å; V183-Y186 PolarHBondContact O-N 3.41Å; V183-K187 WeakPolarHBondContact O-CB 3.28Å; V183-K187 PolarHBondContact O-N 3.47Å
184E95.9Very high96Very high84 Ų8498 Ų9839%0.39349%0.487SS..Hα-helixtrans-60.5-38.5174.6-80.8-63.9145.800112R180 Q182 K187 R188R180-E184 PolarHBondContact O-N 3.18Å; Q182-E184 PolarHBondContact O-N 2.88Å; E184-K187 PolarHBondContact O-N 3.5Å; E184-R188 WeakPolarHBondContact O-CG 3.45Å; E184-R188 PolarHBondContact O-N 3.13Å; E184-R188 VanDerWaalsContact O-N 3.1Å
185T96.4Very high96Very high62 Ų62100 Ų10038%0.3849%0.492SS..Hα-helixtrans-65.4-42.4175.4-55.80000111.8D181 Q182 V183 R188 K189D181-T185 WeakPolarHBondContact O-CB 3.33Å; D181-T185 PolarHBondContact O-N 3.11Å; D181-T185 PolarHBondContact O-OG1 3.19Å; Q182-T185 WeakPolarHBondContact O-CA 3.3Å; Q182-T185 WeakPolarHBondContact O-CB 3.27Å; Q182-T185 PolarHBondContact O-N 2.98Å; Q182-T185 VanDerWaalsContact O-N 3.11Å; V183-T185 VanDerWaalsContact C-N 3.27Å; V183-T185 PolarHBondContact O-N 3.37Å; T185-R188 PolarHBondContact O-N 3.38Å; T185-K189 WeakPolarHBondContact O-CG 3.42Å; T185-K189 PolarHBondContact O-N 3.14Å
186Y95.9Very high95.9Very high145 Ų145101.6 Ų101.657%0.56949%0.494SS*.Hα-helixtrans-65.9-39.2175.3-78.1-66.7000112.2Q182 V183 R188 K189 V190Q182-Y186 HydrophobicContact CB-CE2 4.49Å; Q182-Y186 WeakPolarHBondContact O-CD2 3.37Å; Q182-Y186 PolarHBondContact O-N 2.91Å; V183-Y186 PolarHBondContact O-N 3.41Å; Y186-R188 PolarHBondContact O-N 3.05Å; Y186-K189 HydrophobicContact CD1-CD 4.42Å; Y186-K189 WeakPolarHBondContact O-CA 3.48Å; Y186-K189 WeakPolarHBondContact O-CB 3.49Å; Y186-K189 PolarHBondContact O-N 3.16Å; Y186-K189 VanDerWaalsContact O-N 3.07Å; Y186-V190 WeakPolarHBondContact O-CG2 3.33Å; Y186-V190 PolarHBondContact O-N 3.5Å
187K96.3Very high95.9Very high115 Ų115102.2 Ų102.250%0.550%0.495SS..Hα-helixtrans-58.2-47.4175.9-172.9179.7176.3-1740111.7V183 E184 K189 V190 D191V183-K187 WeakPolarHBondContact O-CB 3.28Å; V183-K187 PolarHBondContact O-N 3.47Å; E184-K187 PolarHBondContact O-N 3.5Å; K187-K189 VanDerWaalsContact C-N 3.26Å; K187-K189 PolarHBondContact O-N 3Å; K187-V190 WeakPolarHBondContact O-CB 3.48Å; K187-V190 PolarHBondContact O-N 2.9Å; K187-D191 PolarHBondContact O-N 3.31Å
188R96Very high95.9Very high149 Ų149100.8 Ų100.856%0.56249%0.489SS*.Hα-helixtrans-58.4-37.3174-66.5173.7-159139.47112.6E184 T185 Y186 D191 V192E184-R188 WeakPolarHBondContact O-CG 3.45Å; E184-R188 PolarHBondContact O-N 3.13Å; E184-R188 VanDerWaalsContact O-N 3.1Å; T185-R188 PolarHBondContact O-N 3.38Å; Y186-R188 PolarHBondContact O-N 3.05Å; R188-D191 PolarHBondContact O-N 2.84Å; R188-V192 WeakPolarHBondContact O-CG2 3.33Å; R188-V192 PolarHBondContact O-N 3.28Å
189K95.9Very high95.9Very high123 Ų123103.6 Ų103.654%0.53549%0.494SS..Hα-helixtrans-67.3-38175.8-69.3178.2-179.1179.60111.9T185 Y186 K187 V192 L193T185-K189 WeakPolarHBondContact O-CG 3.42Å; T185-K189 PolarHBondContact O-N 3.14Å; Y186-K189 HydrophobicContact CD1-CD 4.42Å; Y186-K189 WeakPolarHBondContact O-CA 3.48Å; Y186-K189 WeakPolarHBondContact O-CB 3.49Å; Y186-K189 PolarHBondContact O-N 3.16Å; Y186-K189 VanDerWaalsContact O-N 3.07Å; K187-K189 VanDerWaalsContact C-N 3.26Å; K187-K189 PolarHBondContact O-N 3Å; K189-V192 PolarHBondContact O-N 2.96Å; K189-L193 WeakPolarHBondContact O-CG 3.44Å; K189-L193 PolarHBondContact O-N 3.22Å; K189-L193 VanDerWaalsContact O-N 3.1Å
190V95.9Very high95.9Very high76 Ų76104.7 Ų104.746%0.46150%0.495SS..Hα-helixtrans-64.9-44.9175.2173.30000110.6Y186 K187 V192 L193 D194Y186-V190 WeakPolarHBondContact O-CG2 3.33Å; Y186-V190 PolarHBondContact O-N 3.5Å; K187-V190 WeakPolarHBondContact O-CB 3.48Å; K187-V190 PolarHBondContact O-N 2.9Å; V190-V192 PolarHBondContact O-N 3.4Å; V190-L193 WeakPolarHBondContact O-CA 3.48Å; V190-L193 WeakPolarHBondContact O-CB 3.43Å; V190-L193 PolarHBondContact O-N 3.46Å; V190-D194 PolarHBondContact O-N 3.46Å
191D94.7Very high95.9Very high81 Ų81102.9 Ų102.943%0.43349%0.489SS..Hα-helixtrans-57.2-39.8177.4-63.5-30.4000111.8K187 R188 D194 D195K187-D191 PolarHBondContact O-N 3.31Å; R188-D191 PolarHBondContact O-N 2.84Å; D191-D194 WeakPolarHBondContact O-CB 3.12Å; D191-D194 PolarHBondContact O-N 3.43Å; D191-D195 PolarHBondContact O-N 3.29Å; D191-D195 VanDerWaalsContact O-N 3.14Å
192V96.4Very high95.9Very high71 Ų71103.5 Ų103.543%0.4349%0.491SS..Hα-helixtrans-66.3-38.8175.1171.20000112.1R188 K189 V190 D195 Y196R188-V192 WeakPolarHBondContact O-CG2 3.33Å; R188-V192 PolarHBondContact O-N 3.28Å; K189-V192 PolarHBondContact O-N 2.96Å; V190-V192 PolarHBondContact O-N 3.4Å; V192-D195 PolarHBondContact O-N 2.92Å; V192-Y196 HydrophobicContact CG1-CD2 3.95Å; V192-Y196 HydrophobicContact CG1-CE2 3.47Å; V192-Y196 VanDerWaalsContact CG1-CE2 3.47Å; V192-Y196 WeakPolarHBondContact O-CD2 3.41Å; V192-Y196 PolarHBondContact O-N 3.45Å; V192-Y196 VanDerWaalsContact O-N 3.14Å
193L94.8Very high95.9Very high112 Ų112102.8 Ų102.859%0.58649%0.491SS*.Hα-helixtrans-66.2-39.2175.3-70.9174.4000111.6K189 V190 D195 Y196 E197K189-L193 WeakPolarHBondContact O-CG 3.44Å; K189-L193 PolarHBondContact O-N 3.22Å; K189-L193 VanDerWaalsContact O-N 3.1Å; V190-L193 WeakPolarHBondContact O-CA 3.48Å; V190-L193 WeakPolarHBondContact O-CB 3.43Å; V190-L193 PolarHBondContact O-N 3.46Å; L193-D195 VanDerWaalsContact C-N 3.28Å; L193-D195 PolarHBondContact O-N 3.11Å; L193-Y196 PolarHBondContact O-N 3.16Å; L193-E197 PolarHBondContact O-N 2.93Å
194D95.3Very high95.9Very high62 Ų62106.9 Ų106.933%0.33250%0.496SS..Hα-helixtrans-60.3-39.3175.2-78.3-1.4000111.4V190 D191 E197 R198V190-D194 PolarHBondContact O-N 3.46Å; D191-D194 WeakPolarHBondContact O-CB 3.12Å; D191-D194 PolarHBondContact O-N 3.43Å; D194-E197 PolarHBondContact O-N 3.04Å; D194-R198 VanDerWaalsContact O-CG 3.28Å; D194-R198 WeakPolarHBondContact O-CG 3.31Å; D194-R198 PolarHBondContact O-N 2.56Å
195D95.7Very high95.9Very high90 Ų90107.7 Ų107.748%0.48150%0.503SS..Hα-helixtrans-64.3-43.9174.7-75.9-22.4000112.2D191 V192 L193 E197 R198 Q199D191-D195 PolarHBondContact O-N 3.29Å; D191-D195 VanDerWaalsContact O-N 3.14Å; V192-D195 PolarHBondContact O-N 2.92Å; L193-D195 VanDerWaalsContact C-N 3.28Å; L193-D195 PolarHBondContact O-N 3.11Å; D195-E197 VanDerWaalsContact C-N 3.32Å; D195-E197 PolarHBondContact O-N 3.15Å; D195-R198 PolarHBondContact O-N 3.09Å; D195-R198 IonicContact OD1-CZ 3.32Å; D195-R198 IonicContact OD1-NH1 3.69Å; D195-R198 PolarHBondContact OD1-NH1 2.84Å; D195-Q199 PolarHBondContact O-N 3.18Å
196Y96.4Very high95.9Very high136 Ų136109.4 Ų109.453%0.53351%0.507SS..Hα-helixtrans-62.7-39.7173.4-72.1-52.7000111.9V192 L193 Q199 V200V192-Y196 HydrophobicContact CG1-CD2 3.95Å; V192-Y196 HydrophobicContact CG1-CE2 3.47Å; V192-Y196 VanDerWaalsContact CG1-CE2 3.47Å; V192-Y196 WeakPolarHBondContact O-CD2 3.41Å; V192-Y196 PolarHBondContact O-N 3.45Å; V192-Y196 VanDerWaalsContact O-N 3.14Å; L193-Y196 PolarHBondContact O-N 3.16Å; Y196-Q199 PolarHBondContact O-N 2.98Å; Y196-V200 WeakPolarHBondContact O-CG2 3.18Å; Y196-V200 PolarHBondContact O-N 2.83Å
197E96.4Very high95.8Very high99 Ų99106.7 Ų106.746%0.46351%0.505SS..Hα-helixtrans-64-42.3177.5-159.4-165.6130.800111.4L193 D194 D195 Q199 V200 R201L193-E197 PolarHBondContact O-N 2.93Å; D194-E197 PolarHBondContact O-N 3.04Å; D195-E197 VanDerWaalsContact C-N 3.32Å; D195-E197 PolarHBondContact O-N 3.15Å; E197-Q199 VanDerWaalsContact C-N 3.33Å; E197-Q199 PolarHBondContact O-N 2.93Å; E197-V200 PolarHBondContact O-N 2.9Å; E197-R201 WeakPolarHBondContact O-CG 3.04Å; E197-R201 PolarHBondContact O-N 3.47Å; E197-R201 IonicContact OE1-CZ 2.73Å; E197-R201 IonicContact OE1-NE 2.74Å; E197-R201 PolarHBondContact OE1-NE 3.29Å; E197-R201 IonicContact OE1-NH2 3.44Å; E197-R201 PolarHBondContact OE1-NH2 2.79Å
198R96.1Very high95.7Very high128 Ų128104.7 Ų104.748%0.48351%0.505SS..Hα-helixtrans-59.5-44172.7-70.1169-161.8150.85111.4D194 D195 V200 R201 L202D194-R198 VanDerWaalsContact O-CG 3.28Å; D194-R198 WeakPolarHBondContact O-CG 3.31Å; D194-R198 PolarHBondContact O-N 2.56Å; D195-R198 PolarHBondContact O-N 3.09Å; D195-R198 IonicContact OD1-CZ 3.32Å; D195-R198 IonicContact OD1-NH1 3.69Å; D195-R198 PolarHBondContact OD1-NH1 2.84Å; R198-V200 VanDerWaalsContact C-N 3.34Å; R198-V200 PolarHBondContact O-N 2.84Å; R198-R201 PolarHBondContact O-N 3.19Å; R198-L202 WeakPolarHBondContact O-CG 3.27Å; R198-L202 PolarHBondContact O-N 3.43Å
199Q95.9Very high95.7Very high108 Ų108103.4 Ų103.451%0.50550%0.504SS..Hα-helixtrans-62.8-41.1177.3-169.5177.619.300111.8D195 Y196 E197 R201 L202 L203D195-Q199 PolarHBondContact O-N 3.18Å; Y196-Q199 PolarHBondContact O-N 2.98Å; E197-Q199 VanDerWaalsContact C-N 3.33Å; E197-Q199 PolarHBondContact O-N 2.93Å; Q199-R201 VanDerWaalsContact C-N 3.34Å; Q199-R201 PolarHBondContact O-N 2.91Å; Q199-L202 PolarHBondContact O-N 3.01Å; Q199-L203 HydrophobicContact CG-CD1 4.26Å; Q199-L203 WeakPolarHBondContact O-CB 3.13Å; Q199-L203 WeakPolarHBondContact O-CG 3.23Å; Q199-L203 PolarHBondContact O-N 3Å
200V96.3Very high95.6Very high72 Ų72101.5 Ų101.544%0.43650%0.499SS..Hα-helixtrans-62.6-40.3175.1169.70000111.3Y196 E197 R198 L203 R204Y196-V200 WeakPolarHBondContact O-CG2 3.18Å; Y196-V200 PolarHBondContact O-N 2.83Å; E197-V200 PolarHBondContact O-N 2.9Å; R198-V200 VanDerWaalsContact C-N 3.34Å; R198-V200 PolarHBondContact O-N 2.84Å; V200-L203 PolarHBondContact O-N 3.1Å; V200-R204 WeakPolarHBondContact O-CB 3.41Å; V200-R204 WeakPolarHBondContact O-CG 3.31Å; V200-R204 PolarHBondContact O-N 2.92Å
201R95.9Very high95.4Very high128 Ų128101.9 Ų101.948%0.48350%0.502SS..Hα-helixtrans-61.9-48.5174.6-68.1-177.7-136.1159.32.3111.4E197 R198 Q199 L203 R204 D205E197-R201 WeakPolarHBondContact O-CG 3.04Å; E197-R201 PolarHBondContact O-N 3.47Å; E197-R201 IonicContact OE1-CZ 2.73Å; E197-R201 IonicContact OE1-NE 2.74Å; E197-R201 PolarHBondContact OE1-NE 3.29Å; E197-R201 IonicContact OE1-NH2 3.44Å; E197-R201 PolarHBondContact OE1-NH2 2.79Å; R198-R201 PolarHBondContact O-N 3.19Å; Q199-R201 VanDerWaalsContact C-N 3.34Å; Q199-R201 PolarHBondContact O-N 2.91Å; R201-L203 VanDerWaalsContact C-N 3.35Å; R201-L203 PolarHBondContact O-N 3.48Å; R201-R204 WeakPolarHBondContact O-CB 3.09Å; R201-R204 PolarHBondContact O-N 3.34Å; R201-R204 VanDerWaalsContact O-N 3.13Å; R201-D205 PolarHBondContact O-N 3.39Å
202L95.8Very high95.2Very high121 Ų121100.4 Ų100.463%0.63450%0.501SS*.Hα-helixtrans-59.3-44.2177.6-70.5174000112.4R198 Q199 R204 D205 E206R198-L202 WeakPolarHBondContact O-CG 3.27Å; R198-L202 PolarHBondContact O-N 3.43Å; Q199-L202 PolarHBondContact O-N 3.01Å; L202-R204 VanDerWaalsContact C-N 3.33Å; L202-R204 PolarHBondContact O-N 3.32Å; L202-D205 PolarHBondContact O-N 3.21Å; L202-E206 WeakPolarHBondContact O-CB 3.4Å; L202-E206 PolarHBondContact O-N 2.96Å
203L96.4Very high95Very high103 Ų103101.1 Ų101.154%0.53950%0.499SS..Hα-helixtrans-64.9-36.5176.6-72.7172000112.1Q199 V200 R201 E206 V207Q199-L203 HydrophobicContact CG-CD1 4.26Å; Q199-L203 WeakPolarHBondContact O-CB 3.13Å; Q199-L203 WeakPolarHBondContact O-CG 3.23Å; Q199-L203 PolarHBondContact O-N 3Å; V200-L203 PolarHBondContact O-N 3.1Å; R201-L203 VanDerWaalsContact C-N 3.35Å; R201-L203 PolarHBondContact O-N 3.48Å; L203-E206 PolarHBondContact O-N 2.52Å; L203-V207 WeakPolarHBondContact O-CB 3.49Å; L203-V207 VanDerWaalsContact O-CG2 3.23Å; L203-V207 WeakPolarHBondContact O-CG2 3.3Å; L203-V207 PolarHBondContact O-N 3.48Å
204R95.7Very high94.7Very high180 Ų180102.7 Ų102.768%0.67950%0.502SS*.Hα-helixtrans-64.4-43.3173.7-79.4178.1176.3-178.90.9111.7V200 R201 L202 V207 S208V200-R204 WeakPolarHBondContact O-CB 3.41Å; V200-R204 WeakPolarHBondContact O-CG 3.31Å; V200-R204 PolarHBondContact O-N 2.92Å; R201-R204 WeakPolarHBondContact O-CB 3.09Å; R201-R204 PolarHBondContact O-N 3.34Å; R201-R204 VanDerWaalsContact O-N 3.13Å; L202-R204 VanDerWaalsContact C-N 3.33Å; L202-R204 PolarHBondContact O-N 3.32Å; R204-V207 PolarHBondContact O-N 3.28Å; R204-S208 WeakPolarHBondContact O-CB 3.36Å; R204-S208 PolarHBondContact O-N 3.46Å
205D95.7Very high94.4Very high101 Ų101102.9 Ų102.954%0.5451%0.508SS..Hα-helixtrans-62.8-44.7177.4-66.4-18.6000110.3R201 L202 V207 S208 F209R201-D205 PolarHBondContact O-N 3.39Å; L202-D205 PolarHBondContact O-N 3.21Å; D205-V207 PolarHBondContact O-N 2.94Å; D205-S208 WeakPolarHBondContact O-CB 3.47Å; D205-S208 PolarHBondContact O-N 2.96Å; D205-S208 PolarHBondContact O-OG 3.43Å; D205-F209 PolarHBondContact O-N 3.22Å
206E95.6Very high93.9Very high98 Ų98103 Ų10346%0.45851%0.507SS..Hα-helixtrans-61.8-44.9175.8-172.862.5-162.600112.2L202 L203 S208 F209 L210L202-E206 WeakPolarHBondContact O-CB 3.4Å; L202-E206 PolarHBondContact O-N 2.96Å; L203-E206 PolarHBondContact O-N 2.52Å; E206-S208 VanDerWaalsContact C-N 3.29Å; E206-S208 PolarHBondContact O-N 3.3Å; E206-F209 WeakPolarHBondContact O-CB 3.42Å; E206-F209 PolarHBondContact O-N 3.11Å; E206-L210 HydrophobicContact CG-CD1 4.07Å; E206-L210 HydrophobicContact CG-CG 4.44Å; E206-L210 WeakPolarHBondContact O-CB 3.41Å; E206-L210 VanDerWaalsContact O-CG 3.31Å; E206-L210 WeakPolarHBondContact O-CG 3.43Å; E206-L210 PolarHBondContact O-N 3.44Å
207V94.4Very high93.3Very high88 Ų88100.8 Ų100.853%0.53350%0.503SS..Hα-helixtrans-61.2-40.6174.9168.20000110.8L203 R204 D205 F209 T211L203-V207 WeakPolarHBondContact O-CB 3.49Å; L203-V207 VanDerWaalsContact O-CG2 3.23Å; L203-V207 WeakPolarHBondContact O-CG2 3.3Å; L203-V207 PolarHBondContact O-N 3.48Å; R204-V207 PolarHBondContact O-N 3.28Å; D205-V207 PolarHBondContact O-N 2.94Å; V207-F209 VanDerWaalsContact C-N 3.34Å; V207-T211 VanDerWaalsContact O-CB 3.23Å; V207-T211 WeakPolarHBondContact O-CB 3.2Å; V207-T211 PolarHBondContact O-N 3.37Å; V207-T211 PolarHBondContact O-OG1 3.01Å
208S95Very high92.6Very high72 Ų72101.8 Ų101.850%0.50351%0.508SS..Hα-helixtrans-63.9-41.217781.50000111.7R204 D205 E206 T211 A212R204-S208 WeakPolarHBondContact O-CB 3.36Å; R204-S208 PolarHBondContact O-N 3.46Å; D205-S208 WeakPolarHBondContact O-CB 3.47Å; D205-S208 PolarHBondContact O-N 2.96Å; D205-S208 PolarHBondContact O-OG 3.43Å; E206-S208 VanDerWaalsContact C-N 3.29Å; E206-S208 PolarHBondContact O-N 3.3Å; S208-T211 PolarHBondContact O-N 3.01Å; S208-A212 WeakPolarHBondContact O-CB 3.49Å; S208-A212 PolarHBondContact O-N 2.97Å
209F94.9Very high91.6Very high122 Ų12299.5 Ų99.554%0.53550%0.503SS..Hα-helixtrans-64.1-51.7176.2178-94.6000111.6D205 E206 V207 T211 A212 E213D205-F209 PolarHBondContact O-N 3.22Å; E206-F209 WeakPolarHBondContact O-CB 3.42Å; E206-F209 PolarHBondContact O-N 3.11Å; V207-F209 VanDerWaalsContact C-N 3.34Å; F209-T211 VanDerWaalsContact C-N 3.25Å; F209-T211 PolarHBondContact O-N 3.17Å; F209-A212 WeakPolarHBondContact O-CB 3.26Å; F209-A212 PolarHBondContact O-N 3.3Å; F209-A212 VanDerWaalsContact O-N 3.12Å; F209-E213 PolarHBondContact O-N 3.08Å
210L93.4Very high90.4Very high83 Ų83101.5 Ų101.544%0.43551%0.506SS..Hα-helixtrans-60.9-35.6177.3-69.9172.9000111.8E206 K214E206-L210 HydrophobicContact CG-CD1 4.07Å; E206-L210 HydrophobicContact CG-CG 4.44Å; E206-L210 WeakPolarHBondContact O-CB 3.41Å; E206-L210 VanDerWaalsContact O-CG 3.31Å; E206-L210 WeakPolarHBondContact O-CG 3.43Å; E206-L210 PolarHBondContact O-N 3.44Å; L210-K214 WeakPolarHBondContact O-CB 3.13Å; L210-K214 PolarHBondContact O-N 3.12Å
211T93.1Very high88.8Confident84 Ų84104.5 Ų104.552%0.51552%0.519SS..Hα-helixtrans-67.5-43175.4-58.30000111.1V207 S208 F209 K214 S215V207-T211 VanDerWaalsContact O-CB 3.23Å; V207-T211 WeakPolarHBondContact O-CB 3.2Å; V207-T211 PolarHBondContact O-N 3.37Å; V207-T211 PolarHBondContact O-OG1 3.01Å; S208-T211 PolarHBondContact O-N 3.01Å; F209-T211 VanDerWaalsContact C-N 3.25Å; F209-T211 PolarHBondContact O-N 3.17Å; T211-K214 PolarHBondContact O-N 2.98Å; T211-S215 PolarHBondContact O-N 3.28Å
212A90.6Very high87.3Confident50 Ų50104.4 Ų104.441%0.41353%0.532SS..Hα-helixtrans-63.6-45.1174.500000111.4S208 F209 K214 S215 M216S208-A212 WeakPolarHBondContact O-CB 3.49Å; S208-A212 PolarHBondContact O-N 2.97Å; F209-A212 WeakPolarHBondContact O-CB 3.26Å; F209-A212 PolarHBondContact O-N 3.3Å; F209-A212 VanDerWaalsContact O-N 3.12Å; A212-K214 PolarHBondContact O-N 2.86Å; A212-S215 PolarHBondContact O-N 3.27Å; A212-S215 VanDerWaalsContact O-N 3.16Å; A212-S215 PolarHBondContact O-OG 2.83Å; A212-M216 WeakPolarHBondContact O-CG 3.28Å; A212-M216 PolarHBondContact O-N 3.35Å
213E90.9Very high85.2Confident86 Ų86106.7 Ų106.740%0.40253%0.532SS..Hα-helixtrans-61.6-45.7176.5-174.2177.3-157.900111.5F209 S215 M216 L217F209-E213 PolarHBondContact O-N 3.08Å; E213-S215 VanDerWaalsContact C-N 3.29Å; E213-S215 PolarHBondContact O-N 3.46Å; E213-M216 PolarHBondContact O-N 3.02Å; E213-M216 VanDerWaalsContact O-N 3.15Å; E213-L217 HydrophobicContact CG-CD1 4.1Å; E213-L217 HydrophobicContact CG-CG 4.35Å; E213-L217 WeakPolarHBondContact O-CB 3.31Å; E213-L217 WeakPolarHBondContact O-CG 3.25Å; E213-L217 PolarHBondContact O-N 3.46Å
214K89.1Confident82.7Confident145 Ų145105.9 Ų105.963%0.6354%0.536SS*.Hα-helixtrans-55.8-44.8173-179-179.2177.4-179.40111.2L210 T211 A212 L217 Q218L210-K214 WeakPolarHBondContact O-CB 3.13Å; L210-K214 PolarHBondContact O-N 3.12Å; T211-K214 PolarHBondContact O-N 2.98Å; A212-K214 PolarHBondContact O-N 2.86Å; K214-L217 PolarHBondContact O-N 3.37Å; K214-Q218 VanDerWaalsContact O-CB 3.24Å; K214-Q218 WeakPolarHBondContact O-CB 3.44Å; K214-Q218 PolarHBondContact O-N 2.88Å
215S88.8Confident80Confident66 Ų66103 Ų10346%0.46254%0.542SS..Hα-helixtrans-63.8-40.6177.5780000112.3T211 A212 E213 Q218 E219T211-S215 PolarHBondContact O-N 3.28Å; A212-S215 PolarHBondContact O-N 3.27Å; A212-S215 VanDerWaalsContact O-N 3.16Å; A212-S215 PolarHBondContact O-OG 2.83Å; E213-S215 VanDerWaalsContact C-N 3.29Å; E213-S215 PolarHBondContact O-N 3.46Å; S215-Q218 PolarHBondContact O-N 3.25Å; S215-E219 WeakPolarHBondContact O-CB 3.38Å; S215-E219 PolarHBondContact O-N 3.3Å
216M84.6Confident77Confident94 Ų94104 Ų10446%0.46356%0.556SS.*Hα-helixtrans-66.4-42175.5-71.9-155.884.900112.4A212 E213 Q218 E219 R220A212-M216 WeakPolarHBondContact O-CG 3.28Å; A212-M216 PolarHBondContact O-N 3.35Å; E213-M216 PolarHBondContact O-N 3.02Å; E213-M216 VanDerWaalsContact O-N 3.15Å; M216-Q218 VanDerWaalsContact C-N 3.33Å; M216-E219 PolarHBondContact O-N 2.93Å; M216-R220 WeakPolarHBondContact O-CB 3.5Å; M216-R220 VanDerWaalsContact O-CG 3.25Å; M216-R220 WeakPolarHBondContact O-CG 3.25Å; M216-R220 PolarHBondContact O-N 3.44Å
217L84.8Confident74.6Confident88 Ų88104.7 Ų104.746%0.46157%0.569SS.*Hα-helixtrans-66.1-39177.1-71.1175.2000110.9E213 K214 R220 L221E213-L217 HydrophobicContact CG-CD1 4.1Å; E213-L217 HydrophobicContact CG-CG 4.35Å; E213-L217 WeakPolarHBondContact O-CB 3.31Å; E213-L217 WeakPolarHBondContact O-CG 3.25Å; E213-L217 PolarHBondContact O-N 3.46Å; K214-L217 PolarHBondContact O-N 3.37Å; L217-R220 PolarHBondContact O-N 3.43Å; L217-L221 WeakPolarHBondContact O-CB 3.33Å; L217-L221 PolarHBondContact O-N 3.06Å
218Q82.2Confident71.8Confident120 Ų120105.7 Ų105.756%0.56158%0.58SS**Hα-helixtrans-65.5-40.5173.9-167.6167.1-600111.4K214 S215 M216 L221 V222K214-Q218 VanDerWaalsContact O-CB 3.24Å; K214-Q218 WeakPolarHBondContact O-CB 3.44Å; K214-Q218 PolarHBondContact O-N 2.88Å; S215-Q218 PolarHBondContact O-N 3.25Å; M216-Q218 VanDerWaalsContact C-N 3.33Å; Q218-L221 PolarHBondContact O-N 3.04Å; Q218-V222 VanDerWaalsContact O-CG2 3.29Å; Q218-V222 WeakPolarHBondContact O-CG2 3.4Å; Q218-V222 PolarHBondContact O-N 3.45Å
219E74.4Confident69.7Low81 Ų81108.2 Ų108.238%0.37960%0.595SS.*Hα-helixtrans-66-37.8173.5-167.6-179-164.900112.2S215 M216 V222 R223S215-E219 WeakPolarHBondContact O-CB 3.38Å; S215-E219 PolarHBondContact O-N 3.3Å; M216-E219 PolarHBondContact O-N 2.93Å; E219-V222 PolarHBondContact O-N 3.06Å; E219-R223 VanDerWaalsContact O-CB 3.3Å; E219-R223 WeakPolarHBondContact O-CB 3.29Å; E219-R223 WeakPolarHBondContact O-CG 3.03Å; E219-R223 PolarHBondContact O-N 3.3Å; E219-R223 IonicContact OE1-CZ 3.78Å; E219-R223 IonicContact OE1-NH1 2.95Å; E219-R223 PolarHBondContact OE1-NH1 3.05Å; E219-R223 IonicContact OE1-NH2 2.69Å; E219-R223 PolarHBondContact OE1-NH2 3.18Å; E219-R223 IonicContact OE2-NH1 3.45Å
220R70.7Confident67.3Low150 Ų150109.9 Ų109.957%0.56661%0.608SS**Hα-helixtrans-66.8-37173.3-74.5179.1-144.81737.4112.5M216 L217 V222 R223 S224M216-R220 WeakPolarHBondContact O-CB 3.5Å; M216-R220 VanDerWaalsContact O-CG 3.25Å; M216-R220 WeakPolarHBondContact O-CG 3.25Å; M216-R220 PolarHBondContact O-N 3.44Å; L217-R220 PolarHBondContact O-N 3.43Å; R220-V222 VanDerWaalsContact C-N 3.31Å; R220-R223 CarbonylContact O-C 3.59Å; R220-R223 PolarHBondContact O-N 3.23Å; R220-S224 PolarHBondContact O-N 3.14Å
221L63.6Low65.2Low135 Ų135111.1 Ų111.171%0.70762%0.621SS**Hα-helixtrans-66.8-34174.8-167.172.9000111.5L217 Q218 S224L217-L221 WeakPolarHBondContact O-CB 3.33Å; L217-L221 PolarHBondContact O-N 3.06Å; Q218-L221 PolarHBondContact O-N 3.04Å; L221-S224 PolarHBondContact O-OG 3.02Å; L221-S224 VanDerWaalsContact O-OG 3.09Å
