A0A087X425_POEFO Loading...

Transmembrane protein 177

Plays a role in the early steps of cytochrome c oxidase subunit II (MT-CO2/COX2) maturation and is required for the stabilization of COX20 and the newly synthesized MT-CO2/COX2 protein.

AlphaFold DB , UniProt , Accession A0A087X425, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 310 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
1M51Low67.9Low239 Ų239121 Ų121100%1.17761%0.611SS**  01130-78.1-178.4-91.400108.8S3M1-S3 PolarHBondContact O-N 3.27Å
2A54.2Low68.1Low49 Ų49117.7 Ų117.741%0.40560%0.596SS.*  trans-56.2129.7173.500000109.5L6 K7A2-L6 HydrophobicContact CB-CB 4.48Å; A2-L6 HydrophobicContact CB-CD2 4.01Å; A2-K7 HydrophobicContact CB-CG 4.24Å
3S76.5Confident68.4Low71 Ų71116.4 Ų116.450%0.49759%0.586SS.*  trans-57.3148.5179.485.30000109.6M1 F5 L6 K7M1-S3 PolarHBondContact O-N 3.27Å; S3-F5 PolarHBondContact O-N 3.15Å; S3-L6 PolarHBondContact O-N 3.17Å; S3-K7 PolarHBondContact O-N 2.98Å
4R73.3Confident69.1Low228 Ų228119.1 Ų119.186%0.8659%0.592SS**Hα-helixtrans-52.8-32.2-179.6-67.4-177.8179.1-177-1.1112K7 L8R4-K7 PolarHBondContact O-N 3.24Å; R4-L8 WeakPolarHBondContact O-CB 3.31Å; R4-L8 PolarHBondContact O-N 3.08Å
5F67.5Low70Confident170 Ų170118.8 Ų118.875%0.74658%0.583SS**Hα-helixtrans-63.7-40.2174.7-76.5-83.6000114S3 L8 S9S3-F5 PolarHBondContact O-N 3.15Å; F5-L8 PolarHBondContact O-N 3.34Å; F5-S9 WeakPolarHBondContact O-CB 3.47Å; F5-S9 PolarHBondContact O-N 3.19Å
6L70.3Confident70.7Confident102 Ų102119.5 Ų119.553%0.53458%0.577SS.*Hα-helixtrans-68.6-41.7178.9-162.578.2000111A2 S3 L8 S9 V10A2-L6 HydrophobicContact CB-CB 4.48Å; A2-L6 HydrophobicContact CB-CD2 4.01Å; S3-L6 PolarHBondContact O-N 3.17Å; L6-L8 VanDerWaalsContact C-N 3.35Å; L6-L8 PolarHBondContact O-N 3.49Å; L6-S9 PolarHBondContact O-N 2.64Å; L6-V10 VanDerWaalsContact O-CG2 3.31Å; L6-V10 WeakPolarHBondContact O-CG2 3.35Å; L6-V10 PolarHBondContact O-N 3.31Å
7K71.7Confident71.5Confident140 Ų140115.7 Ų115.761%0.60957%0.57SS**Hα-helixtrans-61.7-43.4175.5-65.7-175.3179.7-1750111.5A2 S3 R4 L11A2-K7 HydrophobicContact CB-CG 4.24Å; S3-K7 PolarHBondContact O-N 2.98Å; R4-K7 PolarHBondContact O-N 3.24Å; K7-L11 WeakPolarHBondContact O-CB 3.46Å; K7-L11 PolarHBondContact O-N 3.28Å
8L71.1Confident72.6Confident99 Ų99113.3 Ų113.352%0.51856%0.564SS.*Hα-helixtrans-64.1-43.5175.9-171.871.5000111.9R4 F5 L6 L11 L12R4-L8 WeakPolarHBondContact O-CB 3.31Å; R4-L8 PolarHBondContact O-N 3.08Å; F5-L8 PolarHBondContact O-N 3.34Å; L6-L8 VanDerWaalsContact C-N 3.35Å; L6-L8 PolarHBondContact O-N 3.49Å; L8-L11 PolarHBondContact O-N 2.98Å; L8-L12 HydrophobicContact CG-CD1 4.08Å; L8-L12 WeakPolarHBondContact O-CB 3.42Å; L8-L12 VanDerWaalsContact O-CG 3.31Å; L8-L12 WeakPolarHBondContact O-CG 3.41Å; L8-L12 PolarHBondContact O-N 3.3Å
9S69.1Low73.5Confident49 Ų49112.1 Ų112.134%0.34356%0.559SS.*Hα-helixtrans-62.3-44.5178.5-177.60000112.6F5 L6 L11 L12 Q13F5-S9 WeakPolarHBondContact O-CB 3.47Å; F5-S9 PolarHBondContact O-N 3.19Å; L6-S9 PolarHBondContact O-N 2.64Å; S9-L11 VanDerWaalsContact C-N 3.34Å; S9-L12 PolarHBondContact O-N 3.05Å; S9-Q13 WeakPolarHBondContact O-CB 3.32Å; S9-Q13 PolarHBondContact O-N 3.28Å