222V62.8Low62.4Low125 Ų125117.1 Ų117.176%0.75864%0.635SS**Hα-helixtrans-75.8-25.9173176.80000111.6Q218 E219 R220Q218-V222 VanDerWaalsContact O-CG2 3.29Å; Q218-V222 WeakPolarHBondContact O-CG2 3.4Å; Q218-V222 PolarHBondContact O-N 3.45Å; E219-V222 PolarHBondContact O-N 3.06Å; R220-V222 VanDerWaalsContact C-N 3.31Å
223R53.1Low59.9Low169 Ų169122.4 Ų122.464%0.63865%0.651SS**SBendtrans-97.56.3-179.2-73.8-175.1176.8143.311.3115.4E219 R220 C225E219-R223 VanDerWaalsContact O-CB 3.3Å; E219-R223 WeakPolarHBondContact O-CB 3.29Å; E219-R223 WeakPolarHBondContact O-CG 3.03Å; E219-R223 PolarHBondContact O-N 3.3Å; E219-R223 IonicContact OE1-CZ 3.78Å; E219-R223 IonicContact OE1-NH1 2.95Å; E219-R223 PolarHBondContact OE1-NH1 3.05Å; E219-R223 IonicContact OE1-NH2 2.69Å; E219-R223 PolarHBondContact OE1-NH2 3.18Å; E219-R223 IonicContact OE2-NH1 3.45Å; R220-R223 CarbonylContact O-C 3.59Å; R220-R223 PolarHBondContact O-N 3.23Å; R223-C225 PolarHBondContact O-N 2.83Å
224S43.1Very low57.2Low87 Ų87123.9 Ų123.961%0.60867%0.671SS**  trans-7571.2173.852.30000111.9R220 L221R220-S224 PolarHBondContact O-N 3.14Å; L221-S224 PolarHBondContact O-OG 3.02Å; L221-S224 VanDerWaalsContact O-OG 3.09Å
225C38.4Very low55Low120 Ų120128.7 Ų128.781%0.81169%0.685SS**SBendtrans-136.798152.9-83.50000107.2R223R223-C225 PolarHBondContact O-N 2.83Å
226S32.8Very low52.7Low121 Ų121131.4 Ų131.485%0.84670%0.701SS**SBendtrans76.7154.8162.6-68.70000120.1
227P45.7Very low50.5Low113 Ų113132.7 Ų132.773%0.73472%0.719SS**  trans-109.8148.9-138.439-31.1000115.8
228S36.7Very low48.3Very low109 Ų109133.6 Ų133.676%0.76273%0.733SS**  trans30.4144.8148.357.50000120.8
229P49.8Very low46.6Very low124 Ų124133.8 Ų133.881%0.80574%0.744SS**  cis-147.9168.14935.5-12.4000118.4
230L44.3Very low45.1Very low157 Ų157138.1 Ų138.182%0.82277%0.769SS**  trans-48.5159.2160.2-76.9165.6000112.1
231P49.9Very low43.8Very low109 Ų109140.8 Ų140.871%0.70879%0.785SS**  -159.8-178.857.240.8-17.2000119.1
232R34.8Very low42.6Very low210 Ų210139.5 Ų139.579%0.79279%0.787SS**  trans104.6111.4148.8-75.4-177.8179.8-147.12.1119.8
233Q38.2Very low42.2Very low162 Ų162141.1 Ų141.176%0.75779%0.787SS**  69.6105.4110.2-156.1171.43000118.1
234S33.3Very low42.4Very low117 Ų117137.8 Ų137.882%0.81879%0.789SS**  trans-164.5117.6134.95.50000110.6
235R43.3Very low43.6Very low246 Ų246137 Ų13793%0.92878%0.782SS**PPolyproline II helixtrans-70.2136.9159.4-80.9176.1167.2-168.4-4.3108.2
236P40.3Very low45.2Very low123 Ų123131.7 Ų131.780%0.79975%0.746SS**PPolyproline II helixtrans-86.8132.215313.33.7000109.5
237S38.9Very low47.1Very low121 Ų121133.6 Ų133.685%0.84673%0.734SS**PPolyproline II helixtrans-56.1130.8166.2-66.90000110.6
238S37.9Very low48.4Very low106 Ų106128.4 Ų128.474%0.74170%0.701SS**PPolyproline II helixtrans-65.3141.2168.9500000110.8
239P46.7Very low50.5Low124 Ų124126.8 Ų126.881%0.80568%0.682SS**PPolyproline II helixtrans-64.8149.3173.7-12.426.9000111.2
240L43.7Very low51.9Low173 Ų173126.9 Ų126.991%0.90668%0.675SS**PPolyproline II helixtrans-48135.5172.5-70.1154.2000111.1S242L240-S242 PolarHBondContact O-N 3.25Å
241K41.9Very low53.9Low206 Ų206121.3 Ų121.390%0.89665%0.647SS**PPolyproline II helixtrans-47.1118.6176.3-73.8172.4171.8176.60110.8E243K241-E243 PolarHBondContact O-N 2.86Å
242S38.7Very low55.7Low108 Ų108117.2 Ų117.276%0.75562%0.62SS**  trans-70.3114.4157.960.80000107.7L240 S244L240-S242 PolarHBondContact O-N 3.25Å; S242-S244 PolarHBondContact O-N 2.71Å
243E54Low58.3Low159 Ų159111.8 Ų111.874%0.74361%0.614SS**PPolyproline II helixtrans-60122.6164.7-86.2163.4158.100108.3K241K241-E243 PolarHBondContact O-N 2.86Å
244S57.4Low60.8Low98 Ų98106.6 Ų106.669%0.68560%0.595SS**PPolyproline II helixtrans-65128.9175.4-58.50000108.6S242 T246S242-S244 PolarHBondContact O-N 2.71Å; S244-T246 PolarHBondContact O-N 3.15Å
245P69.3Low63.7Low71 Ų71102 Ų10246%0.46156%0.56SS.*PPolyproline II helixtrans-63.1136.7-178.121.6-30.9000111.8Q249 L250P245-Q249 HydrophobicContact CB-CB 4.3Å; P245-Q249 VanDerWaalsContact CB-OE1 3.26Å; P245-L250 HydrophobicContact CB-CD2 4.42Å; P245-L250 HydrophobicContact CG-CD2 3.95Å; P245-L250 HydrophobicContact CG-CG 4.42Å
246T72.3Confident66.2Low9 Ų992.2 Ų92.26%0.05553%0.525CS..PPolyproline II helixtrans-63.9155.2178.7-45.90000110.5S244 A248 Q249 L250 E326 D334S244-T246 PolarHBondContact O-N 3.15Å; T246-A248 VanDerWaalsContact C-N 3.26Å; T246-A248 PolarHBondContact O-N 3.49Å; T246-Q249 VanDerWaalsContact N-OE1 3.08Å; T246-Q249 WeakPolarHBondContact O-CB 3.22Å; T246-Q249 PolarHBondContact O-N 3.43Å; T246-L250 PolarHBondContact O-N 3.44Å; T246-L250 VanDerWaalsContact O-N 3.08Å; T246-E326 WeakPolarHBondContact CG2-OE2 3.4Å; T246-E326 PolarHBondContact OG1-OE2 3.38Å; T246-D334 HydrophobicContact CG2-CB 3.75Å
247R71.8Confident68.8Low160 Ų16089.3 Ų89.360%0.60451%0.511SS*.Hα-helixtrans-57.8-36.7180-176.7-178.5178.587.9-0.3112.8Q249 L250 T251R247-Q249 VanDerWaalsContact C-N 3.31Å; R247-Q249 PolarHBondContact O-N 2.9Å; R247-L250 PolarHBondContact O-N 3.42Å; R247-T251 PolarHBondContact O-N 3.02Å; R247-T251 VanDerWaalsContact O-N 3.15Å; R247-T251 PolarHBondContact O-OG1 2.9Å
248A73.8Confident71.5Confident5 Ų590.2 Ų90.24%0.04150%0.496CS..Hα-helixtrans-53.7-46.3171.500000112.2T246 T251 N252 V333 D334 V337T246-A248 VanDerWaalsContact C-N 3.26Å; T246-A248 PolarHBondContact O-N 3.49Å; A248-T251 PolarHBondContact O-N 3.38Å; A248-T251 PolarHBondContact O-OG1 2.81Å; A248-N252 WeakPolarHBondContact O-CB 3.25Å; A248-N252 PolarHBondContact O-N 3.27Å; A248-V333 HydrophobicContact CB-CG1 4.33Å; A248-D334 HydrophobicContact CB-CB 4.44Å; A248-D334 PolarHBondContact N-OD1 3.04Å; A248-V337 HydrophobicContact CB-CG2 4.32Å
249Q79.3Confident74.3Confident75 Ų7586.1 Ų86.135%0.3547%0.465SS..Hα-helixtrans-66.2-43.6179-62.9172-14.600111.5P245 T246 R247 T251 N252P245-Q249 HydrophobicContact CB-CB 4.3Å; P245-Q249 VanDerWaalsContact CB-OE1 3.26Å; T246-Q249 VanDerWaalsContact N-OE1 3.08Å; T246-Q249 WeakPolarHBondContact O-CB 3.22Å; T246-Q249 PolarHBondContact O-N 3.43Å; R247-Q249 VanDerWaalsContact C-N 3.31Å; R247-Q249 PolarHBondContact O-N 2.9Å; Q249-T251 PolarHBondContact O-N 3.2Å; Q249-N252 WeakPolarHBondContact O-CB 3.4Å; Q249-N252 PolarHBondContact O-N 3.06Å
250L80Confident76.7Confident126 Ų12681.4 Ų81.466%0.6643%0.434SS*.Hα-helixtrans-60.7-30.9178.5-70.6174.7000113.3P245 T246 R247P245-L250 HydrophobicContact CB-CD2 4.42Å; P245-L250 HydrophobicContact CG-CD2 3.95Å; P245-L250 HydrophobicContact CG-CG 4.42Å; T246-L250 PolarHBondContact O-N 3.44Å; T246-L250 VanDerWaalsContact O-N 3.08Å; R247-L250 PolarHBondContact O-N 3.42Å
251T85.6Confident79.3Confident40 Ų4076.1 Ų76.125%0.24541%0.412CS..Hα-helixtrans-96.8-8.6-179.561.30000113.6R247 A248 Q249 S253 S254 R255R247-T251 PolarHBondContact O-N 3.02Å; R247-T251 VanDerWaalsContact O-N 3.15Å; R247-T251 PolarHBondContact O-OG1 2.9Å; A248-T251 PolarHBondContact O-N 3.38Å; A248-T251 PolarHBondContact O-OG1 2.81Å; Q249-T251 PolarHBondContact O-N 3.2Å; T251-S253 PolarHBondContact O-N 3.48Å; T251-S254 PolarHBondContact O-N 3.43Å; T251-S254 PolarHBondContact O-OG 2.76Å; T251-R255 WeakPolarHBondContact O-CG 3.31Å; T251-R255 PolarHBondContact O-N 2.91Å
252N88.8Confident81.9Confident23 Ų2370.4 Ų70.412%0.12339%0.385CS..Hα-helixtrans-58-51.4-169.1-175.130.8000112.5A248 Q249 S254 R255 H256 L390 D391A248-N252 WeakPolarHBondContact O-CB 3.25Å; A248-N252 PolarHBondContact O-N 3.27Å; Q249-N252 WeakPolarHBondContact O-CB 3.4Å; Q249-N252 PolarHBondContact O-N 3.06Å; N252-S254 VanDerWaalsContact C-N 3.3Å; N252-S254 PolarHBondContact O-N 2.86Å; N252-R255 WeakPolarHBondContact O-CB 3.26Å; N252-R255 PolarHBondContact O-N 2.84Å; N252-H256 WeakPolarHBondContact O-CB 3.22Å; N252-H256 PolarHBondContact O-N 3.38Å; N252-L390 WeakPolarHBondContact OD1-CD2 3.49Å; N252-D391 VanDerWaalsContact ND2-CB 3.31Å; N252-D391 WeakPolarHBondContact ND2-CB 3.39Å; N252-D391 PolarHBondContact ND2-OD2 3.47Å
253S89.1Confident84.7Confident96 Ų9665.2 Ų65.267%0.67135%0.349SS*.Hα-helixtrans-58.5-40.4-179.7-47.30000112.8T251 A257T251-S253 PolarHBondContact O-N 3.48Å; S253-A257 PolarHBondContact O-N 3.29Å; S253-A257 VanDerWaalsContact O-N 3.08Å
254S91.8Very high86.8Confident52 Ų5259.9 Ų59.936%0.36433%0.329SS..Hα-helixtrans-68.4-36.8177.881.30000112.1T251 N252 R258T251-S254 PolarHBondContact O-N 3.43Å; T251-S254 PolarHBondContact O-OG 2.76Å; N252-S254 VanDerWaalsContact C-N 3.3Å; N252-S254 PolarHBondContact O-N 2.86Å; S254-R258 WeakPolarHBondContact O-CG 3.49Å; S254-R258 PolarHBondContact O-N 3.47Å; S254-R258 VanDerWaalsContact O-N 3.12Å; S254-R258 PolarHBondContact O-NH1 3.29Å; S254-R258 PolarHBondContact OG-NH1 3.28Å; S254-R258 VanDerWaalsContact OG-NH1 3.09Å
255R93.4Very high88.6Confident20 Ų2057.8 Ų57.88%0.07531%0.31CS..Hα-helixtrans-71-44.1178-71.4173.961.1-140-8.8110.7T251 N252 R258 L259 V337 T389 L390T251-R255 WeakPolarHBondContact O-CG 3.31Å; T251-R255 PolarHBondContact O-N 2.91Å; N252-R255 WeakPolarHBondContact O-CB 3.26Å; N252-R255 PolarHBondContact O-N 2.84Å; R255-R258 VanDerWaalsContact CG-NH2 3.33Å; R255-R258 PolarHBondContact O-N 3.37Å; R255-L259 WeakPolarHBondContact O-CB 3.34Å; R255-L259 VanDerWaalsContact O-CG 3.3Å; R255-L259 WeakPolarHBondContact O-CG 3.39Å; R255-L259 PolarHBondContact O-N 2.66Å; R255-V337 VanDerWaalsContact NH1-CG1 3.27Å; R255-T389 PolarHBondContact NH1-O 3.45Å; R255-T389 PolarHBondContact NH2-OG1 3.28Å; R255-L390 HydrophobicContact CB-CD2 3.97Å
256H95.3Very high90Very high42 Ų4254.4 Ų54.419%0.19429%0.288CS..Hα-helixtrans-53.6-54.8174.1179.1-79.5000110.6N252 R258 L259 V260 L390 E433N252-H256 WeakPolarHBondContact O-CB 3.22Å; N252-H256 PolarHBondContact O-N 3.38Å; H256-R258 VanDerWaalsContact C-N 3.35Å; H256-R258 PolarHBondContact O-N 2.94Å; H256-L259 PolarHBondContact O-N 3.49Å; H256-V260 WeakPolarHBondContact O-CG2 3.39Å; H256-V260 PolarHBondContact O-N 3.05Å; H256-L390 HydrophobicContact CB-CD1 4.34Å; H256-L390 HydrophobicContact CB-CD2 4.2Å; H256-E433 IonicContact NE2-OE1 3.29Å; H256-E433 IonicContact NE2-OE2 3.68Å
257A94.6Very high91.1Very high61 Ų6157.5 Ų57.550%0.50430%0.299SS..Hα-helixtrans-58.6-42.9178.500000112.9S253 S261S253-A257 PolarHBondContact O-N 3.29Å; S253-A257 VanDerWaalsContact O-N 3.08Å; A257-S261 PolarHBondContact O-N 3.12Å
258R95.9Very high92.3Very high140 Ų14052.4 Ų52.453%0.52829%0.291SS..Hα-helixtrans-64.2-41.1176.4-75-167.8-57.4-88.13.2112.6S254 R255 H256 S261 R262S254-R258 WeakPolarHBondContact O-CG 3.49Å; S254-R258 PolarHBondContact O-N 3.47Å; S254-R258 VanDerWaalsContact O-N 3.12Å; S254-R258 PolarHBondContact O-NH1 3.29Å; S254-R258 PolarHBondContact OG-NH1 3.28Å; S254-R258 VanDerWaalsContact OG-NH1 3.09Å; R255-R258 VanDerWaalsContact CG-NH2 3.33Å; R255-R258 PolarHBondContact O-N 3.37Å; H256-R258 VanDerWaalsContact C-N 3.35Å; H256-R258 PolarHBondContact O-N 2.94Å; R258-S261 WeakPolarHBondContact O-CB 3.46Å; R258-S261 PolarHBondContact O-N 3.29Å; R258-R262 WeakPolarHBondContact O-CG 3.15Å; R258-R262 PolarHBondContact O-N 2.93Å
259L97Very high93.3Very high20 Ų2055.6 Ų55.611%0.10531%0.31CS..Hα-helixtrans-69.8-38.7-179.7-72.7167.8000112.1R255 H256 S261 R262 F263 V383 A386 M387 L390R255-L259 WeakPolarHBondContact O-CB 3.34Å; R255-L259 VanDerWaalsContact O-CG 3.3Å; R255-L259 WeakPolarHBondContact O-CG 3.39Å; R255-L259 PolarHBondContact O-N 2.66Å; H256-L259 PolarHBondContact O-N 3.49Å; L259-S261 VanDerWaalsContact C-N 3.32Å; L259-S261 PolarHBondContact O-N 3.49Å; L259-R262 PolarHBondContact O-N 3.39Å; L259-F263 WeakPolarHBondContact O-CB 3.31Å; L259-F263 PolarHBondContact O-N 3.24Å; L259-V383 HydrophobicContact CD2-CG1 4.43Å; L259-A386 HydrophobicContact CD1-CB 4.17Å; L259-A386 HydrophobicContact CD2-CB 3.66Å; L259-M387 HydrophobicContact CB-CE 4.27Å; L259-M387 HydrophobicContact CB-CG 4.11Å; L259-M387 HydrophobicContact CD1-CG 4.21Å; L259-M387 HydrophobicContact CD2-CG 4.45Å; L259-M387 HydrophobicContact CG-CG 4.49Å; L259-M387 WeakPolarHBondContact O-CE 3.32Å; L259-L390 HydrophobicContact CD1-CD1 3.9Å; L259-L390 HydrophobicContact CD1-CD2 3.98Å; L259-L390 HydrophobicContact CD1-CG 4.02Å
260V97.4Very high94.2Very high25 Ų2553.6 Ų53.615%0.15230%0.301CS..Hα-helixtrans-61.8-41.9172.11730000110.9H256 F263 S264 L394 L431 I438 V439H256-V260 WeakPolarHBondContact O-CG2 3.39Å; H256-V260 PolarHBondContact O-N 3.05Å; V260-F263 PolarHBondContact O-N 3.43Å; V260-S264 PolarHBondContact O-N 3.21Å; V260-S264 VanDerWaalsContact O-N 3.11Å; V260-S264 PolarHBondContact O-OG 3.1Å; V260-L394 HydrophobicContact CG2-CD1 3.78Å; V260-L431 HydrophobicContact CG2-CD2 4.3Å; V260-I438 HydrophobicContact CG1-CG2 4.1Å; V260-I438 HydrophobicContact CG2-CG2 3.98Å; V260-V439 HydrophobicContact CG1-CG2 3.73Å
261S97.1Very high94.9Very high63 Ų6348.6 Ų48.644%0.44127%0.273SS..Hα-helixtrans-62.4-48.4173.5-168.80000111.4A257 R258 L259 F263 S264 D265A257-S261 PolarHBondContact O-N 3.12Å; R258-S261 WeakPolarHBondContact O-CB 3.46Å; R258-S261 PolarHBondContact O-N 3.29Å; L259-S261 VanDerWaalsContact C-N 3.32Å; L259-S261 PolarHBondContact O-N 3.49Å; S261-F263 VanDerWaalsContact C-N 3.29Å; S261-F263 PolarHBondContact O-N 3.12Å; S261-S264 CarbonylContact O-C 3.56Å; S261-S264 WeakPolarHBondContact O-CA 3.36Å; S261-S264 WeakPolarHBondContact O-CB 3.42Å; S261-S264 PolarHBondContact O-N 2.94Å; S261-D265 PolarHBondContact O-N 3.41Å
262R97.4Very high95.4Very high85 Ų8550.7 Ų50.732%0.32128%0.282SS..Hα-helixtrans-62.2-34.6178.9-72.2-60.4-64145.10.1112.7R258 L259 S264 D265 L266 E270 E379 V383R258-R262 WeakPolarHBondContact O-CG 3.15Å; R258-R262 PolarHBondContact O-N 2.93Å; L259-R262 PolarHBondContact O-N 3.39Å; R262-S264 VanDerWaalsContact C-N 3.31Å; R262-D265 IonicContact CZ-OD2 3.94Å; R262-D265 IonicContact NH1-OD2 3.14Å; R262-D265 PolarHBondContact NH1-OD2 2.84Å; R262-D265 WeakPolarHBondContact O-CB 3.3Å; R262-D265 PolarHBondContact O-N 2.87Å; R262-L266 WeakPolarHBondContact O-CG 3.45Å; R262-L266 PolarHBondContact O-N 3.03Å; R262-E270 IonicContact CZ-OE1 3.57Å; R262-E270 IonicContact NH1-OE1 3.86Å; R262-E270 IonicContact NH2-OE1 2.96Å; R262-E270 PolarHBondContact NH2-OE1 2.92Å; R262-E270 VanDerWaalsContact NH2-OE1 3.07Å; R262-E379 IonicContact NH2-OE1 3.92Å; R262-E379 PolarHBondContact NH2-OE1 2.91Å; R262-V383 HydrophobicContact CB-CG2 4.35Å
263F97.8Very high95.8Very high0 Ų055 Ų550%030%0.302CS..Hα-helixtrans-65.5-36.5172.2-175.2-100.3000112.8L259 V260 S261 L266 Y267 F300 M387 L396 W428 P429 L431 V439L259-F263 WeakPolarHBondContact O-CB 3.31Å; L259-F263 PolarHBondContact O-N 3.24Å; V260-F263 PolarHBondContact O-N 3.43Å; S261-F263 VanDerWaalsContact C-N 3.29Å; S261-F263 PolarHBondContact O-N 3.12Å; F263-L266 PolarHBondContact O-N 3.02Å; F263-Y267 PolarHBondContact O-N 3.39Å; F263-F300 HydrophobicContact CD2-CE2 4.3Å; F263-F300 AromaticContact CD2-CZ 3.91Å; F263-F300 HydrophobicContact CD2-CZ 3.91Å; F263-F300 AromaticContact CE2-CE2 3.93Å; F263-F300 HydrophobicContact CE2-CE2 3.93Å; F263-F300 AromaticContact CE2-CZ 3.74Å; F263-F300 HydrophobicContact CE2-CZ 3.74Å; F263-M387 HydrophobicContact CB-CE 3.58Å; F263-M387 HydrophobicContact CD2-CE 4.06Å; F263-M387 HydrophobicContact CG-CE 4.04Å; F263-L396 HydrophobicContact CE2-CD2 3.96Å; F263-L396 HydrophobicContact CZ-CD2 3.96Å; F263-W428 HydrophobicContact CD2-CZ2 4.31Å; F263-W428 HydrophobicContact CE1-CZ2 4.4Å; F263-W428 AromaticContact CE1-NE1 3.19Å; F263-W428 AromaticContact CE2-CZ2 3.85Å; F263-W428 HydrophobicContact CE2-CZ2 3.85Å; F263-W428 AromaticContact CZ-CE2 3.75Å; F263-W428 AromaticContact CZ-CZ2 3.91Å; F263-W428 HydrophobicContact CZ-CZ2 3.91Å; F263-W428 AromaticContact CZ-NE1 3.21Å; F263-P429 HydrophobicContact CZ-CG 4.36Å; F263-L431 HydrophobicContact CB-CD2 4.37Å; F263-L431 HydrophobicContact CD1-CB 4.06Å; F263-L431 HydrophobicContact CD1-CD1 4.48Å; F263-L431 HydrophobicContact CD1-CD2 3.95Å; F263-L431 HydrophobicContact CD1-CG 4.41Å; F263-L431 HydrophobicContact CD2-CD1 4.31Å; F263-L431 HydrophobicContact CE1-CB 3.74Å; F263-L431 HydrophobicContact CE1-CD1 4.41Å; F263-L431 HydrophobicContact CE1-CD2 4.46Å; F263-L431 HydrophobicContact CE1-CG 4.44Å; F263-L431 HydrophobicContact CE2-CD1 4.24Å; F263-L431 HydrophobicContact CG-CD1 4.42Å; F263-L431 HydrophobicContact CG-CD2 4.11Å; F263-L431 HydrophobicContact CZ-CB 4.22Å; F263-L431 HydrophobicContact CZ-CD1 4.28Å; F263-V439 HydrophobicContact CD1-CB 4.38Å; F263-V439 HydrophobicContact CD1-CG1 4.36Å; F263-V439 HydrophobicContact CD1-CG2 4.47Å; F263-V439 HydrophobicContact CE1-CB 4.43Å; F263-V439 HydrophobicContact CE1-CG1 4.38Å
264S96.9Very high96.1Very high46 Ų4650.8 Ų50.832%0.32227%0.272SS..Hα-helixtrans-68.9-36.8174.2-54.10000111.2V260 S261 R262 Y267 A268V260-S264 PolarHBondContact O-N 3.21Å; V260-S264 VanDerWaalsContact O-N 3.11Å; V260-S264 PolarHBondContact O-OG 3.1Å; S261-S264 CarbonylContact O-C 3.56Å; S261-S264 WeakPolarHBondContact O-CA 3.36Å; S261-S264 WeakPolarHBondContact O-CB 3.42Å; S261-S264 PolarHBondContact O-N 2.94Å; R262-S264 VanDerWaalsContact C-N 3.31Å; S264-Y267 WeakPolarHBondContact O-CB 3.46Å; S264-Y267 PolarHBondContact O-N 2.96Å; S264-A268 WeakPolarHBondContact O-CB 3.44Å; S264-A268 PolarHBondContact O-N 3.02Å
265D96.9Very high96.3Very high55 Ų5550 Ų5029%0.29426%0.263SS..Hα-helixtrans-63-46.4172.8-60.9-19.9000111S261 R262 Y267 A268 V269 E270S261-D265 PolarHBondContact O-N 3.41Å; R262-D265 IonicContact CZ-OD2 3.94Å; R262-D265 IonicContact NH1-OD2 3.14Å; R262-D265 PolarHBondContact NH1-OD2 2.84Å; R262-D265 WeakPolarHBondContact O-CB 3.3Å; R262-D265 PolarHBondContact O-N 2.87Å; D265-Y267 PolarHBondContact O-N 2.83Å; D265-Y267 VanDerWaalsContact O-N 3.12Å; D265-A268 CarbonylContact O-C 3.57Å; D265-A268 PolarHBondContact O-N 2.97Å; D265-V269 PolarHBondContact O-N 3.32Å; D265-E270 VanDerWaalsContact C-OE2 3.24Å
266L97.5Very high96.4Very high0 Ų052.1 Ų52.10%028%0.281CS..Hα-helixtrans-51.5-39.3176.2-77.2176.9000112R262 F263 E270 R271 E379 V383 W428R262-L266 WeakPolarHBondContact O-CG 3.45Å; R262-L266 PolarHBondContact O-N 3.03Å; F263-L266 PolarHBondContact O-N 3.02Å; L266-E270 VanDerWaalsContact CA-OE2 3.25Å; L266-E270 WeakPolarHBondContact CA-OE2 3.27Å; L266-E270 HydrophobicContact CD2-CB 3.98Å; L266-E270 HydrophobicContact CD2-CG 4Å; L266-E270 PolarHBondContact N-OE2 3.41Å; L266-R271 WeakPolarHBondContact O-CB 3.32Å; L266-R271 PolarHBondContact O-N 3.29Å; L266-E379 HydrophobicContact CD2-CB 4.28Å; L266-E379 HydrophobicContact CD2-CG 3.87Å; L266-V383 HydrophobicContact CD1-CB 4.01Å; L266-V383 HydrophobicContact CD1-CG1 4.12Å; L266-V383 HydrophobicContact CD1-CG2 3.99Å; L266-W428 HydrophobicContact CB-CH2 3.93Å; L266-W428 HydrophobicContact CB-CZ2 4.03Å
267Y96.5Very high96.3Very high74 Ų7452.5 Ų52.529%0.2928%0.284SS..Hα-helixtrans-72-40.5175.2170.6-103.5000113.5F263 S264 D265 R271 W428 E442F263-Y267 PolarHBondContact O-N 3.39Å; S264-Y267 WeakPolarHBondContact O-CB 3.46Å; S264-Y267 PolarHBondContact O-N 2.96Å; D265-Y267 PolarHBondContact O-N 2.83Å; D265-Y267 VanDerWaalsContact O-N 3.12Å; Y267-R271 WeakPolarHBondContact O-CB 3.36Å; Y267-R271 PolarHBondContact O-NE 3.47Å; Y267-W428 HydrophobicContact CD2-CB 3.63Å; Y267-W428 AromaticContact CD2-CD1 3.78Å; Y267-W428 AromaticContact CD2-CD2 3.59Å; Y267-W428 HydrophobicContact CD2-CD2 3.59Å; Y267-W428 HydrophobicContact CD2-CE3 4.09Å; Y267-W428 AromaticContact CD2-CG 3.37Å; Y267-W428 HydrophobicContact CD2-CG 3.37Å; Y267-W428 HydrophobicContact CE2-CB 3.82Å; Y267-W428 HydrophobicContact CE2-CG 4.07Å; Y267-W428 HydrophobicContact CG-CD2 4.22Å; Y267-W428 HydrophobicContact CG-CG 4.14Å; Y267-E442 HydrophobicContact CE2-CB 4.41Å; Y267-E442 WeakPolarHBondContact CE2-OE2 3.23Å; Y267-E442 VanDerWaalsContact CZ-OE2 3.24Å; Y267-E442 PolarHBondContact OH-OE2 3.12Å
268A95.6Very high96.3Very high53 Ų5349.6 Ų49.644%0.43826%0.26SS..Hα-helixtrans-81.3-31-17300000113.5S264 D265 L272S264-A268 WeakPolarHBondContact O-CB 3.44Å; S264-A268 PolarHBondContact O-N 3.02Å; D265-A268 CarbonylContact O-C 3.57Å; D265-A268 PolarHBondContact O-N 2.97Å; A268-L272 WeakPolarHBondContact O-CD1 3.41Å
269V95.9Very high96.2Very high71 Ų7148 Ų4843%0.4325%0.254SS..THydrogen-bonded Turntrans-119.8-70.8-171.7-176.90000110.5D265 R271 L272 E273D265-V269 PolarHBondContact O-N 3.32Å; V269-R271 VanDerWaalsContact C-N 3.28Å; V269-R271 PolarHBondContact O-N 2.85Å; V269-L272 PolarHBondContact O-N 3.38Å; V269-E273 PolarHBondContact O-N 3.17Å
270E97.1Very high96Very high33 Ų3356.2 Ų56.215%0.15428%0.284CS..Hα-helixtrans-63.2-33.4-169.5-66.686.8158.200112.2R262 D265 L266 E273 A274 F376R262-E270 IonicContact CZ-OE1 3.57Å; R262-E270 IonicContact NH1-OE1 3.86Å; R262-E270 IonicContact NH2-OE1 2.96Å; R262-E270 PolarHBondContact NH2-OE1 2.92Å; R262-E270 VanDerWaalsContact NH2-OE1 3.07Å; D265-E270 VanDerWaalsContact C-OE2 3.24Å; L266-E270 VanDerWaalsContact CA-OE2 3.25Å; L266-E270 WeakPolarHBondContact CA-OE2 3.27Å; L266-E270 HydrophobicContact CD2-CB 3.98Å; L266-E270 HydrophobicContact CD2-CG 4Å; L266-E270 PolarHBondContact N-OE2 3.41Å; E270-E273 PolarHBondContact O-N 2.94Å; E270-A274 WeakPolarHBondContact O-CB 3.31Å; E270-A274 PolarHBondContact O-N 3.14Å; E270-F376 HydrophobicContact CB-CD2 3.95Å; E270-F376 HydrophobicContact CB-CE2 4.44Å
271R96.5Very high95.6Very high22 Ų2260.7 Ų60.78%0.08330%0.299CS..Hα-helixtrans-62.4-43.2172.4-175.2-159.765.781-5.7112.2L266 Y267 V269 Q275 I292 W428L266-R271 WeakPolarHBondContact O-CB 3.32Å; L266-R271 PolarHBondContact O-N 3.29Å; Y267-R271 WeakPolarHBondContact O-CB 3.36Å; Y267-R271 PolarHBondContact O-NE 3.47Å; V269-R271 VanDerWaalsContact C-N 3.28Å; V269-R271 PolarHBondContact O-N 2.85Å; R271-Q275 VanDerWaalsContact O-CB 3.29Å; R271-Q275 WeakPolarHBondContact O-CB 3.44Å; R271-Q275 PolarHBondContact O-N 2.95Å; R271-I292 HydrophobicContact CG-CG2 3.77Å; R271-W428 HydrophobicContact CB-CZ3 4.14Å; R271-W428 HydrophobicContact CG-CE3 4.15Å; R271-W428 HydrophobicContact CG-CZ3 4.09Å
272L95.9Very high95.4Very high83 Ų8358.4 Ų58.444%0.43528%0.281SS..Hα-helixtrans-69.3-38.8179.2-77.9-180000111.3A268 V269 Q275 S276A268-L272 WeakPolarHBondContact O-CD1 3.41Å; V269-L272 PolarHBondContact O-N 3.38Å; L272-Q275 PolarHBondContact O-N 3.34Å; L272-S276 WeakPolarHBondContact O-CB 3.38Å; L272-S276 PolarHBondContact O-N 3.12Å
273E96.1Very high95Very high115 Ų11561.5 Ų61.554%0.53730%0.304SS..Hα-helixtrans-60.9-50.4173.5-68.2-177.9173.900110.9V269 E270 Q275 S276 L277V269-E273 PolarHBondContact O-N 3.17Å; E270-E273 PolarHBondContact O-N 2.94Å; E273-Q275 VanDerWaalsContact C-N 3.31Å; E273-Q275 PolarHBondContact O-N 2.72Å; E273-S276 PolarHBondContact O-N 3.36Å; E273-S276 PolarHBondContact O-OG 3.16Å; E273-L277 WeakPolarHBondContact O-CB 3.43Å; E273-L277 PolarHBondContact O-N 3.15Å
274A96.1Very high94.7Very high6 Ų665.1 Ų65.15%0.0532%0.324CS..Hα-helixtrans-58.5-42.3175.500000111.9E270 L277 L278 I292 I373 F376E270-A274 WeakPolarHBondContact O-CB 3.31Å; E270-A274 PolarHBondContact O-N 3.14Å; A274-L277 PolarHBondContact O-N 2.96Å; A274-L278 WeakPolarHBondContact O-CB 3.09Å; A274-L278 VanDerWaalsContact O-CG 3.26Å; A274-L278 WeakPolarHBondContact O-CG 3.41Å; A274-L278 PolarHBondContact O-N 2.88Å; A274-I292 HydrophobicContact CB-CD1 4.36Å; A274-I292 HydrophobicContact CB-CG1 4.4Å; A274-I373 HydrophobicContact CB-CG2 4.19Å; A274-F376 HydrophobicContact CB-CB 4.03Å; A274-F376 HydrophobicContact CB-CD1 4.48Å; A274-F376 HydrophobicContact CB-CD2 4.26Å; A274-F376 HydrophobicContact CB-CG 3.99Å
275Q95.4Very high94.5Very high36 Ų3665 Ų6517%0.16832%0.319CS..Hα-helixtrans-61.5-47.3175.8-172.8-176.8-57.200111.5R271 L272 E273 L277 L278 R279 L285 V288 I292R271-Q275 VanDerWaalsContact O-CB 3.29Å; R271-Q275 WeakPolarHBondContact O-CB 3.44Å; R271-Q275 PolarHBondContact O-N 2.95Å; L272-Q275 PolarHBondContact O-N 3.34Å; E273-Q275 VanDerWaalsContact C-N 3.31Å; E273-Q275 PolarHBondContact O-N 2.72Å; Q275-L277 PolarHBondContact O-N 3.16Å; Q275-L278 PolarHBondContact O-N 2.86Å; Q275-R279 HydrophobicContact CG-CG 4.26Å; Q275-R279 VanDerWaalsContact O-CB 3.31Å; Q275-R279 WeakPolarHBondContact O-CB 3.4Å; Q275-R279 WeakPolarHBondContact O-CG 3.35Å; Q275-R279 PolarHBondContact O-N 3.37Å; Q275-L285 HydrophobicContact CG-CD1 4.25Å; Q275-V288 HydrophobicContact CB-CG1 4.28Å; Q275-V288 HydrophobicContact CG-CG1 3.75Å; Q275-I292 HydrophobicContact CB-CD1 3.71Å; Q275-I292 HydrophobicContact CG-CD1 4.37Å
276S95.1Very high94.2Very high65 Ų6563.6 Ų63.646%0.45531%0.311SS..Hα-helixtrans-60.7-34.2179.677.70000112.2L272 E273L272-S276 WeakPolarHBondContact O-CB 3.38Å; L272-S276 PolarHBondContact O-N 3.12Å; E273-S276 PolarHBondContact O-N 3.36Å; E273-S276 PolarHBondContact O-OG 3.16Å
277L94.1Very high94Very high49 Ų4964.8 Ų64.826%0.25732%0.316SS..Hα-helixtrans-77.6-44.4-177.6-164.4159.6000110.7E273 A274 Q275 R279 R280 Y281 L372E273-L277 WeakPolarHBondContact O-CB 3.43Å; E273-L277 PolarHBondContact O-N 3.15Å; A274-L277 PolarHBondContact O-N 2.96Å; Q275-L277 PolarHBondContact O-N 3.16Å; L277-R279 VanDerWaalsContact C-N 3.35Å; L277-R279 PolarHBondContact O-N 3.33Å; L277-R280 WeakPolarHBondContact O-CB 3.38Å; L277-R280 PolarHBondContact O-N 3.47Å; L277-Y281 WeakPolarHBondContact O-CD2 3.47Å; L277-L372 HydrophobicContact CD2-CB 4.45Å; L277-L372 HydrophobicContact CD2-CD1 3.35Å; L277-L372 HydrophobicContact CD2-CD2 3.55Å; L277-L372 HydrophobicContact CD2-CG 3.15Å
278L93.9Very high93.9Very high0 Ų061.2 Ų61.20%030%0.303CS..Hα-helixtrans-64.4-36.2173.9-71.5169.3000112.7A274 Q275 R280 Y281 I282 V288 I291 I292 F364 L372 I373A274-L278 WeakPolarHBondContact O-CB 3.09Å; A274-L278 VanDerWaalsContact O-CG 3.26Å; A274-L278 WeakPolarHBondContact O-CG 3.41Å; A274-L278 PolarHBondContact O-N 2.88Å; Q275-L278 PolarHBondContact O-N 2.86Å; L278-R280 PolarHBondContact O-N 3.2Å; L278-R280 VanDerWaalsContact O-N 3.1Å; L278-Y281 PolarHBondContact O-N 3.29Å; L278-I282 PolarHBondContact O-N 2.88Å; L278-V288 HydrophobicContact CB-CB 4.48Å; L278-V288 HydrophobicContact CB-CG1 3.7Å; L278-V288 HydrophobicContact CB-CG2 4.06Å; L278-V288 HydrophobicContact CD1-CG1 3.88Å; L278-V288 HydrophobicContact CG-CG1 4.46Å; L278-I291 HydrophobicContact CD1-CB 4.46Å; L278-I291 HydrophobicContact CD1-CG2 4Å; L278-I292 HydrophobicContact CD1-CD1 4.09Å; L278-I292 HydrophobicContact CD1-CG1 3.72Å; L278-F364 HydrophobicContact CD2-CE2 3.61Å; L278-F364 HydrophobicContact CD2-CZ 4.04Å; L278-L372 HydrophobicContact CD2-CD2 4.31Å; L278-I373 HydrophobicContact CD1-CG2 3.96Å; L278-I373 HydrophobicContact CD2-CG2 3.84Å; L278-I373 HydrophobicContact CG-CG2 3.71Å
279R93.4Very high93.8Very high108 Ų10859.4 Ų59.441%0.40829%0.285SS..THydrogen-bonded Turntrans-63.5-13178.5-75.5-76-76.3155.1-9.5114.2Q275 L277 Y281 I282 D283 V288Q275-R279 HydrophobicContact CG-CG 4.26Å; Q275-R279 VanDerWaalsContact O-CB 3.31Å; Q275-R279 WeakPolarHBondContact O-CB 3.4Å; Q275-R279 WeakPolarHBondContact O-CG 3.35Å; Q275-R279 PolarHBondContact O-N 3.37Å; L277-R279 VanDerWaalsContact C-N 3.35Å; L277-R279 PolarHBondContact O-N 3.33Å; R279-Y281 VanDerWaalsContact C-N 3.27Å; R279-I282 PolarHBondContact NH1-O 2.77Å; R279-D283 PolarHBondContact NH1-O 2.89Å; R279-V288 HydrophobicContact CG-CG1 4.48Å; R279-V288 HydrophobicContact CG-CG2 4.38Å
280R92.6Very high93.7Very high191 Ų19159.2 Ų59.272%0.72128%0.277SS*.THydrogen-bonded Turntrans-74.9-18.1171.7-60.2179.3-172.2179.41.5113L277 L278L277-R280 WeakPolarHBondContact O-CB 3.38Å; L277-R280 PolarHBondContact O-N 3.47Å; L278-R280 PolarHBondContact O-N 3.2Å; L278-R280 VanDerWaalsContact O-N 3.1Å
281Y90.6Very high93.6Very high120 Ų12057.6 Ų57.647%0.47127%0.269SS..THydrogen-bonded Turntrans-122.5-21-175.2-56.7-84000113L277 L278 R279 V368 L372L277-Y281 WeakPolarHBondContact O-CD2 3.47Å; L278-Y281 PolarHBondContact O-N 3.29Å; R279-Y281 VanDerWaalsContact C-N 3.27Å; Y281-V368 HydrophobicContact CD1-CG1 4.34Å; Y281-V368 HydrophobicContact CD1-CG2 3.85Å; Y281-V368 HydrophobicContact CG-CG1 4.3Å; Y281-V368 HydrophobicContact CG-CG2 4.26Å; Y281-L372 HydrophobicContact CD2-CD2 3.53Å; Y281-L372 HydrophobicContact CE2-CD1 4.06Å; Y281-L372 HydrophobicContact CE2-CD2 3.61Å; Y281-L372 HydrophobicContact CE2-CG 4.48Å; Y281-L372 HydrophobicContact CG-CD2 4.42Å
282I91.2Very high93.6Very high14 Ų1456.6 Ų56.67%0.07227%0.265CS..  trans-125.7116.5-178.2-56.9176.7000110.4L278 R279 D284 M287 V288 I291 F364 P365L278-I282 PolarHBondContact O-N 2.88Å; R279-I282 PolarHBondContact NH1-O 2.77Å; I282-D284 HydrophobicContact CG2-CB 4.37Å; I282-M287 HydrophobicContact CG2-CB 4.16Å; I282-M287 HydrophobicContact CG2-CG 4.37Å; I282-V288 HydrophobicContact CB-CG2 3.7Å; I282-V288 HydrophobicContact CD1-CG2 4.44Å; I282-V288 HydrophobicContact CG2-CG2 3.75Å; I282-I291 HydrophobicContact CD1-CD1 3.45Å; I282-I291 VanDerWaalsContact CD1-CD1 3.45Å; I282-F364 HydrophobicContact CD1-CD2 3.58Å; I282-F364 HydrophobicContact CD1-CE2 3.54Å; I282-F364 HydrophobicContact CG1-CE2 4.42Å; I282-P365 HydrophobicContact CG1-CG 4.19Å
283D89.8Confident93.6Very high150 Ų15053.3 Ų53.380%0.80225%0.248SC*.  trans-76.6-23.8178.8-66.3-34.5000113.5R279 L285R279-D283 PolarHBondContact NH1-O 2.89Å; D283-L285 PolarHBondContact O-N 3.2Å
284D92.1Very high93.6Very high77 Ų7748.3 Ų48.341%0.41223%0.225SC..  trans-83.4107.4177.2-177.616000111.4I282 E286 M287 V288I282-D284 HydrophobicContact CG2-CB 4.37Å; D284-E286 VanDerWaalsContact C-N 3.27Å; D284-E286 PolarHBondContact O-N 3.46Å; D284-E286 WeakPolarHBondContact OD1-CB 3.39Å; D284-E286 PolarHBondContact OD1-N 3.5Å; D284-M287 HydrophobicContact CB-CB 4.01Å; D284-M287 PolarHBondContact O-N 2.69Å; D284-M287 PolarHBondContact OD2-N 3.43Å; D284-V288 WeakPolarHBondContact O-CG2 3.44Å; D284-V288 PolarHBondContact O-N 2.81Å; D284-V288 VanDerWaalsContact O-N 3.12Å
285L91.6Very high93.6Very high43 Ų4348 Ų4823%0.22522%0.222CC..Hα-helixtrans-61.4-35.2177.5-178.764.4000112.3Q275 D283 M287 V288 Q289Q275-L285 HydrophobicContact CG-CD1 4.25Å; D283-L285 PolarHBondContact O-N 3.2Å; L285-M287 VanDerWaalsContact C-N 3.35Å; L285-V288 PolarHBondContact O-N 3.41Å; L285-Q289 HydrophobicContact CD1-CG 4.36Å; L285-Q289 HydrophobicContact CG-CG 4.43Å; L285-Q289 WeakPolarHBondContact O-CG 3.3Å; L285-Q289 PolarHBondContact O-N 3.42Å
286E92.1Very high93.7Very high25 Ų2546.3 Ų46.312%0.11721%0.214CC..Hα-helixtrans-63.6-43.5179170.9173.8152.400110.4D284 Q289 R290 Y425 R446D284-E286 VanDerWaalsContact C-N 3.27Å; D284-E286 PolarHBondContact O-N 3.46Å; D284-E286 WeakPolarHBondContact OD1-CB 3.39Å; D284-E286 PolarHBondContact OD1-N 3.5Å; E286-Q289 PolarHBondContact O-N 2.91Å; E286-R290 WeakPolarHBondContact O-CG 3.44Å; E286-R290 PolarHBondContact O-N 2.74Å; E286-R290 IonicContact OE1-CZ 2.63Å; E286-R290 IonicContact OE1-NE 3.38Å; E286-R290 IonicContact OE1-NH1 2.95Å; E286-R290 PolarHBondContact OE1-NH1 3.35Å; E286-R290 IonicContact OE1-NH2 2.75Å; E286-R290 PolarHBondContact OE1-NH2 2.9Å; E286-Y425 HydrophobicContact CB-CE1 4.05Å; E286-Y425 HydrophobicContact CG-CD1 3.66Å; E286-Y425 HydrophobicContact CG-CE1 3.45Å; E286-Y425 VanDerWaalsContact CG-CE1 3.45Å; E286-Y425 HydrophobicContact CG-CE2 4.38Å; E286-Y425 HydrophobicContact CG-CG 4.2Å; E286-R446 IonicContact OE2-CZ 2.88Å; E286-R446 IonicContact OE2-NH1 2.83Å; E286-R446 PolarHBondContact OE2-NH1 3.45Å; E286-R446 IonicContact OE2-NH2 3.93Å
287M92.4Very high93.8Very high25 Ų2544.4 Ų44.412%0.12320%0.199CC..Hα-helixtrans-63-43.9174.7-171.558.465.100112I282 D284 L285 Q289 R290 I291 I362 S363I282-M287 HydrophobicContact CG2-CB 4.16Å; I282-M287 HydrophobicContact CG2-CG 4.37Å; D284-M287 HydrophobicContact CB-CB 4.01Å; D284-M287 PolarHBondContact O-N 2.69Å; D284-M287 PolarHBondContact OD2-N 3.43Å; L285-M287 VanDerWaalsContact C-N 3.35Å; M287-Q289 VanDerWaalsContact C-N 3.34Å; M287-Q289 PolarHBondContact O-N 3.28Å; M287-R290 PolarHBondContact O-N 3.34Å; M287-I291 HydrophobicContact CG-CD1 4.06Å; M287-I291 VanDerWaalsContact O-CG1 3.3Å; M287-I291 WeakPolarHBondContact O-CG1 3.33Å; M287-I291 PolarHBondContact O-N 3.02Å; M287-I362 HydrophobicContact SD-CB 4.32Å; M287-I362 HydrophobicContact SD-CG2 4.31Å; M287-S363 VanDerWaalsContact CE-OG 3.25Å; M287-S363 WeakPolarHBondContact CE-OG 3.31Å; M287-S363 PolarHBondContact SD-N 3.41Å
288V94.4Very high93.9Very high0 Ų043.6 Ų43.60%020%0.195CC..Hα-helixtrans-58.4-46.3176.5173.20000111.3Q275 L278 R279 I282 D284 L285 R290 I291 I292Q275-V288 HydrophobicContact CB-CG1 4.28Å; Q275-V288 HydrophobicContact CG-CG1 3.75Å; L278-V288 HydrophobicContact CB-CB 4.48Å; L278-V288 HydrophobicContact CB-CG1 3.7Å; L278-V288 HydrophobicContact CB-CG2 4.06Å; L278-V288 HydrophobicContact CD1-CG1 3.88Å; L278-V288 HydrophobicContact CG-CG1 4.46Å; R279-V288 HydrophobicContact CG-CG1 4.48Å; R279-V288 HydrophobicContact CG-CG2 4.38Å; I282-V288 HydrophobicContact CB-CG2 3.7Å; I282-V288 HydrophobicContact CD1-CG2 4.44Å; I282-V288 HydrophobicContact CG2-CG2 3.75Å; D284-V288 WeakPolarHBondContact O-CG2 3.44Å; D284-V288 PolarHBondContact O-N 2.81Å; D284-V288 VanDerWaalsContact O-N 3.12Å; L285-V288 PolarHBondContact O-N 3.41Å; V288-R290 PolarHBondContact O-N 2.63Å; V288-I291 PolarHBondContact O-N 3.4Å; V288-I292 HydrophobicContact CG1-CD1 4.01Å; V288-I292 WeakPolarHBondContact O-CG1 3.46Å; V288-I292 PolarHBondContact O-N 2.97Å; V288-I292 VanDerWaalsContact O-N 3.12Å
289Q94.4Very high94.1Very high15 Ų1543.6 Ų43.67%0.0720%0.195CC..Hα-helixtrans-64.3-39.9178.6-72173.5-31.100111.7L285 E286 M287 I292 F293 Y425 V427L285-Q289 HydrophobicContact CD1-CG 4.36Å; L285-Q289 HydrophobicContact CG-CG 4.43Å; L285-Q289 WeakPolarHBondContact O-CG 3.3Å; L285-Q289 PolarHBondContact O-N 3.42Å; E286-Q289 PolarHBondContact O-N 2.91Å; M287-Q289 VanDerWaalsContact C-N 3.34Å; M287-Q289 PolarHBondContact O-N 3.28Å; Q289-I292 PolarHBondContact O-N 3.43Å; Q289-F293 WeakPolarHBondContact O-CB 3.49Å; Q289-F293 PolarHBondContact O-N 3.32Å; Q289-Y425 HydrophobicContact CB-CE2 4.03Å; Q289-Y425 PolarHBondContact OE1-OH 3.37Å; Q289-V427 HydrophobicContact CG-CG1 4.32Å
290R93.8Very high94.3Very high66 Ų6638.6 Ų38.625%0.24918%0.176CC..Hα-helixtrans-61.7-42.4173.7-76.3177.5173.2146.41.9112.7E286 M287 V288 F293 I294 I362 Y425E286-R290 WeakPolarHBondContact O-CG 3.44Å; E286-R290 PolarHBondContact O-N 2.74Å; E286-R290 IonicContact OE1-CZ 2.63Å; E286-R290 IonicContact OE1-NE 3.38Å; E286-R290 IonicContact OE1-NH1 2.95Å; E286-R290 PolarHBondContact OE1-NH1 3.35Å; E286-R290 IonicContact OE1-NH2 2.75Å; E286-R290 PolarHBondContact OE1-NH2 2.9Å; M287-R290 PolarHBondContact O-N 3.34Å; V288-R290 PolarHBondContact O-N 2.63Å; R290-F293 PolarHBondContact O-N 3.43Å; R290-I294 WeakPolarHBondContact O-CB 3.4Å; R290-I294 VanDerWaalsContact O-CG1 3.3Å; R290-I294 WeakPolarHBondContact O-CG1 3.34Å; R290-I294 PolarHBondContact O-N 3.39Å; R290-I362 HydrophobicContact CB-CG2 3.8Å; R290-Y425 HydrophobicContact CG-CD2 4.49Å; R290-Y425 HydrophobicContact CG-CG 4.48Å
291I94.9Very high94.5Very high0 Ų034.3 Ų34.30%016%0.164CC..Hα-helixtrans-59.2-48.6177.2-70.8162.9000110.3L278 I282 M287 V288 I294 A295 M356 I362 F364 F370 I373L278-I291 HydrophobicContact CD1-CB 4.46Å; L278-I291 HydrophobicContact CD1-CG2 4Å; I282-I291 HydrophobicContact CD1-CD1 3.45Å; I282-I291 VanDerWaalsContact CD1-CD1 3.45Å; M287-I291 HydrophobicContact CG-CD1 4.06Å; M287-I291 VanDerWaalsContact O-CG1 3.3Å; M287-I291 WeakPolarHBondContact O-CG1 3.33Å; M287-I291 PolarHBondContact O-N 3.02Å; V288-I291 PolarHBondContact O-N 3.4Å; I291-I294 PolarHBondContact O-N 3.49Å; I291-A295 VanDerWaalsContact O-CB 3.31Å; I291-A295 WeakPolarHBondContact O-CB 3.43Å; I291-A295 PolarHBondContact O-N 3.06Å; I291-M356 HydrophobicContact CG2-CE 3.79Å; I291-I362 HydrophobicContact CB-CG2 4.47Å; I291-I362 HydrophobicContact CG1-CB 3.96Å; I291-I362 HydrophobicContact CG1-CG2 3.78Å; I291-F364 HydrophobicContact CD1-CD2 3.78Å; I291-F364 HydrophobicContact CD1-CE2 4.24Å; I291-F370 HydrophobicContact CD1-CE1 4.28Å; I291-F370 HydrophobicContact CG1-CE1 4.14Å; I291-F370 HydrophobicContact CG2-CD1 4.07Å; I291-F370 HydrophobicContact CG2-CE1 3.77Å; I291-I373 HydrophobicContact CG2-CD1 4.06Å
292I96Very high94.8Very high1 Ų129.1 Ų29.11%0.00515%0.145CC..Hα-helixtrans-65.4-42.7-179.3-62.8165.2000111.3R271 A274 Q275 L278 V288 Q289 A295 T296 F376 W428R271-I292 HydrophobicContact CG-CG2 3.77Å; A274-I292 HydrophobicContact CB-CD1 4.36Å; A274-I292 HydrophobicContact CB-CG1 4.4Å; Q275-I292 HydrophobicContact CB-CD1 3.71Å; Q275-I292 HydrophobicContact CG-CD1 4.37Å; L278-I292 HydrophobicContact CD1-CD1 4.09Å; L278-I292 HydrophobicContact CD1-CG1 3.72Å; V288-I292 HydrophobicContact CG1-CD1 4.01Å; V288-I292 WeakPolarHBondContact O-CG1 3.46Å; V288-I292 PolarHBondContact O-N 2.97Å; V288-I292 VanDerWaalsContact O-N 3.12Å; Q289-I292 PolarHBondContact O-N 3.43Å; I292-A295 PolarHBondContact O-N 2.97Å; I292-T296 PolarHBondContact O-N 3.22Å; I292-T296 PolarHBondContact O-OG1 3.34Å; I292-F376 HydrophobicContact CG2-CE1 3.85Å; I292-F376 HydrophobicContact CG2-CE2 4.43Å; I292-F376 HydrophobicContact CG2-CZ 3.7Å; I292-W428 HydrophobicContact CG2-CZ3 4.48Å
293F96.1Very high95.1Very high14 Ų1428.4 Ų28.46%0.06114%0.142CC..Hα-helixtrans-58.9-49.6175.9173.8-95000111.4Q289 R290 T296 V297 T399 H426 P429Q289-F293 WeakPolarHBondContact O-CB 3.49Å; Q289-F293 PolarHBondContact O-N 3.32Å; R290-F293 PolarHBondContact O-N 3.43Å; F293-T296 WeakPolarHBondContact O-CB 3.5Å; F293-T296 PolarHBondContact O-N 3.21Å; F293-V297 HydrophobicContact CD1-CG2 4.35Å; F293-V297 HydrophobicContact CE1-CG2 3.8Å; F293-V297 HydrophobicContact CE2-CG2 4.07Å; F293-V297 HydrophobicContact CZ-CG2 3.64Å; F293-V297 WeakPolarHBondContact O-CG2 3.47Å; F293-V297 PolarHBondContact O-N 2.89Å; F293-T399 HydrophobicContact CE2-CG2 4.42Å; F293-T399 HydrophobicContact CZ-CG2 3.87Å; F293-H426 WeakPolarHBondContact CB-O 3.45Å; F293-H426 HydrophobicContact CD1-CB 4.28Å; F293-H426 HydrophobicContact CD2-CB 3.48Å; F293-H426 VanDerWaalsContact CD2-CB 3.48Å; F293-H426 HydrophobicContact CE1-CB 4.13Å; F293-H426 HydrophobicContact CE2-CB 3.29Å; F293-H426 HydrophobicContact CG-CB 3.99Å; F293-H426 HydrophobicContact CZ-CB 3.65Å; F293-P429 HydrophobicContact CD2-CB 4.47Å; F293-P429 HydrophobicContact CE2-CB 3.82Å; F293-P429 HydrophobicContact CE2-CG 4.39Å
294I95.4Very high95.4Very high10 Ų1023.4 Ų23.45%0.05111%0.113CC..Hα-helixtrans-65-44179.5-67.7-177.2000110.8R290 I291 T296 V297 E298 M356 N359 R361 I362R290-I294 WeakPolarHBondContact O-CB 3.4Å; R290-I294 VanDerWaalsContact O-CG1 3.3Å; R290-I294 WeakPolarHBondContact O-CG1 3.34Å; R290-I294 PolarHBondContact O-N 3.39Å; I291-I294 PolarHBondContact O-N 3.49Å; I294-T296 PolarHBondContact O-N 2.91Å; I294-V297 PolarHBondContact O-N 3.4Å; I294-V297 VanDerWaalsContact O-N 3.1Å; I294-E298 HydrophobicContact CG2-CG 3.81Å; I294-E298 WeakPolarHBondContact O-CB 3.4Å; I294-E298 WeakPolarHBondContact O-CG 3.35Å; I294-E298 PolarHBondContact O-N 2.87Å; I294-M356 HydrophobicContact CG2-CG 4.26Å; I294-N359 WeakPolarHBondContact CG2-ND2 3.26Å; I294-R361 HydrophobicContact CD1-CB 3.82Å; I294-I362 HydrophobicContact CB-CD1 4.34Å; I294-I362 HydrophobicContact CD1-CB 4.28Å; I294-I362 HydrophobicContact CD1-CD1 4.25Å; I294-I362 HydrophobicContact CD1-CG1 4.05Å; I294-I362 HydrophobicContact CD1-CG2 3.44Å; I294-I362 VanDerWaalsContact CD1-CG2 3.44Å; I294-I362 HydrophobicContact CG1-CG2 4.3Å; I294-I362 HydrophobicContact CG2-CD1 4.05Å
295A96.6Very high95.6Very high0 Ų024.3 Ų24.30%012%0.117CC..Hα-helixtrans-53.8-40.8174.800000111.8I291 I292 A299 M356 I373 F376 I377I291-A295 VanDerWaalsContact O-CB 3.31Å; I291-A295 WeakPolarHBondContact O-CB 3.43Å; I291-A295 PolarHBondContact O-N 3.06Å; I292-A295 PolarHBondContact O-N 2.97Å; A295-A299 WeakPolarHBondContact O-CB 3.3Å; A295-A299 PolarHBondContact O-N 3.09Å; A295-M356 HydrophobicContact CB-CE 3.79Å; A295-M356 HydrophobicContact CB-SD 3.64Å; A295-I373 HydrophobicContact CB-CD1 4.11Å; A295-F376 HydrophobicContact CB-CD1 4.47Å; A295-F376 HydrophobicContact CB-CE1 4.11Å; A295-I377 HydrophobicContact CB-CG1 4.27Å
296T97.6Very high95.9Very high0 Ų023.1 Ų23.10%011%0.114CC..Hα-helixtrans-66.8-47177.3-50.30000111.6I292 F293 I294 A299 F300 F376 T380 L396 W428 P429I292-T296 PolarHBondContact O-N 3.22Å; I292-T296 PolarHBondContact O-OG1 3.34Å; F293-T296 WeakPolarHBondContact O-CB 3.5Å; F293-T296 PolarHBondContact O-N 3.21Å; I294-T296 PolarHBondContact O-N 2.91Å; T296-A299 PolarHBondContact O-N 2.85Å; T296-F300 HydrophobicContact CG2-CD2 4.35Å; T296-F300 HydrophobicContact CG2-CE2 4.31Å; T296-F300 WeakPolarHBondContact O-CD2 3.23Å; T296-F300 PolarHBondContact O-N 3.06Å; T296-F300 VanDerWaalsContact O-N 3.11Å; T296-F376 WeakPolarHBondContact OG1-CZ 3.43Å; T296-T380 HydrophobicContact CG2-CG2 3.99Å; T296-L396 HydrophobicContact CG2-CD1 4.47Å; T296-W428 HydrophobicContact CG2-CH2 4.04Å; T296-W428 HydrophobicContact CG2-CZ2 4.39Å; T296-W428 HydrophobicContact CG2-CZ3 4.29Å; T296-P429 HydrophobicContact CG2-CG 3.73Å
297V96.8Very high96.1Very high24 Ų2423.2 Ų23.215%0.14511%0.113CC..Hα-helixtrans-63.1-48.1179.8171.20000111.6F293 I294 A299 F300 Q301 L396F293-V297 HydrophobicContact CD1-CG2 4.35Å; F293-V297 HydrophobicContact CE1-CG2 3.8Å; F293-V297 HydrophobicContact CE2-CG2 4.07Å; F293-V297 HydrophobicContact CZ-CG2 3.64Å; F293-V297 WeakPolarHBondContact O-CG2 3.47Å; F293-V297 PolarHBondContact O-N 2.89Å; I294-V297 PolarHBondContact O-N 3.4Å; I294-V297 VanDerWaalsContact O-N 3.1Å; V297-A299 VanDerWaalsContact C-N 3.32Å; V297-A299 PolarHBondContact O-N 3.36Å; V297-F300 PolarHBondContact O-N 3.29Å; V297-Q301 WeakPolarHBondContact O-CG 3.48Å; V297-Q301 PolarHBondContact O-N 3.02Å; V297-Q301 VanDerWaalsContact O-N 3.08Å; V297-L396 HydrophobicContact CB-CD1 4.42Å; V297-L396 HydrophobicContact CG2-CD1 4.02Å
298E96.6Very high96.2Very high33 Ų3328.9 Ų28.915%0.15413%0.133CC..Hα-helixtrans-64.9-37.1178.5-63.7-56.6155.900111.2I294 F300 Q301 A302 V352 A355 M356I294-E298 HydrophobicContact CG2-CG 3.81Å; I294-E298 WeakPolarHBondContact O-CB 3.4Å; I294-E298 WeakPolarHBondContact O-CG 3.35Å; I294-E298 PolarHBondContact O-N 2.87Å; E298-F300 PolarHBondContact O-N 3.44Å; E298-Q301 PolarHBondContact O-N 3.14Å; E298-A302 WeakPolarHBondContact O-CB 3.33Å; E298-A302 PolarHBondContact O-N 3.24Å; E298-V352 HydrophobicContact CB-CG1 3.96Å; E298-V352 HydrophobicContact CB-CG2 4.39Å; E298-A355 HydrophobicContact CG-CB 4.21Å; E298-M356 HydrophobicContact CG-CG 4.48Å
299A97.9Very high96.3Very high0 Ų034.9 Ų34.90%016%0.161CC..Hα-helixtrans-61.5-40.7175.100000112.8A295 T296 V297 A303 V352 T380A295-A299 WeakPolarHBondContact O-CB 3.3Å; A295-A299 PolarHBondContact O-N 3.09Å; T296-A299 PolarHBondContact O-N 2.85Å; V297-A299 VanDerWaalsContact C-N 3.32Å; V297-A299 PolarHBondContact O-N 3.36Å; A299-A303 WeakPolarHBondContact O-CB 3.05Å; A299-A303 PolarHBondContact O-N 3.05Å; A299-V352 HydrophobicContact CB-CG2 4.15Å; A299-T380 HydrophobicContact CB-CG2 3.67Å
300F97.8Very high96.3Very high2 Ų234.7 Ų34.71%0.00916%0.16CC..Hα-helixtrans-66.2-39.9174.4-91.2-108000112.3F263 T296 V297 E298 K304 T380 A384 M387 L396 L431F263-F300 HydrophobicContact CD2-CE2 4.3Å; F263-F300 AromaticContact CD2-CZ 3.91Å; F263-F300 HydrophobicContact CD2-CZ 3.91Å; F263-F300 AromaticContact CE2-CE2 3.93Å; F263-F300 HydrophobicContact CE2-CE2 3.93Å; F263-F300 AromaticContact CE2-CZ 3.74Å; F263-F300 HydrophobicContact CE2-CZ 3.74Å; T296-F300 HydrophobicContact CG2-CD2 4.35Å; T296-F300 HydrophobicContact CG2-CE2 4.31Å; T296-F300 WeakPolarHBondContact O-CD2 3.23Å; T296-F300 PolarHBondContact O-N 3.06Å; T296-F300 VanDerWaalsContact O-N 3.11Å; V297-F300 PolarHBondContact O-N 3.29Å; E298-F300 PolarHBondContact O-N 3.44Å; F300-K304 VanDerWaalsContact O-CB 3.28Å; F300-K304 WeakPolarHBondContact O-CB 3.41Å; F300-K304 PolarHBondContact O-N 3.39Å; F300-T380 HydrophobicContact CD2-CG2 4.22Å; F300-T380 HydrophobicContact CE2-CG2 4.11Å; F300-A384 HydrophobicContact CB-CB 4.39Å; F300-A384 HydrophobicContact CD1-CB 3.92Å; F300-A384 HydrophobicContact CD2-CB 3.66Å; F300-A384 HydrophobicContact CE1-CB 4.08Å; F300-A384 HydrophobicContact CE2-CB 3.83Å; F300-A384 HydrophobicContact CG-CB 3.72Å; F300-A384 HydrophobicContact CZ-CB 4.04Å; F300-M387 HydrophobicContact CE1-SD 3.6Å; F300-M387 HydrophobicContact CZ-SD 3.6Å; F300-M387 VanDerWaalsContact CZ-SD 3.6Å; F300-L396 HydrophobicContact CB-CD1 3.74Å; F300-L396 HydrophobicContact CB-CG 4.03Å; F300-L396 HydrophobicContact CD1-CD1 4.19Å; F300-L396 HydrophobicContact CD1-CD2 3.96Å; F300-L396 HydrophobicContact CD1-CG 3.63Å; F300-L396 HydrophobicContact CD2-CD1 3.73Å; F300-L396 HydrophobicContact CD2-CD2 4.14Å; F300-L396 HydrophobicContact CD2-CG 3.99Å; F300-L396 HydrophobicContact CE1-CD2 3.79Å; F300-L396 HydrophobicContact CE1-CG 4.01Å; F300-L396 HydrophobicContact CE2-CD1 4.36Å; F300-L396 HydrophobicContact CE2-CD2 3.98Å; F300-L396 HydrophobicContact CE2-CG 4.34Å; F300-L396 HydrophobicContact CG-CD1 3.62Å; F300-L396 HydrophobicContact CG-CD2 4.12Å; F300-L396 HydrophobicContact CG-CG 3.61Å; F300-L396 HydrophobicContact CZ-CD2 3.79Å; F300-L396 HydrophobicContact CZ-CG 4.35Å; F300-L431 HydrophobicContact CE1-CD1 4.15Å; F300-L431 HydrophobicContact CZ-CD1 4.29Å
301Q96.6Very high96.4Very high102 Ų10234.2 Ų34.248%0.47716%0.16SC..Hα-helixtrans-64.5-48.2176.1-68.2-179.330.600111.7V297 E298 K304 L305V297-Q301 WeakPolarHBondContact O-CG 3.48Å; V297-Q301 PolarHBondContact O-N 3.02Å; V297-Q301 VanDerWaalsContact O-N 3.08Å; E298-Q301 PolarHBondContact O-N 3.14Å; Q301-K304 PolarHBondContact O-N 3.34Å; Q301-L305 WeakPolarHBondContact O-CG 3.48Å; Q301-L305 PolarHBondContact O-N 3.1Å
302A97.4Very high96.4Very high10 Ų1039.2 Ų39.28%0.08319%0.186CC..Hα-helixtrans-60.7-46.2177.700000111.5E298 K304 L305 A306 D351 V352E298-A302 WeakPolarHBondContact O-CB 3.33Å; E298-A302 PolarHBondContact O-N 3.24Å; A302-K304 VanDerWaalsContact C-N 3.35Å; A302-K304 PolarHBondContact O-N 2.88Å; A302-L305 PolarHBondContact O-N 3.37Å; A302-A306 WeakPolarHBondContact O-CB 3.46Å; A302-A306 PolarHBondContact O-N 3.3Å; A302-D351 HydrophobicContact CB-CB 4.42Å; A302-V352 HydrophobicContact CB-CG2 3.75Å
303A97.1Very high96.3Very high0 Ų046.2 Ų46.20%021%0.212CC..Hα-helixtrans-62.8-39.3177.700000112.5A299 A306 Y307 A384 F385A299-A303 WeakPolarHBondContact O-CB 3.05Å; A299-A303 PolarHBondContact O-N 3.05Å; A303-A306 PolarHBondContact O-N 3.06Å; A303-Y307 WeakPolarHBondContact O-CB 3.44Å; A303-Y307 PolarHBondContact O-N 2.99Å; A303-A384 HydrophobicContact CB-CB 3.62Å; A303-F385 HydrophobicContact CB-CB 4.1Å
304K95.9Very high96.3Very high44 Ų4446 Ų4619%0.19121%0.212CC..Hα-helixtrans-63.5-42.6175.2177.9177-79.4-178.60112.4F300 Q301 A302 R308 Q388 D395F300-K304 VanDerWaalsContact O-CB 3.28Å; F300-K304 WeakPolarHBondContact O-CB 3.41Å; F300-K304 PolarHBondContact O-N 3.39Å; Q301-K304 PolarHBondContact O-N 3.34Å; A302-K304 VanDerWaalsContact C-N 3.35Å; A302-K304 PolarHBondContact O-N 2.88Å; K304-R308 VanDerWaalsContact O-CG 3.31Å; K304-R308 WeakPolarHBondContact O-CG 3.29Å; K304-R308 PolarHBondContact O-N 3.25Å; K304-R308 VanDerWaalsContact O-N 3.12Å; K304-Q388 HydrophobicContact CB-CG 4.36Å; K304-Q388 VanDerWaalsContact CE-OE1 3.23Å; K304-D395 IonicContact NZ-OD1 2.93Å; K304-D395 PolarHBondContact NZ-OD1 2.96Å; K304-D395 IonicContact NZ-OD2 2.63Å; K304-D395 PolarHBondContact NZ-OD2 3.2Å
305L96.6Very high96.2Very high96 Ų9649.2 Ų49.250%0.50323%0.226SC..Hα-helixtrans-65.3-44.1175-68.4174.9000111.3Q301 A302 Y307 R308 Q309Q301-L305 WeakPolarHBondContact O-CG 3.48Å; Q301-L305 PolarHBondContact O-N 3.1Å; A302-L305 PolarHBondContact O-N 3.37Å; L305-Y307 PolarHBondContact O-N 2.94Å; L305-R308 PolarHBondContact O-N 3.42Å; L305-Q309 WeakPolarHBondContact O-CG 3.36Å; L305-Q309 PolarHBondContact O-N 3.37Å
306A96.6Very high96.1Very high18 Ų1856.9 Ų56.915%0.14926%0.259CS..Hα-helixtrans-60.6-43.217700000112.1A302 A303 Q309 F310 Y343 F385A302-A306 WeakPolarHBondContact O-CB 3.46Å; A302-A306 PolarHBondContact O-N 3.3Å; A303-A306 PolarHBondContact O-N 3.06Å; A306-Q309 PolarHBondContact O-N 2.93Å; A306-F310 WeakPolarHBondContact O-CB 3.38Å; A306-F310 PolarHBondContact O-N 2.9Å; A306-Y343 HydrophobicContact CB-CE2 3.82Å; A306-F385 HydrophobicContact CB-CD2 4.33Å; A306-F385 HydrophobicContact CB-CE2 4.34Å
307Y96.5Very high95.8Very high28 Ų2861.9 Ų61.911%0.1129%0.29CS..Hα-helixtrans-62-45.1176173.2-106000111.8A303 L305 Q309 F310 K311 I336 F385 Q388 T389A303-Y307 WeakPolarHBondContact O-CB 3.44Å; A303-Y307 PolarHBondContact O-N 2.99Å; L305-Y307 PolarHBondContact O-N 2.94Å; Y307-Q309 VanDerWaalsContact C-N 3.33Å; Y307-Q309 PolarHBondContact O-N 3.42Å; Y307-F310 PolarHBondContact O-N 2.87Å; Y307-K311 HydrophobicContact CE1-CD 4.23Å; Y307-K311 VanDerWaalsContact O-CB 3.3Å; Y307-K311 WeakPolarHBondContact O-CB 3.47Å; Y307-K311 PolarHBondContact O-N 3.01Å; Y307-I336 HydrophobicContact CD2-CG2 4.46Å; Y307-I336 HydrophobicContact CE2-CD1 3.99Å; Y307-I336 HydrophobicContact CE2-CG2 4.05Å; Y307-F385 HydrophobicContact CD2-CE2 4.46Å; Y307-F385 HydrophobicContact CD2-CZ 4.3Å; Y307-Q388 HydrophobicContact CD1-CB 3.68Å; Y307-Q388 HydrophobicContact CD2-CB 4.27Å; Y307-Q388 HydrophobicContact CE1-CB 4.29Å; Y307-Q388 WeakPolarHBondContact CE1-O 3.45Å; Y307-Q388 HydrophobicContact CG-CB 3.65Å; Y307-T389 HydrophobicContact CD2-CG2 3.76Å; Y307-T389 HydrophobicContact CE2-CG2 3.62Å
308R95.8Very high95.5Very high143 Ų14362.8 Ų62.854%0.5429%0.294SS..Hα-helixtrans-58.7-45.5176.9-72170.3178.7-179.4-1.8111.5K304 L305 L312K304-R308 VanDerWaalsContact O-CG 3.31Å; K304-R308 WeakPolarHBondContact O-CG 3.29Å; K304-R308 PolarHBondContact O-N 3.25Å; K304-R308 VanDerWaalsContact O-N 3.12Å; L305-R308 PolarHBondContact O-N 3.42Å; R308-L312 VanDerWaalsContact O-CG 3.29Å; R308-L312 WeakPolarHBondContact O-CG 3.3Å; R308-L312 PolarHBondContact O-N 3.5Å
309Q95.6Very high95.2Very high127 Ų12764.2 Ų64.259%0.59331%0.308SS*.Hα-helixtrans-65.2-43.1177.2-68.9176.4300111.9L305 A306 Y307 L312 R313L305-Q309 WeakPolarHBondContact O-CG 3.36Å; L305-Q309 PolarHBondContact O-N 3.37Å; A306-Q309 PolarHBondContact O-N 2.93Å; Y307-Q309 VanDerWaalsContact C-N 3.33Å; Y307-Q309 PolarHBondContact O-N 3.42Å; Q309-L312 PolarHBondContact O-N 3.23Å; Q309-R313 WeakPolarHBondContact O-CG 3.48Å; Q309-R313 PolarHBondContact O-N 3.32Å
310F95.7Very high94.6Very high10 Ų1069.3 Ų69.34%0.04434%0.34CS..Hα-helixtrans-63.3-46.6177.8-172.3-126000111.5A306 Y307 L312 R313 V314 I336 L342 F385A306-F310 WeakPolarHBondContact O-CB 3.38Å; A306-F310 PolarHBondContact O-N 2.9Å; Y307-F310 PolarHBondContact O-N 2.87Å; F310-L312 VanDerWaalsContact C-N 3.32Å; F310-L312 PolarHBondContact O-N 2.98Å; F310-R313 PolarHBondContact O-N 2.86Å; F310-R313 VanDerWaalsContact O-N 3.11Å; F310-V314 HydrophobicContact CD1-CG2 4.39Å; F310-V314 HydrophobicContact CD2-CG2 4.16Å; F310-V314 HydrophobicContact CE1-CG2 4.17Å; F310-V314 HydrophobicContact CE2-CG2 3.93Å; F310-V314 HydrophobicContact CG-CG2 4.41Å; F310-V314 HydrophobicContact CZ-CG2 3.94Å; F310-V314 WeakPolarHBondContact O-CG2 3.43Å; F310-V314 PolarHBondContact O-N 3.2Å; F310-I336 HydrophobicContact CD1-CB 4.42Å; F310-I336 HydrophobicContact CD1-CD1 4.31Å; F310-I336 HydrophobicContact CD1-CG1 3.81Å; F310-I336 HydrophobicContact CD1-CG2 3.93Å; F310-I336 HydrophobicContact CE1-CB 4.11Å; F310-I336 HydrophobicContact CE1-CG1 3.7Å; F310-I336 HydrophobicContact CE1-CG2 3.84Å; F310-L342 HydrophobicContact CE2-CB 4.37Å; F310-L342 HydrophobicContact CZ-CB 4.05Å; F310-L342 HydrophobicContact CZ-CD1 4.49Å; F310-F385 HydrophobicContact CB-CZ 4.43Å; F310-F385 AromaticContact CD1-CZ 3.85Å; F310-F385 HydrophobicContact CD1-CZ 3.85Å; F310-F385 HydrophobicContact CG-CZ 4.4Å
311K95.1Very high94Very high56 Ų5673.7 Ų73.724%0.24337%0.371CS..Hα-helixtrans-57.3-44.3176-171.7176.7-178.9179.10111.8Y307 V314 K315 E329 V332 I336Y307-K311 HydrophobicContact CE1-CD 4.23Å; Y307-K311 VanDerWaalsContact O-CB 3.3Å; Y307-K311 WeakPolarHBondContact O-CB 3.47Å; Y307-K311 PolarHBondContact O-N 3.01Å; K311-V314 PolarHBondContact O-N 3.49Å; K311-K315 VanDerWaalsContact O-CB 3.27Å; K311-K315 WeakPolarHBondContact O-CB 3.25Å; K311-K315 PolarHBondContact O-N 2.97Å; K311-E329 WeakPolarHBondContact CE-OE2 3.02Å; K311-E329 IonicContact NZ-OE2 2.74Å; K311-E329 PolarHBondContact NZ-OE2 3.4Å; K311-V332 HydrophobicContact CG-CG1 3.78Å; K311-I336 HydrophobicContact CB-CD1 3.94Å; K311-I336 HydrophobicContact CG-CD1 4.03Å
312L94.9Very high93.4Very high105 Ų10571.5 Ų71.555%0.5536%0.361SS..Hα-helixtrans-63.8-40.6175.7-73.2172000112.7R308 Q309 F310 K316R308-L312 VanDerWaalsContact O-CG 3.29Å; R308-L312 WeakPolarHBondContact O-CG 3.3Å; R308-L312 PolarHBondContact O-N 3.5Å; Q309-L312 PolarHBondContact O-N 3.23Å; F310-L312 VanDerWaalsContact C-N 3.32Å; F310-L312 PolarHBondContact O-N 2.98Å; L312-K316 WeakPolarHBondContact O-CG 3.46Å; L312-K316 PolarHBondContact O-N 2.91Å; L312-K316 VanDerWaalsContact O-N 3.14Å
313R94.5Very high92.3Very high148 Ų14879.4 Ų79.456%0.55840%0.401SS*.Hα-helixtrans-63.2-51.2175.9-74.3-169.6-66.7129.1-11.7111.2Q309 F310 K315 K316 T317Q309-R313 WeakPolarHBondContact O-CG 3.48Å; Q309-R313 PolarHBondContact O-N 3.32Å; F310-R313 PolarHBondContact O-N 2.86Å; F310-R313 VanDerWaalsContact O-N 3.11Å; R313-K315 VanDerWaalsContact C-N 3.33Å; R313-K315 PolarHBondContact O-N 2.9Å; R313-K316 PolarHBondContact O-N 3Å; R313-T317 PolarHBondContact O-N 2.89Å; R313-T317 PolarHBondContact O-OG1 2.62Å; R313-T317 VanDerWaalsContact O-OG1 3.13Å
314V94.6Very high91.1Very high9 Ų981.2 Ų81.26%0.05542%0.42CS..Hα-helixtrans-59.4-44.4179.1174.40000110.8F310 K311 K316 T317 L318 V332 Y335 I336F310-V314 HydrophobicContact CD1-CG2 4.39Å; F310-V314 HydrophobicContact CD2-CG2 4.16Å; F310-V314 HydrophobicContact CE1-CG2 4.17Å; F310-V314 HydrophobicContact CE2-CG2 3.93Å; F310-V314 HydrophobicContact CG-CG2 4.41Å; F310-V314 HydrophobicContact CZ-CG2 3.94Å; F310-V314 WeakPolarHBondContact O-CG2 3.43Å; F310-V314 PolarHBondContact O-N 3.2Å; K311-V314 PolarHBondContact O-N 3.49Å; V314-K316 VanDerWaalsContact C-N 3.35Å; V314-K316 PolarHBondContact O-N 3.48Å; V314-T317 PolarHBondContact O-N 2.92Å; V314-T317 VanDerWaalsContact O-N 3.15Å; V314-L318 HydrophobicContact CG1-CD1 3.52Å; V314-L318 HydrophobicContact CG1-CG 4.07Å; V314-L318 WeakPolarHBondContact O-CB 3.45Å; V314-L318 WeakPolarHBondContact O-CG 3.4Å; V314-L318 PolarHBondContact O-N 3.4Å; V314-V332 HydrophobicContact CB-CG1 4.21Å; V314-V332 HydrophobicContact CG1-CB 4.32Å; V314-V332 HydrophobicContact CG1-CG1 3.89Å; V314-V332 HydrophobicContact CG1-CG2 4.24Å; V314-Y335 HydrophobicContact CB-CD1 4.31Å; V314-Y335 HydrophobicContact CG1-CD1 3.44Å; V314-Y335 VanDerWaalsContact CG1-CD1 3.44Å; V314-Y335 HydrophobicContact CG1-CE1 4.12Å; V314-Y335 HydrophobicContact CG1-CG 3.98Å; V314-Y335 HydrophobicContact CG2-CD1 3.81Å; V314-Y335 HydrophobicContact CG2-CE1 3.88Å; V314-I336 HydrophobicContact CB-CG1 4.46Å; V314-I336 HydrophobicContact CG1-CG1 4.43Å; V314-I336 HydrophobicContact CG2-CG1 4.12Å
315K94.3Very high90.2Very high78 Ų7885.3 Ų85.334%0.33945%0.451SS..Hα-helixtrans-57.8-44176.5-176.3173.2179.2169.30112.8K311 R313 T317 S319 L328 E329 V332K311-K315 VanDerWaalsContact O-CB 3.27Å; K311-K315 WeakPolarHBondContact O-CB 3.25Å; K311-K315 PolarHBondContact O-N 2.97Å; R313-K315 VanDerWaalsContact C-N 3.33Å; R313-K315 PolarHBondContact O-N 2.9Å; K315-T317 VanDerWaalsContact C-N 3.34Å; K315-S319 WeakPolarHBondContact O-CB 3.44Å; K315-S319 PolarHBondContact O-N 3.48Å; K315-L328 HydrophobicContact CG-CD2 4.24Å; K315-E329 WeakPolarHBondContact CE-OE1 3.34Å; K315-E329 IonicContact NZ-OE1 2.81Å; K315-E329 PolarHBondContact NZ-OE1 3.26Å; K315-V332 HydrophobicContact CB-CG2 3.91Å; K315-V332 HydrophobicContact CG-CG2 4.33Å
316K93.8Very high89.3Confident162 Ų16284.2 Ų84.270%0.70444%0.443SS*.Hα-helixtrans-65.6-36176.8-73.5177.6179.3-176.40112.6L312 R313 V314 S319 P320L312-K316 WeakPolarHBondContact O-CG 3.46Å; L312-K316 PolarHBondContact O-N 2.91Å; L312-K316 VanDerWaalsContact O-N 3.14Å; R313-K316 PolarHBondContact O-N 3Å; V314-K316 VanDerWaalsContact C-N 3.35Å; V314-K316 PolarHBondContact O-N 3.48Å; K316-S319 PolarHBondContact O-OG 3.35Å; K316-P320 WeakPolarHBondContact O-CD 3.42Å
317T91.4Very high88.9Confident104 Ų10486.5 Ų86.564%0.63846%0.455SS*.Hα-helixtrans-74.6-37.4179.2-56.50000112.1R313 V314 K315 P320R313-T317 PolarHBondContact O-N 2.89Å; R313-T317 PolarHBondContact O-OG1 2.62Å; R313-T317 VanDerWaalsContact O-OG1 3.13Å; V314-T317 PolarHBondContact O-N 2.92Å; V314-T317 VanDerWaalsContact O-N 3.15Å; K315-T317 VanDerWaalsContact C-N 3.34Å; T317-P320 WeakPolarHBondContact O-CD 3.39Å
318L90.4Very high88.4Confident43 Ų4387.3 Ų87.323%0.22546%0.461CS..Hα-helixtrans-84.3-25.1-178.1-67.4179.1000113.5V314 P320 S321 H322 L328 V332 Y335V314-L318 HydrophobicContact CG1-CD1 3.52Å; V314-L318 HydrophobicContact CG1-CG 4.07Å; V314-L318 WeakPolarHBondContact O-CB 3.45Å; V314-L318 WeakPolarHBondContact O-CG 3.4Å; V314-L318 PolarHBondContact O-N 3.4Å; L318-P320 VanDerWaalsContact C-CD 3.41Å; L318-S321 PolarHBondContact O-N 3.04Å; L318-S321 VanDerWaalsContact O-N 3.12Å; L318-H322 WeakPolarHBondContact O-CB 3.32Å; L318-H322 PolarHBondContact O-N 3.49Å; L318-H322 VanDerWaalsContact O-N 3.12Å; L318-L328 HydrophobicContact CB-CD1 4.3Å; L318-V332 HydrophobicContact CD1-CG2 4.01Å; L318-Y335 HydrophobicContact CD1-CG 4.21Å
319S90.5Very high88.1Confident64 Ų6483.6 Ų83.645%0.44845%0.45SS..THydrogen-bonded Turntrans-55.1-39.1-176.866.10000115.2K315 K316 S321K315-S319 WeakPolarHBondContact O-CB 3.44Å; K315-S319 PolarHBondContact O-N 3.48Å; K316-S319 PolarHBondContact O-OG 3.35Å; S319-S321 VanDerWaalsContact C-N 3.34Å
320P86.3Confident87.7Confident106 Ų10680.1 Ų80.169%0.68844%0.435SS*.THydrogen-bonded Turntrans-74.8-22.5-179.7-14.532.2000113.6K316 T317 L318K316-P320 WeakPolarHBondContact O-CD 3.42Å; T317-P320 WeakPolarHBondContact O-CD 3.39Å; L318-P320 VanDerWaalsContact C-CD 3.41Å
321S83.6Confident87.4Confident94 Ų9481.1 Ų81.166%0.65744%0.444SS*.THydrogen-bonded Turntrans-104.7-0.6-173.9-55.60000113.3L318 S319 L323L318-S321 PolarHBondContact O-N 3.04Å; L318-S321 VanDerWaalsContact O-N 3.12Å; S319-S321 VanDerWaalsContact C-N 3.34Å; S321-L323 PolarHBondContact O-N 3.34Å
322H84.3Confident87.2Confident56 Ų5678.4 Ų78.426%0.25943%0.432SS..  trans-78.5104.4-175.8-175.4-83.1000111.7L318 E326 L328 S331L318-H322 WeakPolarHBondContact O-CB 3.32Å; L318-H322 PolarHBondContact O-N 3.49Å; L318-H322 VanDerWaalsContact O-N 3.12Å; H322-E326 PolarHBondContact CE1-O 3.18Å; H322-E326 PolarHBondContact NE2-O 3.44Å; H322-E326 VanDerWaalsContact NE2-O 3.13Å; H322-L328 HydrophobicContact CB-CD1 3.88Å; H322-S331 PolarHBondContact CD2-OG 3.34Å; H322-S331 PolarHBondContact NE2-OG 2.82Å
323L75.4Confident87Confident176 Ų17674.5 Ų74.592%0.92141%0.412SS*.  trans-121.412.5174.6-67.1168.3000112.3S321S321-L323 PolarHBondContact O-N 3.34Å
324G71.7Confident86.8Confident39 Ų3968.5 Ų68.540%0.40239%0.391SS..SBendtrans-79.2160.3-173.900000113.9E326G324-E326 VanDerWaalsContact C-N 3.25Å
325P76.5Confident86.7Confident129 Ų12972.4 Ų72.484%0.83841%0.406SS*.SBendtrans-71.8-18.8172.230.8-34.9000113.1
326E78.4Confident86.6Confident74 Ų7468.7 Ų68.735%0.34639%0.39SS..SBendtrans-77.2162.2177-60.8-169.4-162.600111.4T246 H322 G324T246-E326 WeakPolarHBondContact CG2-OE2 3.4Å; T246-E326 PolarHBondContact OG1-OE2 3.38Å; H322-E326 PolarHBondContact CE1-O 3.18Å; H322-E326 PolarHBondContact NE2-O 3.44Å; H322-E326 VanDerWaalsContact NE2-O 3.13Å; G324-E326 VanDerWaalsContact C-N 3.25Å
327T86.8Confident86.5Confident65 Ų6562 Ų6240%0.39936%0.363SS..  trans-71.5152.817578.40000110.7E329 D330 S331T327-E329 PolarHBondContact O-N 2.91Å; T327-D330 WeakPolarHBondContact CB-OD2 3.49Å; T327-D330 PolarHBondContact O-N 3.19Å; T327-D330 PolarHBondContact OG1-N 2.88Å; T327-D330 VanDerWaalsContact OG1-N 3.16Å; T327-D330 PolarHBondContact OG1-OD2 3.46Å; T327-S331 PolarHBondContact O-N 3.32Å; T327-S331 PolarHBondContact O-OG 3.5Å
328L87.9Confident86.5Confident46 Ų4664.7 Ų64.724%0.24136%0.361CS..Hα-helixtrans-58.5-34.6175.4177.664.6000111.5K315 L318 H322 V332K315-L328 HydrophobicContact CG-CD2 4.24Å; L318-L328 HydrophobicContact CB-CD1 4.3Å; H322-L328 HydrophobicContact CB-CD1 3.88Å; L328-V332 HydrophobicContact CD1-CG2 4.39Å; L328-V332 WeakPolarHBondContact O-CB 3.34Å; L328-V332 WeakPolarHBondContact O-CG2 3.35Å; L328-V332 PolarHBondContact O-N 2.93Å
329E88Confident86.6Confident65 Ų6564.7 Ų64.730%0.30436%0.361SS..Hα-helixtrans-67.4-42.4177.7-70.9-65.8148.700111.6K311 K315 T327 V332 V333K311-E329 WeakPolarHBondContact CE-OE2 3.02Å; K311-E329 IonicContact NZ-OE2 2.74Å; K311-E329 PolarHBondContact NZ-OE2 3.4Å; K315-E329 WeakPolarHBondContact CE-OE1 3.34Å; K315-E329 IonicContact NZ-OE1 2.81Å; K315-E329 PolarHBondContact NZ-OE1 3.26Å; T327-E329 PolarHBondContact O-N 2.91Å; E329-V332 PolarHBondContact O-N 3.41Å; E329-V333 WeakPolarHBondContact O-CG2 3.28Å; E329-V333 PolarHBondContact O-N 3.43Å
330D87.4Confident86.5Confident53 Ų5364.4 Ų64.428%0.28335%0.354SS..Hα-helixtrans-65.4-42177.5-61.2-38.1000111.2T327 V332 V333 D334T327-D330 WeakPolarHBondContact CB-OD2 3.49Å; T327-D330 PolarHBondContact O-N 3.19Å; T327-D330 PolarHBondContact OG1-N 2.88Å; T327-D330 VanDerWaalsContact OG1-N 3.16Å; T327-D330 PolarHBondContact OG1-OD2 3.46Å; D330-V332 VanDerWaalsContact C-N 3.32Å; D330-V332 PolarHBondContact O-N 3.46Å; D330-V333 PolarHBondContact O-N 3.08Å; D330-D334 WeakPolarHBondContact O-CB 3.38Å; D330-D334 PolarHBondContact O-N 2.93Å
331S88.9Confident86.8Confident31 Ų3165.5 Ų65.522%0.21735%0.354CS..Hα-helixtrans-61.4-39.6174.9-66.70000112.4H322 T327 Y335H322-S331 PolarHBondContact CD2-OG 3.34Å; H322-S331 PolarHBondContact NE2-OG 2.82Å; T327-S331 PolarHBondContact O-N 3.32Å; T327-S331 PolarHBondContact O-OG 3.5Å; S331-Y335 WeakPolarHBondContact O-CB 3.32Å; S331-Y335 PolarHBondContact O-N 3.15Å
332V91.8Very high87.2Confident0 Ų065 Ų650%034%0.344CS..Hα-helixtrans-65.6-45.1175.8166.70000110.7K311 V314 K315 L318 L328 E329 D330 Y335 I336K311-V332 HydrophobicContact CG-CG1 3.78Å; V314-V332 HydrophobicContact CB-CG1 4.21Å; V314-V332 HydrophobicContact CG1-CB 4.32Å; V314-V332 HydrophobicContact CG1-CG1 3.89Å; V314-V332 HydrophobicContact CG1-CG2 4.24Å; K315-V332 HydrophobicContact CB-CG2 3.91Å; K315-V332 HydrophobicContact CG-CG2 4.33Å; L318-V332 HydrophobicContact CD1-CG2 4.01Å; L328-V332 HydrophobicContact CD1-CG2 4.39Å; L328-V332 WeakPolarHBondContact O-CB 3.34Å; L328-V332 WeakPolarHBondContact O-CG2 3.35Å; L328-V332 PolarHBondContact O-N 2.93Å; E329-V332 PolarHBondContact O-N 3.41Å; D330-V332 VanDerWaalsContact C-N 3.32Å; D330-V332 PolarHBondContact O-N 3.46Å; V332-Y335 PolarHBondContact O-N 3.09Å; V332-I336 HydrophobicContact CG1-CD1 3.84Å; V332-I336 WeakPolarHBondContact O-CD1 3.39Å; V332-I336 VanDerWaalsContact O-CG1 3.23Å; V332-I336 WeakPolarHBondContact O-CG1 3.22Å; V332-I336 PolarHBondContact O-N 2.94Å
333V90.9Very high87.7Confident23 Ų2363.4 Ų63.414%0.13934%0.336CS..Hα-helixtrans-65-45.3178.6173.20000110.8A248 E329 D330 Y335 I336 V337A248-V333 HydrophobicContact CB-CG1 4.33Å; E329-V333 WeakPolarHBondContact O-CG2 3.28Å; E329-V333 PolarHBondContact O-N 3.43Å; D330-V333 PolarHBondContact O-N 3.08Å; V333-Y335 VanDerWaalsContact C-N 3.32Å; V333-Y335 PolarHBondContact O-N 3.43Å; V333-I336 PolarHBondContact O-N 2.96Å; V333-I336 VanDerWaalsContact O-N 3.16Å; V333-V337 HydrophobicContact CG1-CG2 4.21Å; V333-V337 WeakPolarHBondContact O-CB 3.45Å; V333-V337 VanDerWaalsContact O-CG2 3.28Å; V333-V337 WeakPolarHBondContact O-CG2 3.43Å; V333-V337 PolarHBondContact O-N 3.45Å
334D90Very high88.7Confident22 Ų2259.5 Ų59.512%0.11832%0.316CS..Hα-helixtrans-61.1-41.6177.4-162.366.3000111.5T246 A248 D330 I336 V337 R338T246-D334 HydrophobicContact CG2-CB 3.75Å; A248-D334 HydrophobicContact CB-CB 4.44Å; A248-D334 PolarHBondContact N-OD1 3.04Å; D330-D334 WeakPolarHBondContact O-CB 3.38Å; D330-D334 PolarHBondContact O-N 2.93Å; D334-I336 PolarHBondContact O-N 3.03Å; D334-V337 PolarHBondContact O-N 2.94Å; D334-R338 WeakPolarHBondContact O-CB 3.45Å; D334-R338 WeakPolarHBondContact O-CD 3.26Å; D334-R338 WeakPolarHBondContact O-CG 3.36Å; D334-R338 PolarHBondContact O-N 3.33Å; D334-R338 VanDerWaalsContact OD2-CD 3.26Å; D334-R338 WeakPolarHBondContact OD2-CD 3.45Å; D334-R338 IonicContact OD2-NH1 2.67Å
335Y91.8Very high89.8Confident90 Ų9058.5 Ų58.535%0.35330%0.302SS..Hα-helixtrans-59-47.5173.8-178.2-87.8000112V314 L318 S331 V332 V333 R338 N339V314-Y335 HydrophobicContact CB-CD1 4.31Å; V314-Y335 HydrophobicContact CG1-CD1 3.44Å; V314-Y335 VanDerWaalsContact CG1-CD1 3.44Å; V314-Y335 HydrophobicContact CG1-CE1 4.12Å; V314-Y335 HydrophobicContact CG1-CG 3.98Å; V314-Y335 HydrophobicContact CG2-CD1 3.81Å; V314-Y335 HydrophobicContact CG2-CE1 3.88Å; L318-Y335 HydrophobicContact CD1-CG 4.21Å; S331-Y335 WeakPolarHBondContact O-CB 3.32Å; S331-Y335 PolarHBondContact O-N 3.15Å; V332-Y335 PolarHBondContact O-N 3.09Å; V333-Y335 VanDerWaalsContact C-N 3.32Å; V333-Y335 PolarHBondContact O-N 3.43Å; Y335-R338 PolarHBondContact O-N 3.3Å; Y335-N339 HydrophobicContact CE1-CB 4.45Å; Y335-N339 WeakPolarHBondContact O-CB 3.41Å; Y335-N339 PolarHBondContact O-N 3.14Å; Y335-N339 VanDerWaalsContact O-N 3.12Å; Y335-N339 PolarHBondContact O-ND2 3.19Å
336I93.3Very high90.8Very high1 Ų156 Ų561%0.00528%0.279CS..Hα-helixtrans-63.2-45.4-179.7-67.3164.2000110.9Y307 F310 K311 V314 V332 V333 D334 R338 N339 L340 T389Y307-I336 HydrophobicContact CD2-CG2 4.46Å; Y307-I336 HydrophobicContact CE2-CD1 3.99Å; Y307-I336 HydrophobicContact CE2-CG2 4.05Å; F310-I336 HydrophobicContact CD1-CB 4.42Å; F310-I336 HydrophobicContact CD1-CD1 4.31Å; F310-I336 HydrophobicContact CD1-CG1 3.81Å; F310-I336 HydrophobicContact CD1-CG2 3.93Å; F310-I336 HydrophobicContact CE1-CB 4.11Å; F310-I336 HydrophobicContact CE1-CG1 3.7Å; F310-I336 HydrophobicContact CE1-CG2 3.84Å; K311-I336 HydrophobicContact CB-CD1 3.94Å; K311-I336 HydrophobicContact CG-CD1 4.03Å; V314-I336 HydrophobicContact CB-CG1 4.46Å; V314-I336 HydrophobicContact CG1-CG1 4.43Å; V314-I336 HydrophobicContact CG2-CG1 4.12Å; V332-I336 HydrophobicContact CG1-CD1 3.84Å; V332-I336 WeakPolarHBondContact O-CD1 3.39Å; V332-I336 VanDerWaalsContact O-CG1 3.23Å; V332-I336 WeakPolarHBondContact O-CG1 3.22Å; V332-I336 PolarHBondContact O-N 2.94Å; V333-I336 PolarHBondContact O-N 2.96Å; V333-I336 VanDerWaalsContact O-N 3.16Å; D334-I336 PolarHBondContact O-N 3.03Å; I336-R338 PolarHBondContact O-N 2.92Å; I336-N339 CarbonylContact O-C 3.45Å; I336-N339 PolarHBondContact O-N 3.1Å; I336-N339 VanDerWaalsContact O-N 3.12Å; I336-L340 PolarHBondContact O-N 3.15Å; I336-T389 HydrophobicContact CG2-CG2 3.69Å
337V91.7Very high91.6Very high22 Ų2254.4 Ų54.413%0.13328%0.279CS..Hα-helixtrans-62.8-32.3-179.3169.40000111.9A248 R255 V333 D334A248-V337 HydrophobicContact CB-CG2 4.32Å; R255-V337 VanDerWaalsContact NH1-CG1 3.27Å; V333-V337 HydrophobicContact CG1-CG2 4.21Å; V333-V337 WeakPolarHBondContact O-CB 3.45Å; V333-V337 VanDerWaalsContact O-CG2 3.28Å; V333-V337 WeakPolarHBondContact O-CG2 3.43Å; V333-V337 PolarHBondContact O-N 3.45Å; D334-V337 PolarHBondContact O-N 2.94Å
338R89.9Confident92.1Very high159 Ų15951.4 Ų51.460%0.626%0.26SS*.Hα-helixtrans-79-22.5176.8-68.8171.578.6135.33.6113.8D334 Y335 I336D334-R338 WeakPolarHBondContact O-CB 3.45Å; D334-R338 WeakPolarHBondContact O-CD 3.26Å; D334-R338 WeakPolarHBondContact O-CG 3.36Å; D334-R338 PolarHBondContact O-N 3.33Å; D334-R338 VanDerWaalsContact OD2-CD 3.26Å; D334-R338 WeakPolarHBondContact OD2-CD 3.45Å; D334-R338 IonicContact OD2-NH1 2.67Å; Y335-R338 PolarHBondContact O-N 3.3Å; I336-R338 PolarHBondContact O-N 2.92Å
339N92.5Very high92.6Very high44 Ų4449.3 Ų49.324%0.23525%0.249CC..THydrogen-bonded Turntrans-123.344.4-174.1-59.8-85.6000111.5Y335 I336 D341 L342Y335-N339 HydrophobicContact CE1-CB 4.45Å; Y335-N339 WeakPolarHBondContact O-CB 3.41Å; Y335-N339 PolarHBondContact O-N 3.14Å; Y335-N339 VanDerWaalsContact O-N 3.12Å; Y335-N339 PolarHBondContact O-ND2 3.19Å; I336-N339 CarbonylContact O-C 3.45Å; I336-N339 PolarHBondContact O-N 3.1Å; I336-N339 VanDerWaalsContact O-N 3.12Å; N339-D341 VanDerWaalsContact CA-OD1 3.26Å; N339-D341 WeakPolarHBondContact CA-OD1 3.43Å; N339-D341 PolarHBondContact O-N 3.34Å; N339-L342 HydrophobicContact CB-CD1 3.7Å; N339-L342 HydrophobicContact CB-CG 3.97Å; N339-L342 WeakPolarHBondContact O-CB 3.5Å; N339-L342 PolarHBondContact O-N 2.88Å
340L90.4Very high93Very high58 Ų5850.5 Ų50.530%0.30426%0.258SS..G310 helixtrans-63.1-23.1177.5-71.5173.7000112.6I336 L342 Y343 F385 T389I336-L340 PolarHBondContact O-N 3.15Å; L340-L342 VanDerWaalsContact C-N 3.27Å; L340-L342 PolarHBondContact O-N 3.22Å; L340-Y343 VanDerWaalsContact O-CB 3.25Å; L340-Y343 WeakPolarHBondContact O-CB 3.47Å; L340-Y343 PolarHBondContact O-N 3.2Å; L340-F385 HydrophobicContact CD2-CD1 4.25Å; L340-F385 HydrophobicContact CD2-CE1 4.04Å; L340-T389 HydrophobicContact CD2-CG2 3.84Å
341D90.9Very high93.4Very high129 Ų12952.5 Ų52.569%0.6927%0.268SS*.G310 helixtrans-67.6-22.8175.761.8-51.4000113.4N339 Y343N339-D341 VanDerWaalsContact CA-OD1 3.26Å; N339-D341 WeakPolarHBondContact CA-OD1 3.43Å; N339-D341 PolarHBondContact O-N 3.34Å; D341-Y343 PolarHBondContact O-N 2.82Å
342L92.4Very high93.8Very high83 Ų8351 Ų5144%0.43526%0.258SS..G310 helixtrans-73.9-3.4173.9-61.2-177.4000113.3F310 N339 L340 D344F310-L342 HydrophobicContact CE2-CB 4.37Å; F310-L342 HydrophobicContact CZ-CB 4.05Å; F310-L342 HydrophobicContact CZ-CD1 4.49Å; N339-L342 HydrophobicContact CB-CD1 3.7Å; N339-L342 HydrophobicContact CB-CG 3.97Å; N339-L342 WeakPolarHBondContact O-CB 3.5Å; N339-L342 PolarHBondContact O-N 2.88Å; L340-L342 VanDerWaalsContact C-N 3.27Å; L340-L342 PolarHBondContact O-N 3.22Å; L342-D344 PolarHBondContact O-N 3.08Å
343Y95.2Very high93.9Very high22 Ų2251.7 Ų51.79%0.08626%0.262CS..  trans-67.6116.8173.8173.3-141.7000110.6A306 L340 D341 V345 S348 F385A306-Y343 HydrophobicContact CB-CE2 3.82Å; L340-Y343 VanDerWaalsContact O-CB 3.25Å; L340-Y343 WeakPolarHBondContact O-CB 3.47Å; L340-Y343 PolarHBondContact O-N 3.2Å; D341-Y343 PolarHBondContact O-N 2.82Å; Y343-V345 VanDerWaalsContact C-N 3.29Å; Y343-V345 HydrophobicContact CD1-CB 4.48Å; Y343-V345 HydrophobicContact CD1-CG2 3.46Å; Y343-V345 VanDerWaalsContact CD1-CG2 3.46Å; Y343-V345 HydrophobicContact CE1-CB 4.22Å; Y343-V345 HydrophobicContact CE1-CG1 4.49Å; Y343-V345 HydrophobicContact CE1-CG2 3.57Å; Y343-V345 HydrophobicContact CG-CG2 4.17Å; Y343-V345 PolarHBondContact O-N 2.9Å; Y343-S348 WeakPolarHBondContact CE2-OG 3.49Å; Y343-S348 WeakPolarHBondContact OH-CB 3.31Å; Y343-S348 PolarHBondContact OH-OG 3.49Å; Y343-F385 HydrophobicContact CD1-CB 3.64Å; Y343-F385 AromaticContact CD1-CD1 3.79Å; Y343-F385 HydrophobicContact CD1-CD1 3.79Å; Y343-F385 AromaticContact CD1-CD2 3.96Å; Y343-F385 HydrophobicContact CD1-CD2 3.96Å; Y343-F385 HydrophobicContact CD1-CE1 4.43Å; Y343-F385 AromaticContact CD1-CG 3.52Å; Y343-F385 HydrophobicContact CD1-CG 3.52Å; Y343-F385 HydrophobicContact CD2-CD1 4.4Å; Y343-F385 AromaticContact CD2-CD2 3.5Å; Y343-F385 HydrophobicContact CD2-CD2 3.5Å; Y343-F385 HydrophobicContact CD2-CE1 4.46Å; Y343-F385 AromaticContact CD2-CE2 3.54Å; Y343-F385 HydrophobicContact CD2-CE2 3.54Å; Y343-F385 AromaticContact CD2-CG 3.95Å; Y343-F385 HydrophobicContact CD2-CG 3.95Å; Y343-F385 HydrophobicContact CD2-CZ 4.04Å; Y343-F385 HydrophobicContact CE1-CB 3.37Å; Y343-F385 HydrophobicContact CE1-CD1 4.39Å; Y343-F385 AromaticContact CE1-CD2 3.98Å; Y343-F385 HydrophobicContact CE1-CD2 3.98Å; Y343-F385 AromaticContact CE1-CG 3.68Å; Y343-F385 HydrophobicContact CE1-CG 3.68Å; Y343-F385 HydrophobicContact CE2-CB 4.48Å; Y343-F385 AromaticContact CE2-CD2 3.56Å; Y343-F385 HydrophobicContact CE2-CD2 3.56Å; Y343-F385 AromaticContact CE2-CE2 3.97Å; Y343-F385 HydrophobicContact CE2-CE2 3.97Å; Y343-F385 HydrophobicContact CE2-CG 4.13Å; Y343-F385 HydrophobicContact CG-CB 4.3Å; Y343-F385 AromaticContact CG-CD1 3.81Å; Y343-F385 HydrophobicContact CG-CD1 3.81Å; Y343-F385 AromaticContact CG-CD2 3.74Å; Y343-F385 HydrophobicContact CG-CD2 3.74Å; Y343-F385 AromaticContact CG-CE1 3.99Å; Y343-F385 HydrophobicContact CG-CE1 3.99Å; Y343-F385 AromaticContact CG-CE2 3.9Å; Y343-F385 HydrophobicContact CG-CE2 3.9Å; Y343-F385 AromaticContact CG-CG 3.68Å; Y343-F385 HydrophobicContact CG-CG 3.68Å; Y343-F385 HydrophobicContact CG-CZ 4.03Å; Y343-F385 AromaticContact CZ-CD2 3.8Å; Y343-F385 AromaticContact CZ-CG 3.99Å
344D95.4Very high94.1Very high95 Ų9555.3 Ų55.351%0.50828%0.28SS..  trans-74.583.3171.7-172.3-6.1000111L342 Q346 A347L342-D344 PolarHBondContact O-N 3.08Å; D344-Q346 PolarHBondContact O-N 3.33Å; D344-Q346 WeakPolarHBondContact OD1-CB 3.36Å; D344-Q346 PolarHBondContact OD1-N 3.5Å; D344-A347 HydrophobicContact CB-CB 4.29Å; D344-A347 PolarHBondContact O-N 2.95Å; D344-A347 PolarHBondContact OD1-N 2.94Å
345V96.4Very high94.3Very high18 Ų1855.6 Ų55.611%0.10929%0.286CS..Hα-helixtrans-61.3-28.7176.2-174.10000111.1Y343 S348 V349 R378 C381 R382Y343-V345 VanDerWaalsContact C-N 3.29Å; Y343-V345 HydrophobicContact CD1-CB 4.48Å; Y343-V345 HydrophobicContact CD1-CG2 3.46Å; Y343-V345 VanDerWaalsContact CD1-CG2 3.46Å; Y343-V345 HydrophobicContact CE1-CB 4.22Å; Y343-V345 HydrophobicContact CE1-CG1 4.49Å; Y343-V345 HydrophobicContact CE1-CG2 3.57Å; Y343-V345 HydrophobicContact CG-CG2 4.17Å; Y343-V345 PolarHBondContact O-N 2.9Å; V345-S348 PolarHBondContact O-N 3.42Å; V345-V349 HydrophobicContact CG1-CG2 4.12Å; V345-V349 WeakPolarHBondContact O-CG2 3.47Å; V345-V349 PolarHBondContact O-N 3.08Å; V345-R378 HydrophobicContact CG1-CB 4.37Å; V345-R378 HydrophobicContact CG1-CG 3.68Å; V345-C381 HydrophobicContact CG1-CB 4.13Å; V345-R382 HydrophobicContact CG1-CG 4.11Å; V345-R382 HydrophobicContact CG2-CG 3.64Å
346Q96.3Very high94.4Very high76 Ų7651.4 Ų51.436%0.35527%0.269SS..Hα-helixtrans-70.3-41.7-177.6-65.3-48.4-97.600112.8D344 S348 V349 N350 R378D344-Q346 PolarHBondContact O-N 3.33Å; D344-Q346 WeakPolarHBondContact OD1-CB 3.36Å; D344-Q346 PolarHBondContact OD1-N 3.5Å; Q346-S348 VanDerWaalsContact C-N 3.31Å; Q346-S348 PolarHBondContact O-N 2.83Å; Q346-V349 PolarHBondContact O-N 3.44Å; Q346-N350 VanDerWaalsContact O-CG 3.31Å; Q346-N350 PolarHBondContact O-N 3.44Å; Q346-N350 PolarHBondContact O-ND2 3.49Å; Q346-R378 VanDerWaalsContact CD-NH1 3.28Å
347A96.4Very high94.3Very high41 Ų4155.8 Ų55.834%0.33929%0.293SS..Hα-helixtrans-55.4-49.2172.200000111D344 V349 N350 D351D344-A347 HydrophobicContact CB-CB 4.29Å; D344-A347 PolarHBondContact O-N 2.95Å; D344-A347 PolarHBondContact OD1-N 2.94Å; A347-V349 PolarHBondContact O-N 2.98Å; A347-N350 PolarHBondContact O-N 3.36Å; A347-D351 PolarHBondContact O-N 3.21Å
348S97.3Very high94.3Very high2 Ų260.3 Ų60.31%0.01432%0.32CS..Hα-helixtrans-65-38.1178.7-62.30000113.7Y343 V345 Q346 N350 D351 V352Y343-S348 WeakPolarHBondContact CE2-OG 3.49Å; Y343-S348 WeakPolarHBondContact OH-CB 3.31Å; Y343-S348 PolarHBondContact OH-OG 3.49Å; V345-S348 PolarHBondContact O-N 3.42Å; Q346-S348 VanDerWaalsContact C-N 3.31Å; Q346-S348 PolarHBondContact O-N 2.83Å; S348-N350 VanDerWaalsContact C-N 3.31Å; S348-N350 PolarHBondContact O-N 2.82Å; S348-D351 PolarHBondContact O-N 3.38Å; S348-V352 VanDerWaalsContact O-CG2 3.25Å; S348-V352 WeakPolarHBondContact O-CG2 3.42Å; S348-V352 PolarHBondContact O-N 2.76Å
349V97.4Very high94.3Very high2 Ų254.1 Ų54.11%0.01230%0.299CS..Hα-helixtrans-60.3-43.5175.3166.60000110.9V345 Q346 A347 V352 I353 N374 I377 R378V345-V349 HydrophobicContact CG1-CG2 4.12Å; V345-V349 WeakPolarHBondContact O-CG2 3.47Å; V345-V349 PolarHBondContact O-N 3.08Å; Q346-V349 PolarHBondContact O-N 3.44Å; A347-V349 PolarHBondContact O-N 2.98Å; V349-V352 PolarHBondContact O-N 3.49Å; V349-I353 HydrophobicContact CG1-CD1 3.85Å; V349-I353 WeakPolarHBondContact O-CG1 3.43Å; V349-I353 PolarHBondContact O-N 3.12Å; V349-N374 WeakPolarHBondContact CG1-OD1 3.25Å; V349-I377 HydrophobicContact CB-CG2 4.42Å; V349-I377 HydrophobicContact CG1-CG2 4.3Å; V349-I377 HydrophobicContact CG2-CG2 4.08Å; V349-R378 HydrophobicContact CG2-CB 4.01Å
350N96.4Very high94.1Very high90 Ų9058.1 Ų58.148%0.48133%0.327SS..Hα-helixtrans-64.4-42.2177.8-67.4-25.8000111.4Q346 A347 S348 V352 I353 N354Q346-N350 VanDerWaalsContact O-CG 3.31Å; Q346-N350 PolarHBondContact O-N 3.44Å; Q346-N350 PolarHBondContact O-ND2 3.49Å; A347-N350 PolarHBondContact O-N 3.36Å; S348-N350 VanDerWaalsContact C-N 3.31Å; S348-N350 PolarHBondContact O-N 2.82Å; N350-V352 VanDerWaalsContact C-N 3.29Å; N350-V352 PolarHBondContact O-N 3.22Å; N350-I353 PolarHBondContact O-N 2.84Å; N350-N354 WeakPolarHBondContact O-CB 3.13Å; N350-N354 PolarHBondContact O-N 3.43Å; N350-N354 PolarHBondContact O-ND2 3.38Å; N350-N354 VanDerWaalsContact O-ND2 3.12Å
351D96.3Very high93.8Very high94 Ų9462.4 Ų62.450%0.50334%0.339SS..Hα-helixtrans-59-41.8175.3-67.5-23.4000111.6A302 A347 S348 N354 A355A302-D351 HydrophobicContact CB-CB 4.42Å; A347-D351 PolarHBondContact O-N 3.21Å; S348-D351 PolarHBondContact O-N 3.38Å; D351-N354 PolarHBondContact O-N 2.99Å; D351-A355 WeakPolarHBondContact O-CB 3.12Å; D351-A355 PolarHBondContact O-N 2.86Å
352V97.1Very high93.7Very high1 Ų157 Ų571%0.00631%0.31CS..Hα-helixtrans-63.9-49.2176.4173.40000111.5E298 A299 A302 S348 V349 N350 N354 A355 M356 I377E298-V352 HydrophobicContact CB-CG1 3.96Å; E298-V352 HydrophobicContact CB-CG2 4.39Å; A299-V352 HydrophobicContact CB-CG2 4.15Å; A302-V352 HydrophobicContact CB-CG2 3.75Å; S348-V352 VanDerWaalsContact O-CG2 3.25Å; S348-V352 WeakPolarHBondContact O-CG2 3.42Å; S348-V352 PolarHBondContact O-N 2.76Å; V349-V352 PolarHBondContact O-N 3.49Å; N350-V352 VanDerWaalsContact C-N 3.29Å; N350-V352 PolarHBondContact O-N 3.22Å; V352-N354 VanDerWaalsContact C-N 3.28Å; V352-N354 PolarHBondContact O-N 3.43Å; V352-A355 PolarHBondContact O-N 3.18Å; V352-A355 VanDerWaalsContact O-N 3.17Å; V352-M356 HydrophobicContact CG1-CG 4.22Å; V352-M356 HydrophobicContact CG1-SD 3.84Å; V352-M356 WeakPolarHBondContact O-CB 3.49Å; V352-M356 VanDerWaalsContact O-CG 3.27Å; V352-M356 WeakPolarHBondContact O-CG 3.29Å; V352-M356 PolarHBondContact O-N 3.02Å; V352-I377 HydrophobicContact CB-CG2 3.89Å; V352-I377 HydrophobicContact CG1-CD1 4.27Å; V352-I377 HydrophobicContact CG1-CG1 4.47Å; V352-I377 HydrophobicContact CG1-CG2 3.69Å; V352-I377 HydrophobicContact CG2-CG2 4.22Å
353I94.8Very high93.2Very high14 Ų1456.5 Ų56.57%0.07231%0.314CS..Hα-helixtrans-59.6-43.2179.5-69.3169.1000110.3V349 N350 A355 M356 N357 F370 V371 I377V349-I353 HydrophobicContact CG1-CD1 3.85Å; V349-I353 WeakPolarHBondContact O-CG1 3.43Å; V349-I353 PolarHBondContact O-N 3.12Å; N350-I353 PolarHBondContact O-N 2.84Å; I353-A355 PolarHBondContact O-N 3.33Å; I353-M356 PolarHBondContact O-N 2.98Å; I353-N357 WeakPolarHBondContact O-CB 3.37Å; I353-N357 PolarHBondContact O-N 3.49Å; I353-N357 PolarHBondContact O-ND2 3.03Å; I353-F370 HydrophobicContact CG2-CB 4.48Å; I353-V371 HydrophobicContact CD1-CG2 4.02Å; I353-I377 HydrophobicContact CG1-CD1 4.07Å
354N94.1Very high92.4Very high99 Ų9957 Ų5753%0.52932%0.317SS..Hα-helixtrans-61.7-43.6176.1-71-29.4000112.2N350 D351 V352 N357N350-N354 WeakPolarHBondContact O-CB 3.13Å; N350-N354 PolarHBondContact O-N 3.43Å; N350-N354 PolarHBondContact O-ND2 3.38Å; N350-N354 VanDerWaalsContact O-ND2 3.12Å; D351-N354 PolarHBondContact O-N 2.99Å; V352-N354 VanDerWaalsContact C-N 3.28Å; V352-N354 PolarHBondContact O-N 3.43Å; N354-N357 PolarHBondContact O-N 3.22Å
355A94.3Very high91.6Very high28 Ų2854.3 Ų54.323%0.23130%0.304CS..Hα-helixtrans-65.1-39.8176.900000112.2E298 D351 V352 I353 V358 N359E298-A355 HydrophobicContact CG-CB 4.21Å; D351-A355 WeakPolarHBondContact O-CB 3.12Å; D351-A355 PolarHBondContact O-N 2.86Å; V352-A355 PolarHBondContact O-N 3.18Å; V352-A355 VanDerWaalsContact O-N 3.17Å; I353-A355 PolarHBondContact O-N 3.33Å; A355-V358 VanDerWaalsContact O-CG2 3.29Å; A355-V358 WeakPolarHBondContact O-CG2 3.48Å; A355-V358 PolarHBondContact O-N 3.1Å; A355-N359 PolarHBondContact O-N 3.47Å
356M93.9Very high90.4Very high2 Ų259.2 Ų59.21%0.0134%0.337CS..Hα-helixtrans-64.8-41.3176.5-72.1-179.369.400112.1I291 I294 A295 E298 V352 I353 V358 N359 I362 F370 I373 I377I291-M356 HydrophobicContact CG2-CE 3.79Å; I294-M356 HydrophobicContact CG2-CG 4.26Å; A295-M356 HydrophobicContact CB-CE 3.79Å; A295-M356 HydrophobicContact CB-SD 3.64Å; E298-M356 HydrophobicContact CG-CG 4.48Å; V352-M356 HydrophobicContact CG1-CG 4.22Å; V352-M356 HydrophobicContact CG1-SD 3.84Å; V352-M356 WeakPolarHBondContact O-CB 3.49Å; V352-M356 VanDerWaalsContact O-CG 3.27Å; V352-M356 WeakPolarHBondContact O-CG 3.29Å; V352-M356 PolarHBondContact O-N 3.02Å; I353-M356 PolarHBondContact O-N 2.98Å; M356-V358 PolarHBondContact O-N 3.46Å; M356-N359 WeakPolarHBondContact O-CB 3.5Å; M356-N359 PolarHBondContact O-N 3.01Å; M356-N359 VanDerWaalsContact O-N 3.1Å; M356-I362 HydrophobicContact CB-CD1 4.09Å; M356-I362 HydrophobicContact CE-CD1 3.99Å; M356-I362 HydrophobicContact CG-CD1 4.38Å; M356-F370 HydrophobicContact CB-CD2 3.86Å; M356-F370 HydrophobicContact CB-CE2 3.91Å; M356-F370 HydrophobicContact CB-CG 4.4Å; M356-F370 HydrophobicContact CB-CZ 4.47Å; M356-F370 HydrophobicContact CE-CB 4.5Å; M356-F370 HydrophobicContact CE-CD1 3.57Å; M356-F370 HydrophobicContact CE-CD2 4.4Å; M356-F370 HydrophobicContact CE-CE1 3.76Å; M356-F370 HydrophobicContact CE-CG 3.92Å; M356-F370 HydrophobicContact CE-CZ 4.25Å; M356-I373 HydrophobicContact CE-CD1 4.3Å; M356-I377 HydrophobicContact SD-CD1 4.16Å
357N91.5Very high89.4Confident93 Ų9363.1 Ų63.150%0.49736%0.355SS..Hα-helixtrans-61.9-25.2179.9-81.3-33.6000114I353 N354 F370I353-N357 WeakPolarHBondContact O-CB 3.37Å; I353-N357 PolarHBondContact O-N 3.49Å; I353-N357 PolarHBondContact O-ND2 3.03Å; N354-N357 PolarHBondContact O-N 3.22Å; N357-F370 VanDerWaalsContact OD1-CD2 3.23Å; N357-F370 WeakPolarHBondContact OD1-CD2 3.21Å; N357-F370 WeakPolarHBondContact OD1-CE2 3.31Å
358V91.4Very high88.4Confident117 Ų11762.9 Ų62.971%0.70935%0.349SS*.THydrogen-bonded Turntrans-100.50.5178-59.70000113.3A355 M356 P360A355-V358 VanDerWaalsContact O-CG2 3.29Å; A355-V358 WeakPolarHBondContact O-CG2 3.48Å; A355-V358 PolarHBondContact O-N 3.1Å; M356-V358 PolarHBondContact O-N 3.46Å; V358-P360 WeakPolarHBondContact O-CD 3.23Å
359N89.4Confident87.8Confident29 Ų2966.6 Ų66.616%0.15537%0.369CS..  trans-81118.8-172.3-166.8-48.2000111.7I294 A355 M356 R361 I362I294-N359 WeakPolarHBondContact CG2-ND2 3.26Å; A355-N359 PolarHBondContact O-N 3.47Å; M356-N359 WeakPolarHBondContact O-CB 3.5Å; M356-N359 PolarHBondContact O-N 3.01Å; M356-N359 VanDerWaalsContact O-N 3.1Å; N359-R361 PolarHBondContact O-N 3.46Å; N359-R361 VanDerWaalsContact O-N 3.14Å; N359-R361 WeakPolarHBondContact OD1-CB 3.42Å; N359-R361 PolarHBondContact OD1-N 2.98Å; N359-I362 HydrophobicContact CB-CD1 4.27Å; N359-I362 HydrophobicContact CB-CG1 3.94Å; N359-I362 PolarHBondContact O-N 3.25Å
360P88Confident87.3Confident128 Ų12866.7 Ų66.783%0.83137%0.369SS*.THydrogen-bonded Turntrans-73.4-7.1-174.231.1-37.3000114.3V358V358-P360 WeakPolarHBondContact O-CD 3.23Å
361R85.8Confident86.9Confident147 Ų14766 Ų6656%0.55537%0.367SS*.THydrogen-bonded Turntrans-90-13-178-63.8-175.1178.9167.23.7113.5I294 N359I294-R361 HydrophobicContact CD1-CB 3.82Å; N359-R361 PolarHBondContact O-N 3.46Å; N359-R361 VanDerWaalsContact O-N 3.14Å; N359-R361 WeakPolarHBondContact OD1-CB 3.42Å; N359-R361 PolarHBondContact OD1-N 2.98Å
362I88.6Confident86.7Confident16 Ų1663.7 Ų63.78%0.08236%0.355CS..  trans-123.8147.1178.551.3172.7000109.6M287 R290 I291 I294 M356 N359 F370M287-I362 HydrophobicContact SD-CB 4.32Å; M287-I362 HydrophobicContact SD-CG2 4.31Å; R290-I362 HydrophobicContact CB-CG2 3.8Å; I291-I362 HydrophobicContact CB-CG2 4.47Å; I291-I362 HydrophobicContact CG1-CB 3.96Å; I291-I362 HydrophobicContact CG1-CG2 3.78Å; I294-I362 HydrophobicContact CB-CD1 4.34Å; I294-I362 HydrophobicContact CD1-CB 4.28Å; I294-I362 HydrophobicContact CD1-CD1 4.25Å; I294-I362 HydrophobicContact CD1-CG1 4.05Å; I294-I362 HydrophobicContact CD1-CG2 3.44Å; I294-I362 VanDerWaalsContact CD1-CG2 3.44Å; I294-I362 HydrophobicContact CG1-CG2 4.3Å; I294-I362 HydrophobicContact CG2-CD1 4.05Å; M356-I362 HydrophobicContact CB-CD1 4.09Å; M356-I362 HydrophobicContact CE-CD1 3.99Å; M356-I362 HydrophobicContact CG-CD1 4.38Å; N359-I362 HydrophobicContact CB-CD1 4.27Å; N359-I362 HydrophobicContact CB-CG1 3.94Å; N359-I362 PolarHBondContact O-N 3.25Å; I362-F370 HydrophobicContact CD1-CE1 4.26Å; I362-F370 HydrophobicContact CD1-CE2 4.4Å; I362-F370 HydrophobicContact CD1-CZ 3.75Å; I362-F370 HydrophobicContact CG1-CZ 4.45Å
363S82.1Confident86.6Confident72 Ų7263.7 Ų63.750%0.50336%0.355SS..  trans-129.4134.8172.558.40000107.7M287M287-S363 VanDerWaalsContact CE-OG 3.25Å; M287-S363 WeakPolarHBondContact CE-OG 3.31Å; M287-S363 PolarHBondContact SD-N 3.41Å
364F78.1Confident86.6Confident33 Ų3365.2 Ų65.215%0.14536%0.363CS..  trans-117.4140.2174.3-151.2-121.4000108.2L278 I282 I291 V368 D369 F370 L372L278-F364 HydrophobicContact CD2-CE2 3.61Å; L278-F364 HydrophobicContact CD2-CZ 4.04Å; I282-F364 HydrophobicContact CD1-CD2 3.58Å; I282-F364 HydrophobicContact CD1-CE2 3.54Å; I282-F364 HydrophobicContact CG1-CE2 4.42Å; I291-F364 HydrophobicContact CD1-CD2 3.78Å; I291-F364 HydrophobicContact CD1-CE2 4.24Å; F364-V368 VanDerWaalsContact CD1-C 3.48Å; F364-V368 HydrophobicContact CD1-CB 3.93Å; F364-V368 HydrophobicContact CD1-CG1 4.39Å; F364-V368 WeakPolarHBondContact CD1-O 3.49Å; F364-V368 HydrophobicContact CE1-CB 3.28Å; F364-V368 HydrophobicContact CE1-CG1 3.29Å; F364-V368 WeakPolarHBondContact CE1-O 3.46Å; F364-V368 HydrophobicContact CZ-CB 3.85Å; F364-V368 HydrophobicContact CZ-CG1 3.49Å; F364-V368 VanDerWaalsContact CZ-CG1 3.49Å; F364-D369 WeakPolarHBondContact CE1-O 3.35Å; F364-F370 HydrophobicContact CB-CE1 3.82Å; F364-F370 HydrophobicContact CB-CE2 4.22Å; F364-F370 HydrophobicContact CB-CZ 3.6Å; F364-F370 HydrophobicContact CD1-CD1 4.35Å; F364-F370 HydrophobicContact CD1-CE1 4.32Å; F364-F370 HydrophobicContact CD2-CD1 4.04Å; F364-F370 AromaticContact CD2-CE1 3.56Å; F364-F370 HydrophobicContact CD2-CE1 3.56Å; F364-F370 HydrophobicContact CD2-CZ 4.25Å; F364-F370 HydrophobicContact CE2-CD1 4.31Å; F364-F370 HydrophobicContact CE2-CE1 4.23Å; F364-F370 HydrophobicContact CG-CD1 4.1Å; F364-F370 AromaticContact CG-CE1 3.66Å; F364-F370 HydrophobicContact CG-CE1 3.66Å; F364-F370 AromaticContact CG-CZ 3.96Å; F364-F370 HydrophobicContact CG-CZ 3.96Å; F364-L372 HydrophobicContact CZ-CD2 4.13Å
365P78.5Confident86.6Confident38 Ų3864.3 Ų64.325%0.24737%0.365CS..  trans-53.6134.5174.3-23.133000109.6I282 E367 V368I282-P365 HydrophobicContact CG1-CG 4.19Å; P365-E367 WeakPolarHBondContact CB-OE2 3.46Å; P365-E367 PolarHBondContact O-N 2.96Å; P365-V368 HydrophobicContact CB-CG2 4.35Å; P365-V368 PolarHBondContact O-N 3.41Å
366P71.6Confident86.8Confident122 Ų12263.2 Ų63.279%0.79236%0.355SS*.THydrogen-bonded Turntrans-62.2-15.8-174.524.2-32.5000113.6
367E74Confident87Confident158 Ų15863.1 Ų63.174%0.73835%0.354SS*.THydrogen-bonded Turntrans-82.9-9.1178.6-55.679.4-171.600113.9P365P365-E367 WeakPolarHBondContact CB-OE2 3.46Å; P365-E367 PolarHBondContact O-N 2.96Å
368V76.6Confident87.3Confident35 Ų3561.4 Ų61.421%0.21234%0.341CS..SBendtrans-124.5148.7-173.8-162.70000108.4Y281 F364 P365 L372Y281-V368 HydrophobicContact CD1-CG1 4.34Å; Y281-V368 HydrophobicContact CD1-CG2 3.85Å; Y281-V368 HydrophobicContact CG-CG1 4.3Å; Y281-V368 HydrophobicContact CG-CG2 4.26Å; F364-V368 VanDerWaalsContact CD1-C 3.48Å; F364-V368 HydrophobicContact CD1-CB 3.93Å; F364-V368 HydrophobicContact CD1-CG1 4.39Å; F364-V368 WeakPolarHBondContact CD1-O 3.49Å; F364-V368 HydrophobicContact CE1-CB 3.28Å; F364-V368 HydrophobicContact CE1-CG1 3.29Å; F364-V368 WeakPolarHBondContact CE1-O 3.46Å; F364-V368 HydrophobicContact CZ-CB 3.85Å; F364-V368 HydrophobicContact CZ-CG1 3.49Å; F364-V368 VanDerWaalsContact CZ-CG1 3.49Å; P365-V368 HydrophobicContact CB-CG2 4.35Å; P365-V368 PolarHBondContact O-N 3.41Å; V368-L372 HydrophobicContact CG1-CD2 3.81Å
369D84.4Confident87.5Confident80 Ų8058 Ų5843%0.42832%0.317SS..  trans-112.1149.2175.9-167.9-14.7000111.6F364 V371 L372F364-D369 WeakPolarHBondContact CE1-O 3.35Å; D369-V371 HydrophobicContact CB-CB 4.31Å; D369-V371 HydrophobicContact CB-CG2 4.38Å; D369-V371 PolarHBondContact O-N 3.21Å; D369-V371 VanDerWaalsContact O-N 3.12Å; D369-V371 PolarHBondContact OD1-N 2.96Å; D369-V371 WeakPolarHBondContact OD2-CG2 3.3Å; D369-L372 WeakPolarHBondContact O-CB 3.36Å; D369-L372 PolarHBondContact O-N 2.98Å
370F87.3Confident87.9Confident5 Ų556.6 Ų56.62%0.02231%0.31CS..G310 helixtrans-62.1-13.6173.3-67.3-59.9000113.5I291 I353 M356 N357 I362 F364 L372 I373I291-F370 HydrophobicContact CD1-CE1 4.28Å; I291-F370 HydrophobicContact CG1-CE1 4.14Å; I291-F370 HydrophobicContact CG2-CD1 4.07Å; I291-F370 HydrophobicContact CG2-CE1 3.77Å; I353-F370 HydrophobicContact CG2-CB 4.48Å; M356-F370 HydrophobicContact CB-CD2 3.86Å; M356-F370 HydrophobicContact CB-CE2 3.91Å; M356-F370 HydrophobicContact CB-CG 4.4Å; M356-F370 HydrophobicContact CB-CZ 4.47Å; M356-F370 HydrophobicContact CE-CB 4.5Å; M356-F370 HydrophobicContact CE-CD1 3.57Å; M356-F370 HydrophobicContact CE-CD2 4.4Å; M356-F370 HydrophobicContact CE-CE1 3.76Å; M356-F370 HydrophobicContact CE-CG 3.92Å; M356-F370 HydrophobicContact CE-CZ 4.25Å; N357-F370 VanDerWaalsContact OD1-CD2 3.23Å; N357-F370 WeakPolarHBondContact OD1-CD2 3.21Å; N357-F370 WeakPolarHBondContact OD1-CE2 3.31Å; I362-F370 HydrophobicContact CD1-CE1 4.26Å; I362-F370 HydrophobicContact CD1-CE2 4.4Å; I362-F370 HydrophobicContact CD1-CZ 3.75Å; I362-F370 HydrophobicContact CG1-CZ 4.45Å; F364-F370 HydrophobicContact CB-CE1 3.82Å; F364-F370 HydrophobicContact CB-CE2 4.22Å; F364-F370 HydrophobicContact CB-CZ 3.6Å; F364-F370 HydrophobicContact CD1-CD1 4.35Å; F364-F370 HydrophobicContact CD1-CE1 4.32Å; F364-F370 HydrophobicContact CD2-CD1 4.04Å; F364-F370 AromaticContact CD2-CE1 3.56Å; F364-F370 HydrophobicContact CD2-CE1 3.56Å; F364-F370 HydrophobicContact CD2-CZ 4.25Å; F364-F370 HydrophobicContact CE2-CD1 4.31Å; F364-F370 HydrophobicContact CE2-CE1 4.23Å; F364-F370 HydrophobicContact CG-CD1 4.1Å; F364-F370 AromaticContact CG-CE1 3.66Å; F364-F370 HydrophobicContact CG-CE1 3.66Å; F364-F370 AromaticContact CG-CZ 3.96Å; F364-F370 HydrophobicContact CG-CZ 3.96Å; F370-L372 PolarHBondContact O-N 3.37Å; F370-I373 VanDerWaalsContact O-CG1 3.25Å; F370-I373 WeakPolarHBondContact O-CG1 3.12Å; F370-I373 PolarHBondContact O-N 3.5Å
371V88.2Confident88.4Confident74 Ų7450.5 Ų50.545%0.44827%0.27SS..G310 helixtrans-49.7-26.6165.2176.10000111.9I353 D369 I373 N374I353-V371 HydrophobicContact CD1-CG2 4.02Å; D369-V371 HydrophobicContact CB-CB 4.31Å; D369-V371 HydrophobicContact CB-CG2 4.38Å; D369-V371 PolarHBondContact O-N 3.21Å; D369-V371 VanDerWaalsContact O-N 3.12Å; D369-V371 PolarHBondContact OD1-N 2.96Å; D369-V371 WeakPolarHBondContact OD2-CG2 3.3Å; V371-I373 PolarHBondContact O-N 2.66Å; V371-I373 VanDerWaalsContact O-N 3.17Å; V371-N374 WeakPolarHBondContact O-CB 3.43Å; V371-N374 PolarHBondContact O-N 3.41Å
372L90.9Very high88.9Confident47 Ų4748.7 Ų48.725%0.24626%0.263CS..G310 helixtrans-53-33.2175.1-174.766.9000113.8L277 L278 Y281 F364 V368 D369 F370L277-L372 HydrophobicContact CD2-CB 4.45Å; L277-L372 HydrophobicContact CD2-CD1 3.35Å; L277-L372 HydrophobicContact CD2-CD2 3.55Å; L277-L372 HydrophobicContact CD2-CG 3.15Å; L278-L372 HydrophobicContact CD2-CD2 4.31Å; Y281-L372 HydrophobicContact CD2-CD2 3.53Å; Y281-L372 HydrophobicContact CE2-CD1 4.06Å; Y281-L372 HydrophobicContact CE2-CD2 3.61Å; Y281-L372 HydrophobicContact CE2-CG 4.48Å; Y281-L372 HydrophobicContact CG-CD2 4.42Å; F364-L372 HydrophobicContact CZ-CD2 4.13Å; V368-L372 HydrophobicContact CG1-CD2 3.81Å; D369-L372 WeakPolarHBondContact O-CB 3.36Å; D369-L372 PolarHBondContact O-N 2.98Å; F370-L372 PolarHBondContact O-N 3.37Å
373I94.3Very high89.4Confident1 Ų148.2 Ų48.21%0.00526%0.261CS..G310 helixtrans-106.323177.258.1164.7000112.9A274 L278 I291 A295 M356 F370 V371 S375 F376 I377A274-I373 HydrophobicContact CB-CG2 4.19Å; L278-I373 HydrophobicContact CD1-CG2 3.96Å; L278-I373 HydrophobicContact CD2-CG2 3.84Å; L278-I373 HydrophobicContact CG-CG2 3.71Å; I291-I373 HydrophobicContact CG2-CD1 4.06Å; A295-I373 HydrophobicContact CB-CD1 4.11Å; M356-I373 HydrophobicContact CE-CD1 4.3Å; F370-I373 VanDerWaalsContact O-CG1 3.25Å; F370-I373 WeakPolarHBondContact O-CG1 3.12Å; F370-I373 PolarHBondContact O-N 3.5Å; V371-I373 PolarHBondContact O-N 2.66Å; V371-I373 VanDerWaalsContact O-N 3.17Å; I373-S375 VanDerWaalsContact C-N 3.26Å; I373-S375 PolarHBondContact O-N 2.79Å; I373-F376 HydrophobicContact CB-CB 4.47Å; I373-F376 WeakPolarHBondContact O-CB 3.11Å; I373-F376 PolarHBondContact O-N 3.43Å; I373-I377 HydrophobicContact CD1-CD1 4.19Å; I373-I377 HydrophobicContact CD1-CG1 4.3Å; I373-I377 HydrophobicContact CG1-CD1 3.94Å; I373-I377 HydrophobicContact CG1-CG1 4.25Å; I373-I377 WeakPolarHBondContact O-CG1 3.45Å; I373-I377 PolarHBondContact O-N 3.23Å
374N94.9Very high90.1Very high45 Ų4544.8 Ų44.824%0.24124%0.237CC..Hα-helixtrans-55.5-36.1-180172.331.1000113.3V349 V371 F376 I377 R378V349-N374 WeakPolarHBondContact CG1-OD1 3.25Å; V371-N374 WeakPolarHBondContact O-CB 3.43Å; V371-N374 PolarHBondContact O-N 3.41Å; N374-F376 VanDerWaalsContact C-N 3.34Å; N374-F376 PolarHBondContact O-N 3.07Å; N374-I377 PolarHBondContact O-N 2.85Å; N374-R378 PolarHBondContact ND2-NH2 3.35Å; N374-R378 WeakPolarHBondContact O-CB 3.48Å; N374-R378 PolarHBondContact O-N 2.9Å; N374-R378 PolarHBondContact OD1-NH2 3.43Å
375S95.9Very high91Very high81 Ų8143.4 Ų43.457%0.56623%0.231SC*.Hα-helixtrans-59.1-46.5175.652.40000111.7I373 E379I373-S375 VanDerWaalsContact C-N 3.26Å; I373-S375 PolarHBondContact O-N 2.79Å; S375-E379 PolarHBondContact O-N 3.35Å; S375-E379 VanDerWaalsContact O-N 3.13Å
376F97.4Very high91.8Very high4 Ų442.3 Ų42.32%0.01823%0.225CC..Hα-helixtrans-65.2-48177.4172.8-101.1000112E270 A274 I292 A295 T296 I373 N374 R378 E379 T380 W428E270-F376 HydrophobicContact CB-CD2 3.95Å; E270-F376 HydrophobicContact CB-CE2 4.44Å; A274-F376 HydrophobicContact CB-CB 4.03Å; A274-F376 HydrophobicContact CB-CD1 4.48Å; A274-F376 HydrophobicContact CB-CD2 4.26Å; A274-F376 HydrophobicContact CB-CG 3.99Å; I292-F376 HydrophobicContact CG2-CE1 3.85Å; I292-F376 HydrophobicContact CG2-CE2 4.43Å; I292-F376 HydrophobicContact CG2-CZ 3.7Å; A295-F376 HydrophobicContact CB-CD1 4.47Å; A295-F376 HydrophobicContact CB-CE1 4.11Å; T296-F376 WeakPolarHBondContact OG1-CZ 3.43Å; I373-F376 HydrophobicContact CB-CB 4.47Å; I373-F376 WeakPolarHBondContact O-CB 3.11Å; I373-F376 PolarHBondContact O-N 3.43Å; N374-F376 VanDerWaalsContact C-N 3.34Å; N374-F376 PolarHBondContact O-N 3.07Å; F376-R378 VanDerWaalsContact C-N 3.34Å; F376-R378 PolarHBondContact O-N 3.33Å; F376-E379 PolarHBondContact O-N 3.26Å; F376-T380 WeakPolarHBondContact O-CB 3.35Å; F376-T380 PolarHBondContact O-N 3.42Å; F376-T380 PolarHBondContact O-OG1 3.14Å; F376-W428 HydrophobicContact CE2-CH2 4.37Å; F376-W428 HydrophobicContact CE2-CZ3 4.33Å; F376-W428 HydrophobicContact CZ-CH2 4.25Å; F376-W428 HydrophobicContact CZ-CZ3 4Å
377I97.6Very high93Very high0 Ų036.5 Ų36.50%019%0.188CC..Hα-helixtrans-60.2-46.8179.4-63170.9000110.2A295 V349 V352 I353 M356 I373 N374 E379 T380 C381A295-I377 HydrophobicContact CB-CG1 4.27Å; V349-I377 HydrophobicContact CB-CG2 4.42Å; V349-I377 HydrophobicContact CG1-CG2 4.3Å; V349-I377 HydrophobicContact CG2-CG2 4.08Å; V352-I377 HydrophobicContact CB-CG2 3.89Å; V352-I377 HydrophobicContact CG1-CD1 4.27Å; V352-I377 HydrophobicContact CG1-CG1 4.47Å; V352-I377 HydrophobicContact CG1-CG2 3.69Å; V352-I377 HydrophobicContact CG2-CG2 4.22Å; I353-I377 HydrophobicContact CG1-CD1 4.07Å; M356-I377 HydrophobicContact SD-CD1 4.16Å; I373-I377 HydrophobicContact CD1-CD1 4.19Å; I373-I377 HydrophobicContact CD1-CG1 4.3Å; I373-I377 HydrophobicContact CG1-CD1 3.94Å; I373-I377 HydrophobicContact CG1-CG1 4.25Å; I373-I377 WeakPolarHBondContact O-CG1 3.45Å; I373-I377 PolarHBondContact O-N 3.23Å; N374-I377 PolarHBondContact O-N 2.85Å; I377-E379 PolarHBondContact O-N 3.37Å; I377-T380 PolarHBondContact O-N 2.85Å; I377-C381 WeakPolarHBondContact O-CB 3.28Å; I377-C381 PolarHBondContact O-N 2.71Å; I377-C381 PolarHBondContact O-SG 3.21Å; I377-C381 VanDerWaalsContact O-SG 3.39Å
378R97.3Very high94.1Very high57 Ų5729.6 Ų29.622%0.21516%0.155CC..Hα-helixtrans-58-48179.6178.1-169.7-58.7-89.1-18.6112.3V345 Q346 V349 N374 F376 T380 C381 R382V345-R378 HydrophobicContact CG1-CB 4.37Å; V345-R378 HydrophobicContact CG1-CG 3.68Å; Q346-R378 VanDerWaalsContact CD-NH1 3.28Å; V349-R378 HydrophobicContact CG2-CB 4.01Å; N374-R378 PolarHBondContact ND2-NH2 3.35Å; N374-R378 WeakPolarHBondContact O-CB 3.48Å; N374-R378 PolarHBondContact O-N 2.9Å; N374-R378 PolarHBondContact OD1-NH2 3.43Å; F376-R378 VanDerWaalsContact C-N 3.34Å; F376-R378 PolarHBondContact O-N 3.33Å; R378-T380 VanDerWaalsContact C-N 3.34Å; R378-C381 PolarHBondContact O-N 2.61Å; R378-R382 WeakPolarHBondContact O-CG 3.26Å; R378-R382 PolarHBondContact O-N 3.27Å; R378-R382 VanDerWaalsContact O-N 3.1Å
379E97.5Very high94.9Very high45 Ų4528 Ų2821%0.2115%0.146CC..Hα-helixtrans-67.5-39.5-179.5-168.360.8-166.400111.2R262 L266 S375 F376 I377 C381 R382 V383R262-E379 IonicContact NH2-OE1 3.92Å; R262-E379 PolarHBondContact NH2-OE1 2.91Å; L266-E379 HydrophobicContact CD2-CB 4.28Å; L266-E379 HydrophobicContact CD2-CG 3.87Å; S375-E379 PolarHBondContact O-N 3.35Å; S375-E379 VanDerWaalsContact O-N 3.13Å; F376-E379 PolarHBondContact O-N 3.26Å; I377-E379 PolarHBondContact O-N 3.37Å; E379-C381 PolarHBondContact O-N 2.88Å; E379-R382 PolarHBondContact O-N 3.4Å; E379-R382 IonicContact OE2-CZ 3.86Å; E379-R382 IonicContact OE2-NH1 3.07Å; E379-R382 PolarHBondContact OE2-NH1 3.38Å; E379-V383 WeakPolarHBondContact O-CG2 3.4Å; E379-V383 PolarHBondContact O-N 2.87Å
380T97.9Very high95.3Very high0 Ų024.6 Ų24.60%013%0.127CC..Hα-helixtrans-61.5-44.4174.9-53.20000111.8T296 A299 F300 F376 I377 R378 R382 V383 A384T296-T380 HydrophobicContact CG2-CG2 3.99Å; A299-T380 HydrophobicContact CB-CG2 3.67Å; F300-T380 HydrophobicContact CD2-CG2 4.22Å; F300-T380 HydrophobicContact CE2-CG2 4.11Å; F376-T380 WeakPolarHBondContact O-CB 3.35Å; F376-T380 PolarHBondContact O-N 3.42Å; F376-T380 PolarHBondContact O-OG1 3.14Å; I377-T380 PolarHBondContact O-N 2.85Å; R378-T380 VanDerWaalsContact C-N 3.34Å; T380-R382 VanDerWaalsContact C-N 3.35Å; T380-R382 PolarHBondContact O-N 3.25Å; T380-V383 PolarHBondContact O-N 3.39Å; T380-A384 WeakPolarHBondContact O-CB 3.39Å; T380-A384 PolarHBondContact O-N 3.04Å
381C97.9Very high95.4Very high0 Ų028.4 Ų28.40%015%0.148CC..Hα-helixtrans-59.8-42.2175.4-75.70000112.3V345 I377 R378 E379 A384 F385V345-C381 HydrophobicContact CG1-CB 4.13Å; I377-C381 WeakPolarHBondContact O-CB 3.28Å; I377-C381 PolarHBondContact O-N 2.71Å; I377-C381 PolarHBondContact O-SG 3.21Å; I377-C381 VanDerWaalsContact O-SG 3.39Å; R378-C381 PolarHBondContact O-N 2.61Å; E379-C381 PolarHBondContact O-N 2.88Å; C381-A384 PolarHBondContact O-N 2.66Å; C381-F385 VanDerWaalsContact O-CB 3.28Å; C381-F385 WeakPolarHBondContact O-CB 3.12Å; C381-F385 PolarHBondContact O-N 3.47Å
382R96.8Very high95.5Very high109 Ų10927.7 Ų27.741%0.41115%0.147SC..Hα-helixtrans-62-48.2177.3-73175.4-175.6142-7.3112V345 R378 E379 T380 F385 A386V345-R382 HydrophobicContact CG1-CG 4.11Å; V345-R382 HydrophobicContact CG2-CG 3.64Å; R378-R382 WeakPolarHBondContact O-CG 3.26Å; R378-R382 PolarHBondContact O-N 3.27Å; R378-R382 VanDerWaalsContact O-N 3.1Å; E379-R382 PolarHBondContact O-N 3.4Å; E379-R382 IonicContact OE2-CZ 3.86Å; E379-R382 IonicContact OE2-NH1 3.07Å; E379-R382 PolarHBondContact OE2-NH1 3.38Å; T380-R382 VanDerWaalsContact C-N 3.35Å; T380-R382 PolarHBondContact O-N 3.25Å; R382-F385 PolarHBondContact O-N 2.9Å; R382-A386 WeakPolarHBondContact O-CB 3.14Å; R382-A386 PolarHBondContact O-N 3.36Å
383V97.3Very high95.6Very high6 Ų628.7 Ų28.74%0.03616%0.156CC..Hα-helixtrans-63.4-47.5179173.50000110L259 R262 L266 E379 T380 F385 A386 M387L259-V383 HydrophobicContact CD2-CG1 4.43Å; R262-V383 HydrophobicContact CB-CG2 4.35Å; L266-V383 HydrophobicContact CD1-CB 4.01Å; L266-V383 HydrophobicContact CD1-CG1 4.12Å; L266-V383 HydrophobicContact CD1-CG2 3.99Å; E379-V383 WeakPolarHBondContact O-CG2 3.4Å; E379-V383 PolarHBondContact O-N 2.87Å; T380-V383 PolarHBondContact O-N 3.39Å; V383-F385 VanDerWaalsContact C-N 3.35Å; V383-F385 PolarHBondContact O-N 3.32Å; V383-A386 PolarHBondContact O-N 3.09Å; V383-M387 HydrophobicContact CG1-CE 3.76Å; V383-M387 HydrophobicContact CG1-SD 4.16Å; V383-M387 VanDerWaalsContact O-CG 3.31Å; V383-M387 WeakPolarHBondContact O-CG 3.32Å; V383-M387 PolarHBondContact O-N 2.89Å
384A97.5Very high95.7Very high0 Ų028.7 Ų28.70%016%0.156CC..Hα-helixtrans-60.9-41.8178.800000112.3F300 A303 T380 C381 M387 Q388F300-A384 HydrophobicContact CB-CB 4.39Å; F300-A384 HydrophobicContact CD1-CB 3.92Å; F300-A384 HydrophobicContact CD2-CB 3.66Å; F300-A384 HydrophobicContact CE1-CB 4.08Å; F300-A384 HydrophobicContact CE2-CB 3.83Å; F300-A384 HydrophobicContact CG-CB 3.72Å; F300-A384 HydrophobicContact CZ-CB 4.04Å; A303-A384 HydrophobicContact CB-CB 3.62Å; T380-A384 WeakPolarHBondContact O-CB 3.39Å; T380-A384 PolarHBondContact O-N 3.04Å; C381-A384 PolarHBondContact O-N 2.66Å; A384-M387 WeakPolarHBondContact O-CB 3.46Å; A384-M387 PolarHBondContact O-N 3.33Å; A384-Q388 WeakPolarHBondContact O-CG 3.46Å; A384-Q388 PolarHBondContact O-N 2.92Å
385F97.4Very high95.7Very high4 Ų428.7 Ų28.72%0.01816%0.156CC..Hα-helixtrans-64-47.4176.9-176.1-87.9000110.9A303 A306 Y307 F310 L340 Y343 C381 R382 V383 M387 Q388 T389A303-F385 HydrophobicContact CB-CB 4.1Å; A306-F385 HydrophobicContact CB-CD2 4.33Å; A306-F385 HydrophobicContact CB-CE2 4.34Å; Y307-F385 HydrophobicContact CD2-CE2 4.46Å; Y307-F385 HydrophobicContact CD2-CZ 4.3Å; F310-F385 HydrophobicContact CB-CZ 4.43Å; F310-F385 AromaticContact CD1-CZ 3.85Å; F310-F385 HydrophobicContact CD1-CZ 3.85Å; F310-F385 HydrophobicContact CG-CZ 4.4Å; L340-F385 HydrophobicContact CD2-CD1 4.25Å; L340-F385 HydrophobicContact CD2-CE1 4.04Å; Y343-F385 HydrophobicContact CD1-CB 3.64Å; Y343-F385 AromaticContact CD1-CD1 3.79Å; Y343-F385 HydrophobicContact CD1-CD1 3.79Å; Y343-F385 AromaticContact CD1-CD2 3.96Å; Y343-F385 HydrophobicContact CD1-CD2 3.96Å; Y343-F385 HydrophobicContact CD1-CE1 4.43Å; Y343-F385 AromaticContact CD1-CG 3.52Å; Y343-F385 HydrophobicContact CD1-CG 3.52Å; Y343-F385 HydrophobicContact CD2-CD1 4.4Å; Y343-F385 AromaticContact CD2-CD2 3.5Å; Y343-F385 HydrophobicContact CD2-CD2 3.5Å; Y343-F385 HydrophobicContact CD2-CE1 4.46Å; Y343-F385 AromaticContact CD2-CE2 3.54Å; Y343-F385 HydrophobicContact CD2-CE2 3.54Å; Y343-F385 AromaticContact CD2-CG 3.95Å; Y343-F385 HydrophobicContact CD2-CG 3.95Å; Y343-F385 HydrophobicContact CD2-CZ 4.04Å; Y343-F385 HydrophobicContact CE1-CB 3.37Å; Y343-F385 HydrophobicContact CE1-CD1 4.39Å; Y343-F385 AromaticContact CE1-CD2 3.98Å; Y343-F385 HydrophobicContact CE1-CD2 3.98Å; Y343-F385 AromaticContact CE1-CG 3.68Å; Y343-F385 HydrophobicContact CE1-CG 3.68Å; Y343-F385 HydrophobicContact CE2-CB 4.48Å; Y343-F385 AromaticContact CE2-CD2 3.56Å; Y343-F385 HydrophobicContact CE2-CD2 3.56Å; Y343-F385 AromaticContact CE2-CE2 3.97Å; Y343-F385 HydrophobicContact CE2-CE2 3.97Å; Y343-F385 HydrophobicContact CE2-CG 4.13Å; Y343-F385 HydrophobicContact CG-CB 4.3Å; Y343-F385 AromaticContact CG-CD1 3.81Å; Y343-F385 HydrophobicContact CG-CD1 3.81Å; Y343-F385 AromaticContact CG-CD2 3.74Å; Y343-F385 HydrophobicContact CG-CD2 3.74Å; Y343-F385 AromaticContact CG-CE1 3.99Å; Y343-F385 HydrophobicContact CG-CE1 3.99Å; Y343-F385 AromaticContact CG-CE2 3.9Å; Y343-F385 HydrophobicContact CG-CE2 3.9Å; Y343-F385 AromaticContact CG-CG 3.68Å; Y343-F385 HydrophobicContact CG-CG 3.68Å; Y343-F385 HydrophobicContact CG-CZ 4.03Å; Y343-F385 AromaticContact CZ-CD2 3.8Å; Y343-F385 AromaticContact CZ-CG 3.99Å; C381-F385 VanDerWaalsContact O-CB 3.28Å; C381-F385 WeakPolarHBondContact O-CB 3.12Å; C381-F385 PolarHBondContact O-N 3.47Å; R382-F385 PolarHBondContact O-N 2.9Å; V383-F385 VanDerWaalsContact C-N 3.35Å; V383-F385 PolarHBondContact O-N 3.32Å; F385-M387 VanDerWaalsContact C-N 3.25Å; F385-M387 PolarHBondContact O-N 3.48Å; F385-Q388 WeakPolarHBondContact O-CB 3.32Å; F385-Q388 PolarHBondContact O-N 2.87Å; F385-T389 HydrophobicContact CD1-CG2 4.43Å; F385-T389 HydrophobicContact CE1-CG2 4.21Å
386A95.9Very high95.7Very high15 Ų1525.7 Ų25.712%0.12413%0.133CC..Hα-helixtrans-60.8-35177.600000112.2L259 R382 V383 Q388 T389L259-A386 HydrophobicContact CD1-CB 4.17Å; L259-A386 HydrophobicContact CD2-CB 3.66Å; R382-A386 WeakPolarHBondContact O-CB 3.14Å; R382-A386 PolarHBondContact O-N 3.36Å; V383-A386 PolarHBondContact O-N 3.09Å; A386-Q388 VanDerWaalsContact C-N 3.31Å; A386-Q388 PolarHBondContact O-N 2.63Å; A386-T389 PolarHBondContact O-N 3.36Å; A386-T389 VanDerWaalsContact O-N 3.14Å; A386-T389 PolarHBondContact O-OG1 2.71Å
387M96.8Very high95.4Very high0 Ų025.9 Ų25.90%014%0.136CC..Hα-helixtrans-63.3-31.7173.7-77.2176.617000113.9L259 F263 F300 V383 A384 F385 T389 L394 L431L259-M387 HydrophobicContact CB-CE 4.27Å; L259-M387 HydrophobicContact CB-CG 4.11Å; L259-M387 HydrophobicContact CD1-CG 4.21Å; L259-M387 HydrophobicContact CD2-CG 4.45Å; L259-M387 HydrophobicContact CG-CG 4.49Å; L259-M387 WeakPolarHBondContact O-CE 3.32Å; F263-M387 HydrophobicContact CB-CE 3.58Å; F263-M387 HydrophobicContact CD2-CE 4.06Å; F263-M387 HydrophobicContact CG-CE 4.04Å; F300-M387 HydrophobicContact CE1-SD 3.6Å; F300-M387 HydrophobicContact CZ-SD 3.6Å; F300-M387 VanDerWaalsContact CZ-SD 3.6Å; V383-M387 HydrophobicContact CG1-CE 3.76Å; V383-M387 HydrophobicContact CG1-SD 4.16Å; V383-M387 VanDerWaalsContact O-CG 3.31Å; V383-M387 WeakPolarHBondContact O-CG 3.32Å; V383-M387 PolarHBondContact O-N 2.89Å; A384-M387 WeakPolarHBondContact O-CB 3.46Å; A384-M387 PolarHBondContact O-N 3.33Å; F385-M387 VanDerWaalsContact C-N 3.25Å; F385-M387 PolarHBondContact O-N 3.48Å; M387-T389 PolarHBondContact O-N 3.22Å; M387-L394 HydrophobicContact CB-CB 4.05Å; M387-L394 HydrophobicContact CE-CD1 4.36Å; M387-L394 HydrophobicContact CG-CB 4.08Å; M387-L394 HydrophobicContact CG-CD1 4.24Å; M387-L394 PolarHBondContact O-N 3.43Å; M387-L394 HydrophobicContact SD-CB 4.08Å; M387-L431 HydrophobicContact CE-CD1 4.06Å; M387-L431 HydrophobicContact CE-CD2 3.91Å; M387-L431 HydrophobicContact SD-CD1 4.01Å
388Q96Very high95Very high13 Ų1334 Ų346%0.06117%0.171CC..Hα-helixtrans-72.6-14.1175.6-58.3-53.9-65.300113.3K304 Y307 A384 F385 A386 L394K304-Q388 HydrophobicContact CB-CG 4.36Å; K304-Q388 VanDerWaalsContact CE-OE1 3.23Å; Y307-Q388 HydrophobicContact CD1-CB 3.68Å; Y307-Q388 HydrophobicContact CD2-CB 4.27Å; Y307-Q388 HydrophobicContact CE1-CB 4.29Å; Y307-Q388 WeakPolarHBondContact CE1-O 3.45Å; Y307-Q388 HydrophobicContact CG-CB 3.65Å; A384-Q388 WeakPolarHBondContact O-CG 3.46Å; A384-Q388 PolarHBondContact O-N 2.92Å; F385-Q388 WeakPolarHBondContact O-CB 3.32Å; F385-Q388 PolarHBondContact O-N 2.87Å; A386-Q388 VanDerWaalsContact C-N 3.31Å; A386-Q388 PolarHBondContact O-N 2.63Å; Q388-L394 PolarHBondContact NE2-O 3.19Å
389T93.6Very high94.4Very high1 Ų132.3 Ų32.31%0.00617%0.167CC..THydrogen-bonded Turntrans-95.29.4-179.569.10000113.6R255 Y307 I336 L340 F385 A386 M387R255-T389 PolarHBondContact NH1-O 3.45Å; R255-T389 PolarHBondContact NH2-OG1 3.28Å; Y307-T389 HydrophobicContact CD2-CG2 3.76Å; Y307-T389 HydrophobicContact CE2-CG2 3.62Å; I336-T389 HydrophobicContact CG2-CG2 3.69Å; L340-T389 HydrophobicContact CD2-CG2 3.84Å; F385-T389 HydrophobicContact CD1-CG2 4.43Å; F385-T389 HydrophobicContact CE1-CG2 4.21Å; A386-T389 PolarHBondContact O-N 3.36Å; A386-T389 VanDerWaalsContact O-N 3.14Å; A386-T389 PolarHBondContact O-OG1 2.71Å; M387-T389 PolarHBondContact O-N 3.22Å
390L93.6Very high93.5Very high9 Ų932.5 Ų32.55%0.04717%0.174CC..SBendtrans-82.6155.1171-63.9171.8000109.9N252 R255 H256 L259 S392 L394N252-L390 WeakPolarHBondContact OD1-CD2 3.49Å; R255-L390 HydrophobicContact CB-CD2 3.97Å; H256-L390 HydrophobicContact CB-CD1 4.34Å; H256-L390 HydrophobicContact CB-CD2 4.2Å; L259-L390 HydrophobicContact CD1-CD1 3.9Å; L259-L390 HydrophobicContact CD1-CD2 3.98Å; L259-L390 HydrophobicContact CD1-CG 4.02Å; L390-S392 VanDerWaalsContact C-N 3.25Å; L390-S392 WeakPolarHBondContact CB-O 3.42Å; L390-S392 PolarHBondContact O-N 2.87Å; L390-L394 HydrophobicContact CD1-CD1 3.67Å; L390-L394 HydrophobicContact CD1-CG 3.87Å
391D88.1Confident92.3Very high85 Ų8535.1 Ų35.146%0.45520%0.2SC..SBendtrans-60.3-41.6178.7-58.7-20.8000110.8N252N252-D391 VanDerWaalsContact ND2-CB 3.31Å; N252-D391 WeakPolarHBondContact ND2-CB 3.39Å; N252-D391 PolarHBondContact ND2-OD2 3.47Å
392S91.3Very high91.1Very high60 Ų6036 Ų3642%0.4221%0.21SC..SBendtrans-104.5107.5166.1-700000108.8L390 L394 E433L390-S392 VanDerWaalsContact C-N 3.25Å; L390-S392 WeakPolarHBondContact CB-O 3.42Å; L390-S392 PolarHBondContact O-N 2.87Å; S392-L394 PolarHBondContact O-N 3.3Å; S392-E433 WeakPolarHBondContact CB-OE1 3.31Å
393P92.8Very high90.7Very high68 Ų6832.1 Ų32.144%0.44220%0.196SC..  trans-71.1133.2-174.927.2-33.3000110.9
394L95.7Very high90.3Very high0 Ų038 Ų380%023%0.226CC..EExtended strand (participates in β ladder)trans-84.8137.4172.6-62.7171.6000110V260 M387 Q388 L390 S392 L431 E433 I438V260-L394 HydrophobicContact CG2-CD1 3.78Å; M387-L394 HydrophobicContact CB-CB 4.05Å; M387-L394 HydrophobicContact CE-CD1 4.36Å; M387-L394 HydrophobicContact CG-CB 4.08Å; M387-L394 HydrophobicContact CG-CD1 4.24Å; M387-L394 PolarHBondContact O-N 3.43Å; M387-L394 HydrophobicContact SD-CB 4.08Å; Q388-L394 PolarHBondContact NE2-O 3.19Å; L390-L394 HydrophobicContact CD1-CD1 3.67Å; L390-L394 HydrophobicContact CD1-CG 3.87Å; S392-L394 PolarHBondContact O-N 3.3Å; L394-L431 HydrophobicContact CB-CD1 4.2Å; L394-L431 HydrophobicContact CB-CG 4.43Å; L394-L431 HydrophobicContact CD1-CD2 4.22Å; L394-E433 HydrophobicContact CD2-CB 3.71Å; L394-E433 HydrophobicContact CD2-CG 4.03Å; L394-I438 HydrophobicContact CD2-CG1 4.21Å
395D95.1Very high89.9Confident45 Ų4539.8 Ų39.824%0.24123%0.234CC..EExtended strand (participates in β ladder)trans-143.5173-178.4-163.823.5000111.7K304 V432K304-D395 IonicContact NZ-OD1 2.93Å; K304-D395 PolarHBondContact NZ-OD1 2.96Å; K304-D395 IonicContact NZ-OD2 2.63Å; K304-D395 PolarHBondContact NZ-OD2 3.2Å; D395-V432 PolarHBondContact N-O 3.25Å; D395-V432 WeakPolarHBondContact O-CG2 3.45Å; D395-V432 PolarHBondContact O-N 3.43Å
396L95.8Very high89.6Confident19 Ų1941.6 Ų41.610%0.09925%0.247CC..EExtended strand (participates in β ladder)trans-87.1142.5176.2-55.3-178.4000111.3F263 T296 V297 F300 F398 P429 A430 L431F263-L396 HydrophobicContact CE2-CD2 3.96Å; F263-L396 HydrophobicContact CZ-CD2 3.96Å; T296-L396 HydrophobicContact CG2-CD1 4.47Å; V297-L396 HydrophobicContact CB-CD1 4.42Å; V297-L396 HydrophobicContact CG2-CD1 4.02Å; F300-L396 HydrophobicContact CB-CD1 3.74Å; F300-L396 HydrophobicContact CB-CG 4.03Å; F300-L396 HydrophobicContact CD1-CD1 4.19Å; F300-L396 HydrophobicContact CD1-CD2 3.96Å; F300-L396 HydrophobicContact CD1-CG 3.63Å; F300-L396 HydrophobicContact CD2-CD1 3.73Å; F300-L396 HydrophobicContact CD2-CD2 4.14Å; F300-L396 HydrophobicContact CD2-CG 3.99Å; F300-L396 HydrophobicContact CE1-CD2 3.79Å; F300-L396 HydrophobicContact CE1-CG 4.01Å; F300-L396 HydrophobicContact CE2-CD1 4.36Å; F300-L396 HydrophobicContact CE2-CD2 3.98Å; F300-L396 HydrophobicContact CE2-CG 4.34Å; F300-L396 HydrophobicContact CG-CD1 3.62Å; F300-L396 HydrophobicContact CG-CD2 4.12Å; F300-L396 HydrophobicContact CG-CG 3.61Å; F300-L396 HydrophobicContact CZ-CD2 3.79Å; F300-L396 HydrophobicContact CZ-CG 4.35Å; L396-F398 PolarHBondContact O-N 3.06Å; L396-P429 HydrophobicContact CB-CB 4.25Å; L396-P429 HydrophobicContact CD1-CB 3.92Å; L396-P429 HydrophobicContact CD1-CG 3.8Å; L396-P429 HydrophobicContact CD2-CB 3.92Å; L396-P429 HydrophobicContact CD2-CG 3.79Å; L396-P429 HydrophobicContact CG-CB 4.24Å; L396-P429 HydrophobicContact CG-CG 4.33Å; L396-A430 CarbonylContact C-O 3.59Å; L396-A430 WeakPolarHBondContact CA-O 3.33Å; L396-L431 HydrophobicContact CD2-CD1 4.22Å
397A92.6Very high89.4Confident8 Ų845.7 Ų45.77%0.06627%0.266CS..PPolyproline II helixtrans-60.1137.1170.500000110.3T399 A430 V432A397-T399 PolarHBondContact O-N 2.81Å; A397-A430 HydrophobicContact CB-CB 3.91Å; A397-A430 PolarHBondContact N-O 2.95Å; A397-V432 HydrophobicContact CB-CG1 3.84Å
398F87.7Confident89.2Confident170 Ų17050.8 Ų50.875%0.74629%0.294SS*.PPolyproline II helixtrans-61.4125.9173.5-178.7-98000110.7L396L396-F398 PolarHBondContact O-N 3.06Å
399T85.8Confident89Confident21 Ų2153.8 Ų53.813%0.12931%0.307CS..  trans-117.1127.1179.450.90000111.4F293 A397 Y410F293-T399 HydrophobicContact CE2-CG2 4.42Å; F293-T399 HydrophobicContact CZ-CG2 3.87Å; A397-T399 PolarHBondContact O-N 2.81Å; T399-Y410 WeakPolarHBondContact CG2-OH 3.39Å
400S78.4Confident89Confident50 Ų5053.8 Ų53.835%0.3531%0.307SS..  trans-111.3149.8170.362.30000111.5G402 E403S400-G402 PolarHBondContact O-N 3.42Å; S400-E403 PolarHBondContact N-OE2 2.99Å; S400-E403 PolarHBondContact O-N 3.4Å; S400-E403 WeakPolarHBondContact OG-CB 3.43Å; S400-E403 PolarHBondContact OG-OE2 2.91Å
401G73.1Confident89.1Confident54 Ų5459.9 Ų59.956%0.55733%0.329SS*.THydrogen-bonded Turntrans-69.1126.6179.400000110.7
402G72.8Confident89.3Confident19 Ų1958.3 Ų58.320%0.19632%0.317CS..THydrogen-bonded Turntrans74.525.6-178.400000114.4S400 L422 V423S400-G402 PolarHBondContact O-N 3.42Å; G402-L422 WeakPolarHBondContact O-CD2 3.37Å; G402-V423 WeakPolarHBondContact CA-O 3.46Å
403E87.5Confident89.3Confident28 Ų2855.6 Ų55.613%0.13130%0.297CS..PPolyproline II helixtrans-67.8158.2175.469-173.2-166.600113.1S400 Y410 V423 H426S400-E403 PolarHBondContact N-OE2 2.99Å; S400-E403 PolarHBondContact O-N 3.4Å; S400-E403 WeakPolarHBondContact OG-CB 3.43Å; S400-E403 PolarHBondContact OG-OE2 2.91Å; E403-Y410 VanDerWaalsContact OE1-CE2 3.31Å; E403-Y410 WeakPolarHBondContact OE1-CE2 3.15Å; E403-Y410 PolarHBondContact OE1-OH 3.48Å; E403-V423 HydrophobicContact CG-CB 4.31Å; E403-V423 HydrophobicContact CG-CG2 4.2Å; E403-V423 PolarHBondContact O-N 3.19Å; E403-H426 IonicContact OE1-CE1 3.98Å; E403-H426 PolarHBondContact OE1-CE1 3.07Å; E403-H426 IonicContact OE1-NE2 3.78Å; E403-H426 PolarHBondContact OE1-NE2 3.44Å
404L88.3Confident89Confident128 Ų12861.6 Ų61.667%0.6731%0.313SS*.BIsolated β-bridgetrans-66.6133.7172.2-70.9170.3000109.7S406 P421 L422L404-S406 PolarHBondContact O-N 3.14Å; L404-P421 WeakPolarHBondContact CA-O 3.33Å; L404-P421 HydrophobicContact CD2-CB 4.22Å; L404-L422 HydrophobicContact CD2-CD2 3.87Å; L404-L422 HydrophobicContact CG-CD2 4.49Å
405Y90.9Very high88.6Confident38 Ų3863.9 Ų63.915%0.14933%0.325CS..PPolyproline II helixtrans-61.3126.4175.6174.6-92.1000110.3D407 Y410 R412 P421 V423 T445Y405-D407 HydrophobicContact CE1-CB 3.88Å; Y405-D407 PolarHBondContact OH-OD1 3.25Å; Y405-Y410 PolarHBondContact OH-O 3.08Å; Y405-R412 HydrophobicContact CD2-CG 4.1Å; Y405-R412 HydrophobicContact CE1-CG 4.28Å; Y405-R412 HydrophobicContact CE2-CG 3.38Å; Y405-R412 VanDerWaalsContact CZ-CG 3.5Å; Y405-P421 PolarHBondContact N-O 2.92Å; Y405-V423 HydrophobicContact CD2-CG2 4.45Å; Y405-T445 HydrophobicContact CD2-CG2 3.78Å; Y405-T445 HydrophobicContact CG-CG2 4.13Å
406S91Very high88.4Confident42 Ų4262.2 Ų62.229%0.29432%0.317SS..  trans-113.5117.3174.1-179.20000109.8L404 N408 K409 Y410L404-S406 PolarHBondContact O-N 3.14Å; S406-N408 PolarHBondContact O-N 2.86Å; S406-K409 PolarHBondContact O-N 3.38Å; S406-K409 VanDerWaalsContact O-N 3.15Å; S406-Y410 PolarHBondContact O-N 3.07Å
407D90.4Very high88.1Confident101 Ų10164.7 Ų64.754%0.5433%0.328SS..THydrogen-bonded Turntrans-67.9-21.9-179.4-160.664.1000113.2Y405 K440Y405-D407 HydrophobicContact CE1-CB 3.88Å; Y405-D407 PolarHBondContact OH-OD1 3.25Å; D407-K440 WeakPolarHBondContact O-CE 3.47Å; D407-K440 PolarHBondContact O-NZ 3.09Å
408N92.7Very high87.8Confident107 Ų10770.9 Ų70.957%0.57235%0.354SS*.THydrogen-bonded Turntrans-70-37.3174.1-168.227.9000111.6S406 K440S406-N408 PolarHBondContact O-N 2.86Å; N408-K440 WeakPolarHBondContact O-CE 3.45Å
409K92.3Very high87.8Confident77 Ų7767.5 Ų67.534%0.33535%0.347SS..THydrogen-bonded Turntrans-90.1-36.2-173.8-65.5-176.1179.3-176.50113.2S406 A430 V437 K440 G441S406-K409 PolarHBondContact O-N 3.38Å; S406-K409 VanDerWaalsContact O-N 3.15Å; K409-A430 HydrophobicContact CB-CB 4.43Å; K409-A430 VanDerWaalsContact O-CB 3.23Å; K409-A430 WeakPolarHBondContact O-CB 3.32Å; K409-V437 HydrophobicContact CG-CG2 3.94Å; K409-K440 CarbonylContact O-C 3.58Å; K409-K440 VanDerWaalsContact O-CA 3.3Å; K409-K440 WeakPolarHBondContact O-CA 3.35Å; K409-G441 PolarHBondContact O-N 3.11Å
410Y94.4Very high87.9Confident0 Ų066.5 Ų66.50%034%0.341CS..EExtended strand (participates in β ladder)trans-130.1152.9-168.9-53.3-69.8000112.2T399 E403 Y405 S406 H426 A430 G441 A443T399-Y410 WeakPolarHBondContact CG2-OH 3.39Å; E403-Y410 VanDerWaalsContact OE1-CE2 3.31Å; E403-Y410 WeakPolarHBondContact OE1-CE2 3.15Å; E403-Y410 PolarHBondContact OE1-OH 3.48Å; Y405-Y410 PolarHBondContact OH-O 3.08Å; S406-Y410 PolarHBondContact O-N 3.07Å; Y410-H426 AromaticContact CE1-CD2 3.73Å; Y410-H426 AromaticContact CE2-NE2 4Å; Y410-H426 AromaticContact CZ-CD2 3.76Å; Y410-H426 AromaticContact CZ-NE2 3.75Å; Y410-A430 HydrophobicContact CD1-CB 4.35Å; Y410-A430 HydrophobicContact CE1-CB 3.9Å; Y410-G441 CarbonylContact C-O 3.59Å; Y410-G441 WeakPolarHBondContact CA-O 3.32Å; Y410-A443 HydrophobicContact CD1-CB 4.43Å; Y410-A443 HydrophobicContact CG-CB 4.11Å
411R94.3Very high88.4Confident137 Ų13767.7 Ų67.752%0.51735%0.347SS..EExtended strand (participates in β ladder)trans-97.4145.6161.1-57.8-175.9-172.691.2-2.4108.6K440 G441 E442 A443R411-K440 HydrophobicContact CG-CB 4.1Å; R411-K440 HydrophobicContact CG-CD 4.19Å; R411-K440 PolarHBondContact NH1-O 3.37Å; R411-G441 PolarHBondContact N-O 3.28Å; R411-E442 WeakPolarHBondContact O-CA 3.25Å; R411-A443 PolarHBondContact O-N 3.18Å
412R92.8Very high89.2Confident53 Ų5366.8 Ų66.820%0.233%0.329CS..EExtended strand (participates in β ladder)trans-78.5130.7172-67-173.5-175.6-122.53.1110.2Y405 E417 F418 A420 A443 T445Y405-R412 HydrophobicContact CD2-CG 4.1Å; Y405-R412 HydrophobicContact CE1-CG 4.28Å; Y405-R412 HydrophobicContact CE2-CG 3.38Å; Y405-R412 VanDerWaalsContact CZ-CG 3.5Å; R412-E417 PolarHBondContact NH1-O 2.85Å; R412-E417 VanDerWaalsContact NH1-O 3.14Å; R412-F418 HydrophobicContact CB-CD1 4.45Å; R412-F418 HydrophobicContact CB-CE1 3.96Å; R412-F418 HydrophobicContact CB-CZ 4.46Å; R412-F418 PolarHBondContact NH1-O 3.44Å; R412-A420 PolarHBondContact NH1-O 2.93Å; R412-A420 PolarHBondContact NH2-O 2.89Å; R412-A420 VanDerWaalsContact NH2-O 3.15Å; R412-A443 WeakPolarHBondContact CA-O 3.38Å; R412-T445 VanDerWaalsContact NH1-CB 3.27Å; R412-T445 PolarHBondContact NH1-OG1 3.37Å
413S90.9Very high90.1Very high2 Ų265.9 Ų65.91%0.01432%0.32CS..PPolyproline II helixtrans-65.1157.4167.2-54.20000111.1D415 S416 E442 A443S413-D415 WeakPolarHBondContact CB-OD1 3.46Å; S413-D415 PolarHBondContact O-N 2.9Å; S413-S416 WeakPolarHBondContact O-CB 3.42Å; S413-S416 PolarHBondContact O-N 2.97Å; S413-S416 VanDerWaalsContact O-N 3.11Å; S413-S416 PolarHBondContact O-OG 2.87Å; S413-E442 VanDerWaalsContact CB-OE1 3.27Å; S413-E442 WeakPolarHBondContact CB-OE1 3.45Å; S413-E442 WeakPolarHBondContact OG-CG 3.2Å; S413-E442 PolarHBondContact OG-OE1 2.86Å; S413-A443 PolarHBondContact N-O 3.5Å
414Y86.8Confident90.3Very high195 Ų19565.7 Ų65.777%0.76532%0.323SS*.THydrogen-bonded Turntrans-62.8-25.8-177.473-89.4000114S416Y414-S416 PolarHBondContact O-N 3.46Å
415D86.5Confident90.4Very high47 Ų4760 Ų6025%0.25129%0.293SS..THydrogen-bonded Turntrans-86.66.8179.870.1-38.9000113.1S413 Y425 V444 R446S413-D415 WeakPolarHBondContact CB-OD1 3.46Å; S413-D415 PolarHBondContact O-N 2.9Å; D415-Y425 PolarHBondContact OD2-OH 3.14Å; D415-V444 WeakPolarHBondContact OD1-CG2 3.45Å; D415-R446 IonicContact OD2-NH2 3.93Å
416S90.9Very high90.6Very high10 Ų1058.9 Ų58.97%0.0729%0.289CS..SBendtrans-75.5143.3177.1-76.80000113.6S413 Y414 F418 A443 V444 T445S413-S416 WeakPolarHBondContact O-CB 3.42Å; S413-S416 PolarHBondContact O-N 2.97Å; S413-S416 VanDerWaalsContact O-N 3.11Å; S413-S416 PolarHBondContact O-OG 2.87Å; Y414-S416 PolarHBondContact O-N 3.46Å; S416-F418 VanDerWaalsContact O-CD2 3.31Å; S416-F418 WeakPolarHBondContact O-CD2 3.44Å; S416-F418 PolarHBondContact O-N 2.92Å; S416-A443 PolarHBondContact OG-O 3.32Å; S416-V444 WeakPolarHBondContact OG-CA 3.45Å; S416-T445 WeakPolarHBondContact CA-O 3.33Å; S416-T445 WeakPolarHBondContact CB-OG1 3.32Å; S416-T445 PolarHBondContact OG-N 3.49Å; S416-T445 PolarHBondContact OG-OG1 2.96Å
417E90Very high90.7Very high72 Ų7257 Ų5734%0.33628%0.276SS..  trans-7799.3158.6-68.6179.5-139.200109.7R412 T419 A420 T445 R447R412-E417 PolarHBondContact NH1-O 2.85Å; R412-E417 VanDerWaalsContact NH1-O 3.14Å; E417-T419 PolarHBondContact O-N 3.34Å; E417-A420 HydrophobicContact CB-CB 3.84Å; E417-A420 VanDerWaalsContact O-CB 3.25Å; E417-A420 WeakPolarHBondContact O-CB 3.44Å; E417-A420 PolarHBondContact O-N 3.11Å; E417-T445 PolarHBondContact N-O 3.4Å; E417-T445 PolarHBondContact O-OG1 2.97Å; E417-R447 PolarHBondContact OE1-N 3.37Å; E417-R447 WeakPolarHBondContact OE2-CB 3.24Å; E417-R447 VanDerWaalsContact OE2-CG 3.31Å; E417-R447 WeakPolarHBondContact OE2-CG 3.4Å; E417-R447 IonicContact OE2-CZ 3.84Å; E417-R447 PolarHBondContact OE2-N 3.45Å; E417-R447 VanDerWaalsContact OE2-N 3.16Å; E417-R447 IonicContact OE2-NE 3.91Å; E417-R447 PolarHBondContact OE2-NE 3.04Å; E417-R447 VanDerWaalsContact OE2-NE 3.14Å
418F86.9Confident91Very high138 Ų13852.3 Ų52.361%0.60525%0.251SS*.THydrogen-bonded Turntrans-56.9-26.7-175.9-72.9-93.4000114.9R412 S416R412-F418 HydrophobicContact CB-CD1 4.45Å; R412-F418 HydrophobicContact CB-CE1 3.96Å; R412-F418 HydrophobicContact CB-CZ 4.46Å; R412-F418 PolarHBondContact NH1-O 3.44Å; S416-F418 VanDerWaalsContact O-CD2 3.31Å; S416-F418 WeakPolarHBondContact O-CD2 3.44Å; S416-F418 PolarHBondContact O-N 2.92Å
419T87Confident91.2Very high98 Ų9847.2 Ų47.260%0.60122%0.223SC*.THydrogen-bonded Turntrans-85.1-7.2175.958.40000113.9E417 R447E417-T419 PolarHBondContact O-N 3.34Å; T419-R447 PolarHBondContact OG1-NH1 3.17Å; T419-R447 VanDerWaalsContact OG1-NH1 3.15Å; T419-R447 PolarHBondContact OG1-NH2 2.75Å
420A88.9Confident91.4Very high0 Ų043.6 Ų43.60%021%0.207CC..  trans-77.6130.417900000110.4R412 E417 R446 R447R412-A420 PolarHBondContact NH1-O 2.93Å; R412-A420 PolarHBondContact NH2-O 2.89Å; R412-A420 VanDerWaalsContact NH2-O 3.15Å; E417-A420 HydrophobicContact CB-CB 3.84Å; E417-A420 VanDerWaalsContact O-CB 3.25Å; E417-A420 WeakPolarHBondContact O-CB 3.44Å; E417-A420 PolarHBondContact O-N 3.11Å; A420-R446 VanDerWaalsContact CB-C 3.46Å; A420-R447 HydrophobicContact CB-CG 4.22Å
421P87.8Confident91.5Very high76 Ų7643.6 Ų43.649%0.49421%0.207SC..  trans-82.5-15.3-178.530.1-32.7000113.5L404 Y405L404-P421 WeakPolarHBondContact CA-O 3.33Å; L404-P421 HydrophobicContact CD2-CB 4.22Å; Y405-P421 PolarHBondContact N-O 2.92Å
422L91.2Very high91.6Very high34 Ų3438 Ų3818%0.17819%0.188CC..BIsolated β-bridgetrans-107.3139.8-172.4-60.8171.2000111.8G402 L404 A424 T445 R446 A449 L450G402-L422 WeakPolarHBondContact O-CD2 3.37Å; L404-L422 HydrophobicContact CD2-CD2 3.87Å; L404-L422 HydrophobicContact CG-CD2 4.49Å; L422-A424 PolarHBondContact O-N 3.42Å; L422-T445 WeakPolarHBondContact O-CA 3.45Å; L422-T445 WeakPolarHBondContact O-CB 3.39Å; L422-R446 PolarHBondContact O-N 2.9Å; L422-A449 HydrophobicContact CB-CB 4.07Å; L422-L450 HydrophobicContact CD1-CD1 3.5Å; L422-L450 HydrophobicContact CD1-CG 3.89Å
423V91.6Very high91.7Very high1 Ų138.1 Ų38.11%0.00619%0.191CC..EExtended strand (participates in β ladder)trans-74.4121.1169.5178.60000109G402 E403 Y405 A443 V444 T445G402-V423 WeakPolarHBondContact CA-O 3.46Å; E403-V423 HydrophobicContact CG-CB 4.31Å; E403-V423 HydrophobicContact CG-CG2 4.2Å; E403-V423 PolarHBondContact O-N 3.19Å; Y405-V423 HydrophobicContact CD2-CG2 4.45Å; V423-A443 HydrophobicContact CG1-CB 3.88Å; V423-A443 HydrophobicContact CG2-CB 4.17Å; V423-V444 CarbonylContact C-O 3.55Å; V423-T445 HydrophobicContact CG2-CG2 4.36Å
424A90.3Very high91.7Very high23 Ų2341.1 Ų41.119%0.1922%0.223CC..EExtended strand (participates in β ladder)trans-74.3-48.8173.200000110.7L422 V444 R446 A449L422-A424 PolarHBondContact O-N 3.42Å; A424-V444 PolarHBondContact N-O 3.32Å; A424-R446 HydrophobicContact CB-CB 4.08Å; A424-R446 HydrophobicContact CB-CG 4.15Å; A424-A449 HydrophobicContact CB-CB 4.17Å
425Y91.7Very high91.8Very high10 Ų1039.9 Ų39.94%0.03923%0.23CC..EExtended strand (participates in β ladder)trans-160.5158.6172.861.7-88000110.3E286 Q289 R290 D415 V427 V444E286-Y425 HydrophobicContact CB-CE1 4.05Å; E286-Y425 HydrophobicContact CG-CD1 3.66Å; E286-Y425 HydrophobicContact CG-CE1 3.45Å; E286-Y425 VanDerWaalsContact CG-CE1 3.45Å; E286-Y425 HydrophobicContact CG-CE2 4.38Å; E286-Y425 HydrophobicContact CG-CG 4.2Å; Q289-Y425 HydrophobicContact CB-CE2 4.03Å; Q289-Y425 PolarHBondContact OE1-OH 3.37Å; R290-Y425 HydrophobicContact CG-CD2 4.49Å; R290-Y425 HydrophobicContact CG-CG 4.48Å; D415-Y425 PolarHBondContact OD2-OH 3.14Å; Y425-V427 HydrophobicContact CD2-CG2 4.38Å; Y425-V427 HydrophobicContact CE2-CG2 3.93Å; Y425-V444 HydrophobicContact CD1-CB 4.12Å; Y425-V444 HydrophobicContact CD2-CB 4.42Å; Y425-V444 HydrophobicContact CD2-CG2 4.23Å; Y425-V444 HydrophobicContact CE1-CB 3.72Å; Y425-V444 HydrophobicContact CE1-CG1 3.88Å; Y425-V444 HydrophobicContact CE1-CG2 3.97Å; Y425-V444 HydrophobicContact CE2-CB 4.04Å; Y425-V444 HydrophobicContact CE2-CG2 3.52Å; Y425-V444 HydrophobicContact CG-CB 4.46Å; Y425-V444 PolarHBondContact N-O 2.85Å; Y425-V444 PolarHBondContact O-N 3.48Å
426H93.6Very high92Very high13 Ų1341.2 Ų41.26%0.0624%0.243CC..EExtended strand (participates in β ladder)trans-94.8136.5177-58.981000109.9F293 E403 Y410F293-H426 WeakPolarHBondContact CB-O 3.45Å; F293-H426 HydrophobicContact CD1-CB 4.28Å; F293-H426 HydrophobicContact CD2-CB 3.48Å; F293-H426 VanDerWaalsContact CD2-CB 3.48Å; F293-H426 HydrophobicContact CE1-CB 4.13Å; F293-H426 HydrophobicContact CE2-CB 3.29Å; F293-H426 HydrophobicContact CG-CB 3.99Å; F293-H426 HydrophobicContact CZ-CB 3.65Å; E403-H426 IonicContact OE1-CE1 3.98Å; E403-H426 PolarHBondContact OE1-CE1 3.07Å; E403-H426 IonicContact OE1-NE2 3.78Å; E403-H426 PolarHBondContact OE1-NE2 3.44Å; Y410-H426 AromaticContact CE1-CD2 3.73Å; Y410-H426 AromaticContact CE2-NE2 4Å; Y410-H426 AromaticContact CZ-CD2 3.76Å; Y410-H426 AromaticContact CZ-NE2 3.75Å
427V94.6Very high92.2Very high3 Ų342.3 Ų42.32%0.01825%0.249CC..EExtended strand (participates in β ladder)trans-93-39.3175.2-179.30000109.9Q289 Y425 E442 V444Q289-V427 HydrophobicContact CG-CG1 4.32Å; Y425-V427 HydrophobicContact CD2-CG2 4.38Å; Y425-V427 HydrophobicContact CE2-CG2 3.93Å; V427-E442 HydrophobicContact CB-CB 4.1Å; V427-E442 HydrophobicContact CB-CG 3.98Å; V427-E442 HydrophobicContact CG1-CG 4.48Å; V427-E442 HydrophobicContact CG2-CG 4.32Å; V427-E442 PolarHBondContact N-O 2.96Å; V427-V444 HydrophobicContact CG2-CG2 3.76Å
428W96.4Very high92.5Very high3 Ų342 Ų421%0.01125%0.248CC..EExtended strand (participates in β ladder)trans-145.1135.7179.2-166.1-107.6000111.2F263 L266 Y267 R271 I292 T296 F376 G441 E442F263-W428 HydrophobicContact CD2-CZ2 4.31Å; F263-W428 HydrophobicContact CE1-CZ2 4.4Å; F263-W428 AromaticContact CE1-NE1 3.19Å; F263-W428 AromaticContact CE2-CZ2 3.85Å; F263-W428 HydrophobicContact CE2-CZ2 3.85Å; F263-W428 AromaticContact CZ-CE2 3.75Å; F263-W428 AromaticContact CZ-CZ2 3.91Å; F263-W428 HydrophobicContact CZ-CZ2 3.91Å; F263-W428 AromaticContact CZ-NE1 3.21Å; L266-W428 HydrophobicContact CB-CH2 3.93Å; L266-W428 HydrophobicContact CB-CZ2 4.03Å; Y267-W428 HydrophobicContact CD2-CB 3.63Å; Y267-W428 AromaticContact CD2-CD1 3.78Å; Y267-W428 AromaticContact CD2-CD2 3.59Å; Y267-W428 HydrophobicContact CD2-CD2 3.59Å; Y267-W428 HydrophobicContact CD2-CE3 4.09Å; Y267-W428 AromaticContact CD2-CG 3.37Å; Y267-W428 HydrophobicContact CD2-CG 3.37Å; Y267-W428 HydrophobicContact CE2-CB 3.82Å; Y267-W428 HydrophobicContact CE2-CG 4.07Å; Y267-W428 HydrophobicContact CG-CD2 4.22Å; Y267-W428 HydrophobicContact CG-CG 4.14Å; R271-W428 HydrophobicContact CB-CZ3 4.14Å; R271-W428 HydrophobicContact CG-CE3 4.15Å; R271-W428 HydrophobicContact CG-CZ3 4.09Å; I292-W428 HydrophobicContact CG2-CZ3 4.48Å; T296-W428 HydrophobicContact CG2-CH2 4.04Å; T296-W428 HydrophobicContact CG2-CZ2 4.39Å; T296-W428 HydrophobicContact CG2-CZ3 4.29Å; F376-W428 HydrophobicContact CE2-CH2 4.37Å; F376-W428 HydrophobicContact CE2-CZ3 4.33Å; F376-W428 HydrophobicContact CZ-CH2 4.25Å; F376-W428 HydrophobicContact CZ-CZ3 4Å; W428-G441 CarbonylContact O-C 3.59Å; W428-G441 VanDerWaalsContact O-CA 3.3Å; W428-G441 WeakPolarHBondContact O-CA 3.5Å; W428-E442 HydrophobicContact CB-CB 4.09Å; W428-E442 PolarHBondContact N-O 3.35Å; W428-E442 VanDerWaalsContact N-O 3.09Å; W428-E442 PolarHBondContact O-N 3.34Å
429P96.6Very high92.9Very high0 Ų036.4 Ų36.40%023%0.226CC..PPolyproline II helixtrans-71.2152.5178.730.2-34.5000112F263 F293 T296 L396 G441F263-P429 HydrophobicContact CZ-CG 4.36Å; F293-P429 HydrophobicContact CD2-CB 4.47Å; F293-P429 HydrophobicContact CE2-CB 3.82Å; F293-P429 HydrophobicContact CE2-CG 4.39Å; T296-P429 HydrophobicContact CG2-CG 3.73Å; L396-P429 HydrophobicContact CB-CB 4.25Å; L396-P429 HydrophobicContact CD1-CB 3.92Å; L396-P429 HydrophobicContact CD1-CG 3.8Å; L396-P429 HydrophobicContact CD2-CB 3.92Å; L396-P429 HydrophobicContact CD2-CG 3.79Å; L396-P429 HydrophobicContact CG-CB 4.24Å; L396-P429 HydrophobicContact CG-CG 4.33Å; P429-G441 WeakPolarHBondContact O-CA 3.49Å
430A96.3Very high93.4Very high0 Ų034.9 Ų34.90%021%0.211CC..PPolyproline II helixtrans-82.9137.8172.200000110L396 A397 K409 Y410 V437 V439L396-A430 CarbonylContact C-O 3.59Å; L396-A430 WeakPolarHBondContact CA-O 3.33Å; A397-A430 HydrophobicContact CB-CB 3.91Å; A397-A430 PolarHBondContact N-O 2.95Å; K409-A430 HydrophobicContact CB-CB 4.43Å; K409-A430 VanDerWaalsContact O-CB 3.23Å; K409-A430 WeakPolarHBondContact O-CB 3.32Å; Y410-A430 HydrophobicContact CD1-CB 4.35Å; Y410-A430 HydrophobicContact CE1-CB 3.9Å; A430-V437 HydrophobicContact CB-CG1 4.48Å; A430-V439 CarbonylContact C-O 3.33Å; A430-V439 WeakPolarHBondContact CA-O 3.48Å
431L97.3Very high93.7Very high0 Ų035 Ų350%021%0.211CC..EExtended strand (participates in β ladder)trans-90.9128.7176.4-166.271.4000109.6V260 F263 F300 M387 L394 L396 I438 V439V260-L431 HydrophobicContact CG2-CD2 4.3Å; F263-L431 HydrophobicContact CB-CD2 4.37Å; F263-L431 HydrophobicContact CD1-CB 4.06Å; F263-L431 HydrophobicContact CD1-CD1 4.48Å; F263-L431 HydrophobicContact CD1-CD2 3.95Å; F263-L431 HydrophobicContact CD1-CG 4.41Å; F263-L431 HydrophobicContact CD2-CD1 4.31Å; F263-L431 HydrophobicContact CE1-CB 3.74Å; F263-L431 HydrophobicContact CE1-CD1 4.41Å; F263-L431 HydrophobicContact CE1-CD2 4.46Å; F263-L431 HydrophobicContact CE1-CG 4.44Å; F263-L431 HydrophobicContact CE2-CD1 4.24Å; F263-L431 HydrophobicContact CG-CD1 4.42Å; F263-L431 HydrophobicContact CG-CD2 4.11Å; F263-L431 HydrophobicContact CZ-CB 4.22Å; F263-L431 HydrophobicContact CZ-CD1 4.28Å; F300-L431 HydrophobicContact CE1-CD1 4.15Å; F300-L431 HydrophobicContact CZ-CD1 4.29Å; M387-L431 HydrophobicContact CE-CD1 4.06Å; M387-L431 HydrophobicContact CE-CD2 3.91Å; M387-L431 HydrophobicContact SD-CD1 4.01Å; L394-L431 HydrophobicContact CB-CD1 4.2Å; L394-L431 HydrophobicContact CB-CG 4.43Å; L394-L431 HydrophobicContact CD1-CD2 4.22Å; L396-L431 HydrophobicContact CD2-CD1 4.22Å; L431-I438 PolarHBondContact O-N 2.84Å; L431-V439 HydrophobicContact CB-CB 3.86Å; L431-V439 HydrophobicContact CB-CG2 4.23Å; L431-V439 HydrophobicContact CD2-CG2 4.09Å; L431-V439 PolarHBondContact N-O 2.75Å; L431-V439 PolarHBondContact O-N 3.45Å
432V96.3Very high94.1Very high19 Ų1932.6 Ų32.612%0.11519%0.194CC..EExtended strand (participates in β ladder)trans-125.7148.8-177.4-60.50000111.6D395 A397 S436 V437D395-V432 PolarHBondContact N-O 3.25Å; D395-V432 WeakPolarHBondContact O-CG2 3.45Å; D395-V432 PolarHBondContact O-N 3.43Å; A397-V432 HydrophobicContact CB-CG1 3.84Å; V432-S436 CarbonylContact C-O 3.57Å; V432-S436 WeakPolarHBondContact CA-O 3.35Å; V432-S436 WeakPolarHBondContact CB-O 3.39Å; V432-V437 HydrophobicContact CG1-CG2 4.15Å
433E94.9Very high94.2Very high56 Ų5631 Ų3126%0.26219%0.185SC..EExtended strand (participates in β ladder)trans-120.5105.9169.2-169.4-179.2-154.700107H256 S392 L394 D435 S436 I438H256-E433 IonicContact NE2-OE1 3.29Å; H256-E433 IonicContact NE2-OE2 3.68Å; S392-E433 WeakPolarHBondContact CB-OE1 3.31Å; L394-E433 HydrophobicContact CD2-CB 3.71Å; L394-E433 HydrophobicContact CD2-CG 4.03Å; E433-D435 PolarHBondContact O-N 2.86Å; E433-D435 VanDerWaalsContact O-N 3.14Å; E433-S436 PolarHBondContact N-O 3.45Å; E433-S436 PolarHBondContact O-N 3.48Å; E433-I438 HydrophobicContact CB-CD1 3.93Å; E433-I438 HydrophobicContact CB-CG1 3.73Å
434G90.4Very high94.3Very high66 Ų6630.9 Ų30.968%0.6819%0.185SC*.THydrogen-bonded Turntrans58.4-117.5-166.600000111.2
435D87.6Confident94.4Very high169 Ų16929.8 Ų29.890%0.90418%0.176SC*.THydrogen-bonded Turntrans-96.2-3.8178.8-67.9-27.9000113.8E433E433-D435 PolarHBondContact O-N 2.86Å; E433-D435 VanDerWaalsContact O-N 3.14Å
436S92.5Very high94.3Very high75 Ų7533.2 Ų33.252%0.52419%0.189SC..EExtended strand (participates in β ladder)trans-94.8132.9-175.4-63.40000111.6V432 E433 I438V432-S436 CarbonylContact C-O 3.57Å; V432-S436 WeakPolarHBondContact CA-O 3.35Å; V432-S436 WeakPolarHBondContact CB-O 3.39Å; E433-S436 PolarHBondContact N-O 3.45Å; E433-S436 PolarHBondContact O-N 3.48Å; S436-I438 PolarHBondContact O-N 3.29Å
437V94.9Very high93.9Very high33 Ų3340.3 Ų40.320%0.222%0.215CC..EExtended strand (participates in β ladder)trans-82.7115.3174.8-177.60000109.2K409 A430 V432 K440K409-V437 HydrophobicContact CG-CG2 3.94Å; A430-V437 HydrophobicContact CB-CG1 4.48Å; V432-V437 HydrophobicContact CG1-CG2 4.15Å; V437-K440 HydrophobicContact CG1-CG 4.4Å
438I95.7Very high92.8Very high64 Ų6442 Ų4233%0.32823%0.232SC..EExtended strand (participates in β ladder)trans-88.6-43.7178.1-54.2-55.8000110.4V260 L394 L431 E433 S436V260-I438 HydrophobicContact CG1-CG2 4.1Å; V260-I438 HydrophobicContact CG2-CG2 3.98Å; L394-I438 HydrophobicContact CD2-CG1 4.21Å; L431-I438 PolarHBondContact O-N 2.84Å; E433-I438 HydrophobicContact CB-CD1 3.93Å; E433-I438 HydrophobicContact CB-CG1 3.73Å; S436-I438 PolarHBondContact O-N 3.29Å
439V96.2Very high91.2Very high21 Ų2142.7 Ų42.713%0.12724%0.239CC..EExtended strand (participates in β ladder)trans-129.2121.3177.1-174.80000108.9V260 F263 A430 L431 G441V260-V439 HydrophobicContact CG1-CG2 3.73Å; F263-V439 HydrophobicContact CD1-CB 4.38Å; F263-V439 HydrophobicContact CD1-CG1 4.36Å; F263-V439 HydrophobicContact CD1-CG2 4.47Å; F263-V439 HydrophobicContact CE1-CB 4.43Å; F263-V439 HydrophobicContact CE1-CG1 4.38Å; A430-V439 CarbonylContact C-O 3.33Å; A430-V439 WeakPolarHBondContact CA-O 3.48Å; L431-V439 HydrophobicContact CB-CB 3.86Å; L431-V439 HydrophobicContact CB-CG2 4.23Å; L431-V439 HydrophobicContact CD2-CG2 4.09Å; L431-V439 PolarHBondContact N-O 2.75Å; L431-V439 PolarHBondContact O-N 3.45Å; V439-G441 PolarHBondContact O-N 2.88Å
440K96.2Very high89.3Confident67 Ų6747.5 Ų47.529%0.29126%0.264SS..  trans-65.5134.7173.8-61.7-166.6177.9-170.30110.3D407 N408 K409 R411 V437D407-K440 WeakPolarHBondContact O-CE 3.47Å; D407-K440 PolarHBondContact O-NZ 3.09Å; N408-K440 WeakPolarHBondContact O-CE 3.45Å; K409-K440 CarbonylContact O-C 3.58Å; K409-K440 VanDerWaalsContact O-CA 3.3Å; K409-K440 WeakPolarHBondContact O-CA 3.35Å; R411-K440 HydrophobicContact CG-CB 4.1Å; R411-K440 HydrophobicContact CG-CD 4.19Å; R411-K440 PolarHBondContact NH1-O 3.37Å; V437-K440 HydrophobicContact CG1-CG 4.4Å
441G95.6Very high87.1Confident1 Ų158 Ų581%0.0130%0.304CS..EExtended strand (participates in β ladder)trans-77.5-168.3170.400000112.2K409 Y410 R411 W428 P429 V439K409-G441 PolarHBondContact O-N 3.11Å; Y410-G441 CarbonylContact C-O 3.59Å; Y410-G441 WeakPolarHBondContact CA-O 3.32Å; R411-G441 PolarHBondContact N-O 3.28Å; W428-G441 CarbonylContact O-C 3.59Å; W428-G441 VanDerWaalsContact O-CA 3.3Å; W428-G441 WeakPolarHBondContact O-CA 3.5Å; P429-G441 WeakPolarHBondContact O-CA 3.49Å; V439-G441 PolarHBondContact O-N 2.88Å
442E95.4Very high84.7Confident26 Ų2668.6 Ų68.612%0.12134%0.344CS..EExtended strand (participates in β ladder)trans-132.9133.9178.6-175.3-175.7177.100110.2Y267 R411 S413 V427 W428Y267-E442 HydrophobicContact CE2-CB 4.41Å; Y267-E442 WeakPolarHBondContact CE2-OE2 3.23Å; Y267-E442 VanDerWaalsContact CZ-OE2 3.24Å; Y267-E442 PolarHBondContact OH-OE2 3.12Å; R411-E442 WeakPolarHBondContact O-CA 3.25Å; S413-E442 VanDerWaalsContact CB-OE1 3.27Å; S413-E442 WeakPolarHBondContact CB-OE1 3.45Å; S413-E442 WeakPolarHBondContact OG-CG 3.2Å; S413-E442 PolarHBondContact OG-OE1 2.86Å; V427-E442 HydrophobicContact CB-CB 4.1Å; V427-E442 HydrophobicContact CB-CG 3.98Å; V427-E442 HydrophobicContact CG1-CG 4.48Å; V427-E442 HydrophobicContact CG2-CG 4.32Å; V427-E442 PolarHBondContact N-O 2.96Å; W428-E442 HydrophobicContact CB-CB 4.09Å; W428-E442 PolarHBondContact N-O 3.35Å; W428-E442 VanDerWaalsContact N-O 3.09Å; W428-E442 PolarHBondContact O-N 3.34Å
443A94.4Very high82.1Confident0 Ų072.8 Ų72.80%037%0.374CS..EExtended strand (participates in β ladder)trans-139.7144.3-17800000112.2Y410 R411 R412 S413 S416 V423Y410-A443 HydrophobicContact CD1-CB 4.43Å; Y410-A443 HydrophobicContact CG-CB 4.11Å; R411-A443 PolarHBondContact O-N 3.18Å; R412-A443 WeakPolarHBondContact CA-O 3.38Å; S413-A443 PolarHBondContact N-O 3.5Å; S416-A443 PolarHBondContact OG-O 3.32Å; V423-A443 HydrophobicContact CG1-CB 3.88Å; V423-A443 HydrophobicContact CG2-CB 4.17Å
444V93.3Very high79.4Confident0 Ų080.9 Ų80.90%040%0.402CS..EExtended strand (participates in β ladder)trans-96.3134.4172.1-175.60000109.3D415 S416 V423 A424 Y425 V427 R446D415-V444 WeakPolarHBondContact OD1-CG2 3.45Å; S416-V444 WeakPolarHBondContact OG-CA 3.45Å; V423-V444 CarbonylContact C-O 3.55Å; A424-V444 PolarHBondContact N-O 3.32Å; Y425-V444 HydrophobicContact CD1-CB 4.12Å; Y425-V444 HydrophobicContact CD2-CB 4.42Å; Y425-V444 HydrophobicContact CD2-CG2 4.23Å; Y425-V444 HydrophobicContact CE1-CB 3.72Å; Y425-V444 HydrophobicContact CE1-CG1 3.88Å; Y425-V444 HydrophobicContact CE1-CG2 3.97Å; Y425-V444 HydrophobicContact CE2-CB 4.04Å; Y425-V444 HydrophobicContact CE2-CG2 3.52Å; Y425-V444 HydrophobicContact CG-CB 4.46Å; Y425-V444 PolarHBondContact N-O 2.85Å; Y425-V444 PolarHBondContact O-N 3.48Å; V427-V444 HydrophobicContact CG2-CG2 3.76Å; V444-R446 HydrophobicContact CG1-CG 4.42Å
445T93.3Very high76.8Confident0 Ų083 Ų830%041%0.407CS..EExtended strand (participates in β ladder)trans-118.3135.4-179.349.70000110.2Y405 R412 S416 E417 L422 V423Y405-T445 HydrophobicContact CD2-CG2 3.78Å; Y405-T445 HydrophobicContact CG-CG2 4.13Å; R412-T445 VanDerWaalsContact NH1-CB 3.27Å; R412-T445 PolarHBondContact NH1-OG1 3.37Å; S416-T445 WeakPolarHBondContact CA-O 3.33Å; S416-T445 WeakPolarHBondContact CB-OG1 3.32Å; S416-T445 PolarHBondContact OG-N 3.49Å; S416-T445 PolarHBondContact OG-OG1 2.96Å; E417-T445 PolarHBondContact N-O 3.4Å; E417-T445 PolarHBondContact O-OG1 2.97Å; L422-T445 WeakPolarHBondContact O-CA 3.45Å; L422-T445 WeakPolarHBondContact O-CB 3.39Å; V423-T445 HydrophobicContact CG2-CG2 4.36Å
446R89.6Confident74.4Confident82 Ų8286 Ų8631%0.30941%0.405SS..  trans-145.2147.7179.2-66.2-172.6-175.5148.65.2111E286 D415 A420 L422 A424 V444E286-R446 IonicContact OE2-CZ 2.88Å; E286-R446 IonicContact OE2-NH1 2.83Å; E286-R446 PolarHBondContact OE2-NH1 3.45Å; E286-R446 IonicContact OE2-NH2 3.93Å; D415-R446 IonicContact OD2-NH2 3.93Å; A420-R446 VanDerWaalsContact CB-C 3.46Å; L422-R446 PolarHBondContact O-N 2.9Å; A424-R446 HydrophobicContact CB-CB 4.08Å; A424-R446 HydrophobicContact CB-CG 4.15Å; V444-R446 HydrophobicContact CG1-CG 4.42Å
447R84.6Confident71.6Confident162 Ų16287.2 Ų87.261%0.61141%0.413SS*.THydrogen-bonded Turntrans-66.4137.7170-84.2-178.4-107-106.66.3110.1E417 T419 A420E417-R447 PolarHBondContact OE1-N 3.37Å; E417-R447 WeakPolarHBondContact OE2-CB 3.24Å; E417-R447 VanDerWaalsContact OE2-CG 3.31Å; E417-R447 WeakPolarHBondContact OE2-CG 3.4Å; E417-R447 IonicContact OE2-CZ 3.84Å; E417-R447 PolarHBondContact OE2-N 3.45Å; E417-R447 VanDerWaalsContact OE2-N 3.16Å; E417-R447 IonicContact OE2-NE 3.91Å; E417-R447 PolarHBondContact OE2-NE 3.04Å; E417-R447 VanDerWaalsContact OE2-NE 3.14Å; T419-R447 PolarHBondContact OG1-NH1 3.17Å; T419-R447 VanDerWaalsContact OG1-NH1 3.15Å; T419-R447 PolarHBondContact OG1-NH2 2.75Å; A420-R447 HydrophobicContact CB-CG 4.22Å
448G71.3Confident68.7Low37 Ų3791.9 Ų91.938%0.38145%0.446SS..THydrogen-bonded Turntrans75.418.218000000115L450 W451G448-L450 PolarHBondContact O-N 2.97Å; G448-W451 VanDerWaalsContact O-CB 3.32Å; G448-W451 WeakPolarHBondContact O-CB 3.36Å; G448-W451 PolarHBondContact O-N 3.08Å
449A62.4Low65.7Low18 Ų1893.5 Ų93.515%0.14946%0.463CS..G310 helixtrans-48.2-35.2176.900000114.2L422 A424 W451L422-A449 HydrophobicContact CB-CB 4.07Å; A424-A449 HydrophobicContact CB-CB 4.17Å; A449-W451 PolarHBondContact O-N 2.85Å
450L57.6Low63.4Low101 Ų10198 Ų9853%0.52949%0.493SS..G310 helixtrans-70.8-13178.3-70.9162.8000114.3L422 G448L422-L450 HydrophobicContact CD1-CD1 3.5Å; L422-L450 HydrophobicContact CD1-CG 3.89Å; G448-L450 PolarHBondContact O-N 2.97Å
451W49.1Very low60.5Low222 Ų222101.1 Ų101.184%0.84152%0.517SS*.G310 helixtrans-89.6-14-168.6-66.940.4000112.8G448 A449G448-W451 VanDerWaalsContact O-CB 3.32Å; G448-W451 WeakPolarHBondContact O-CB 3.36Å; G448-W451 PolarHBondContact O-N 3.08Å; A449-W451 PolarHBondContact O-N 2.85Å
452R48.3Very low57.6Low222 Ų222112.2 Ų112.284%0.83856%0.559SS**SBendtrans-91-13.4178.7-72.9-164.9173.5-135.70.9114.5
453S40.1Very low54.8Low106 Ų106116.7 Ų116.774%0.74159%0.593SS**SBendtrans-89.5-1.9-177.7-580000115S455S453-S455 PolarHBondContact O-N 2.8Å
454R39.9Very low51.9Low226 Ų226120.3 Ų120.385%0.85363%0.63SS**SBendtrans-91.793.3166.7-110.1-178.2179.8-174.50.2108.6R456R454-R456 PolarHBondContact O-N 3.17Å
455S36Very low49.2Very low112 Ų112125.8 Ų125.878%0.78367%0.668SS**  trans-41.6103159.432.20000109.7S453 S457S453-S455 PolarHBondContact O-N 2.8Å; S455-S457 VanDerWaalsContact C-N 3.28Å; S455-S457 PolarHBondContact O-N 3.21Å
456R35.3Very low46.9Very low232 Ų232131.6 Ų131.688%0.87571%0.706SS**  trans-70.895163.1-79.8-173.5176.2-159.5-0.3106.2R454 C458R454-R456 PolarHBondContact O-N 3.17Å; R456-C458 PolarHBondContact O-N 3.48Å
457S33.5Very low44.4Very low99 Ų99134 Ų13469%0.69273%0.73SS**  trans-55.8106.4155.452.30000107.4S455 S459S455-S457 VanDerWaalsContact C-N 3.28Å; S455-S457 PolarHBondContact O-N 3.21Å; S457-S459 VanDerWaalsContact C-N 3.27Å; S457-S459 PolarHBondContact O-N 3.32Å
458C35.5Very low42Very low131 Ų131137 Ų13789%0.88574%0.742SS**  trans-66.392.5164.5-83.80000107.9R456R456-C458 PolarHBondContact O-N 3.48Å
459S32.9Very low40.4Very low99 Ų99141 Ų14169%0.69276%0.759SS**  trans-90.9128159.5-49.50000107.7S457S457-S459 VanDerWaalsContact C-N 3.27Å; S457-S459 PolarHBondContact O-N 3.32Å
460P47.3Very low39.1Very low116 Ų116148.5 Ų148.575%0.75380%0.795SS**  trans-77.2164.1174.332.4-30.7000110.2
461V35.5Very low37.9Very low132 Ų132146.8 Ų146.880%0.880%0.802SS**  trans89.9101.5171.1-164.60000115
462R33.3Very low37.2Very low234 Ų234147 Ų14788%0.88381%0.809SS**  -177.4123.488.1-140.6166.4-168.9-146.73.5110.6
463S38.4Very low36.4Very low120 Ų120142 Ų14284%0.83981%0.808SS**  trans-53.6129.5163.447.20000111.3
464G33.1Very low36.2Very low75 Ų75148.9 Ų148.977%0.77382%0.818SS**  trans-151.697.1172.200000110.7
465S36.1Very low35.9Very low115 Ų115143.2 Ų143.280%0.80481%0.813SS**  trans-61.2152.8174.6-47.20000112.2
466P45.8Very low35.9Very low123 Ų123149.1 Ų149.180%0.79982%0.818SS**  trans-97.7112.6179.234-25.6000111.2
467T37Very low36.1Very low132 Ų132143 Ų14381%0.8181%0.811SS**  trans-164.7118.2155.4-16.40000112.3
468R33.3Very low36.9Very low226 Ų226143.6 Ų143.685%0.85381%0.812SS**  155109.9124.1-88.9-179.4149.8-156.6-5.8112.7
469T37.7Very low36.9Very low121 Ų121142.8 Ų142.874%0.74281%0.808SS**  trans-9.3139.5132.545.20000118.1
470L34.5Very low37.7Very low175 Ų175144.2 Ų144.292%0.91682%0.815SS**  trans155.1134139.1-83.1157.6000106.1
471G33.5Very low37.1Very low64 Ų64142.6 Ų142.666%0.6682%0.819SS**  cis144.395.422.600000105S473G471-S473 PolarHBondContact O-N 3.23Å
472F34.4Very low37.1Very low227 Ų227147.3 Ų147.3100%0.99682%0.822SS**  trans-78.5116.2176.6-90.7-85.3000109.2
473S31.3Very low37.5Very low118 Ų118143.8 Ų143.883%0.82582%0.821SS**  trans-128134.9167.560.60000110.8G471G471-S473 PolarHBondContact O-N 3.23Å
474R35.7Very low37.3Very low250 Ų250143 Ų14394%0.94382%0.815SS**  trans-86.5151.3-176.6-80.4170.2155.3-171.7-5.2111.9
475S34.6Very low37.6Very low107 Ų107143.3 Ų143.375%0.74881%0.81SS**  trans-161.9110.5143.554.80000110.4
476R34.4Very low37.9Very low236 Ų236142.5 Ų142.589%0.89180%0.804SS**  85.6101.698.6-81.4-176.1-179.6-126.22.1113.4
477S39.6Very low37.6Very low104 Ų104147.7 Ų147.773%0.72781%0.808SS**  97.7158.580.757.90000112.6
478P50.1Low37.8Very low111 Ų111152.9 Ų152.972%0.72183%0.83SS**  cis-147.3153.92639.3-16.6000121.5
479S36.8Very low38.1Very low113 Ų113149.3 Ų149.379%0.7983%0.828SS**  trans59.7164133-55.50000124.4
480P50.1Low38.1Very low130 Ų130150.7 Ų150.784%0.84483%0.833SS**  cis-133.5155.1-10.330.2-8.8000116.4
481G34.1Very low38.3Very low81 Ų81149.4 Ų149.484%0.83583%0.828SS**  trans-141.9131.9163.200000109.8
482R35.8Very low38.6Very low231 Ų231154.4 Ų154.487%0.87284%0.838SS**  trans-93.9165.2-156.7-149.3-179.6-145.6-120.75.6111.9
483L40.7Very low38.8Very low161 Ų161149.9 Ų149.984%0.84383%0.828SS**  trans84.5141.6164-48.6167.3000115.1
484S34.9Very low39.3Very low104 Ų104152 Ų15273%0.72783%0.829SS**  cis-175.4145.7-5150.90000107.6
485A39.5Very low39.6Very low80 Ų80145 Ų14566%0.66182%0.82SS**  trans48.2110.5150.100000119.4
486S41.7Very low40Very low98 Ų98147.9 Ų147.969%0.68583%0.826SS**  77.3128.166.981.30000115.6
487R40.2Very low40.4Very low233 Ų233140.6 Ų140.688%0.87982%0.821SS**  trans81.1128.2159-60.6-179.5-167.9-135.22.6114.8
488L41.8Very low40.5Very low241 Ų241143.9 Ų143.9100%1.26283%0.829SS**  cis-145.5019.5-104.6153.2000109.8

Retrieved 488 of 488 residues in 1819.2 ms (Link to these results)