10V70.7Confident74.3Confident86 Ų86108.5 Ų108.552%0.52154%0.542SS..Hα-helixtrans-64.7-40.4176.81720000111L6 Q13 K14L6-V10 VanDerWaalsContact O-CG2 3.31Å; L6-V10 WeakPolarHBondContact O-CG2 3.35Å; L6-V10 PolarHBondContact O-N 3.31Å; V10-Q13 WeakPolarHBondContact O-CB 3.47Å; V10-Q13 PolarHBondContact O-N 3.05Å; V10-K14 WeakPolarHBondContact O-CB 3.49Å; V10-K14 PolarHBondContact O-N 3.36Å
11L71.3Confident75.2Confident98 Ų98109.1 Ų109.151%0.51355%0.546SS..Hα-helixtrans-65.7-46.2176.5-165.2139.1000111.2K7 L8 S9 Q13 K14 Y15K7-L11 WeakPolarHBondContact O-CB 3.46Å; K7-L11 PolarHBondContact O-N 3.28Å; L8-L11 PolarHBondContact O-N 2.98Å; S9-L11 VanDerWaalsContact C-N 3.34Å; L11-Q13 VanDerWaalsContact C-N 3.29Å; L11-Q13 PolarHBondContact O-N 3.29Å; L11-K14 PolarHBondContact O-N 3.18Å; L11-Y15 HydrophobicContact CD2-CD2 4.03Å; L11-Y15 HydrophobicContact CG-CD2 3.92Å; L11-Y15 HydrophobicContact CG-CE2 4.09Å; L11-Y15 VanDerWaalsContact O-CD2 3.26Å; L11-Y15 WeakPolarHBondContact O-CD2 3.21Å; L11-Y15 PolarHBondContact O-N 3.46Å
12L70.8Confident77.3Confident81 Ų81100.8 Ų100.842%0.42452%0.515SS..Hα-helixtrans-61-36.8174-74.4170.9000112L8 S9 R16 L19L8-L12 HydrophobicContact CG-CD1 4.08Å; L8-L12 WeakPolarHBondContact O-CB 3.42Å; L8-L12 VanDerWaalsContact O-CG 3.31Å; L8-L12 WeakPolarHBondContact O-CG 3.41Å; L8-L12 PolarHBondContact O-N 3.3Å; S9-L12 PolarHBondContact O-N 3.05Å; L12-R16 WeakPolarHBondContact O-CG 3.38Å; L12-R16 PolarHBondContact O-N 3.47Å; L12-L19 HydrophobicContact CD2-CD2 3.89Å
13Q71.5Confident79.2Confident101 Ų101100.9 Ų100.947%0.47251%0.513SS..Hα-helixtrans-64.7-42174-94.8178.7-38.300113.2S9 V10 L11 R16S9-Q13 WeakPolarHBondContact O-CB 3.32Å; S9-Q13 PolarHBondContact O-N 3.28Å; V10-Q13 WeakPolarHBondContact O-CB 3.47Å; V10-Q13 PolarHBondContact O-N 3.05Å; L11-Q13 VanDerWaalsContact C-N 3.29Å; L11-Q13 PolarHBondContact O-N 3.29Å; Q13-R16 VanDerWaalsContact CG-CZ 3.44Å
14K79.1Confident80.1Confident155 Ų15598.7 Ų98.767%0.67450%0.497SS*.Hα-helixtrans-68.8-35.9179.2-173.5177178.8-176.50112.4V10 L11V10-K14 WeakPolarHBondContact O-CB 3.49Å; V10-K14 PolarHBondContact O-N 3.36Å; L11-K14 PolarHBondContact O-N 3.18Å
15Y81.9Confident81.3Confident114 Ų11489.5 Ų89.545%0.44747%0.473SS..THydrogen-bonded Turntrans-107.422.5-174.2-63.9-74.8000114.5L11 A17 P18 L19L11-Y15 HydrophobicContact CD2-CD2 4.03Å; L11-Y15 HydrophobicContact CG-CD2 3.92Å; L11-Y15 HydrophobicContact CG-CE2 4.09Å; L11-Y15 VanDerWaalsContact O-CD2 3.26Å; L11-Y15 WeakPolarHBondContact O-CD2 3.21Å; L11-Y15 PolarHBondContact O-N 3.46Å; Y15-A17 PolarHBondContact O-N 3.04Å; Y15-P18 HydrophobicContact CD1-CG 4.37Å; Y15-P18 WeakPolarHBondContact O-CD 3.35Å; Y15-L19 WeakPolarHBondContact O-CB 3.37Å; Y15-L19 PolarHBondContact O-N 3.21Å
16R80.6Confident82.7Confident130 Ų13083.3 Ų83.349%0.49146%0.457SS..Hα-helixtrans-56.3-50.7-177.7-68.3-174.4171.9167.2-4.3113.8L12 Q13 L19 L20L12-R16 WeakPolarHBondContact O-CG 3.38Å; L12-R16 PolarHBondContact O-N 3.47Å; Q13-R16 VanDerWaalsContact CG-CZ 3.44Å; R16-L19 PolarHBondContact O-N 2.9Å; R16-L20 WeakPolarHBondContact O-CB 3.39Å; R16-L20 PolarHBondContact O-N 3.48Å
17A85.4Confident83.9Confident55 Ų5581 Ų8146%0.45545%0.448SS..Hα-helixtrans-68.3-47.7-178.300000112.1Y15 L19 L20 I21Y15-A17 PolarHBondContact O-N 3.04Å; A17-L19 VanDerWaalsContact C-N 3.29Å; A17-L19 PolarHBondContact O-N 2.84Å; A17-L20 PolarHBondContact O-N 3.34Å; A17-I21 VanDerWaalsContact O-CG1 3.31Å; A17-I21 WeakPolarHBondContact O-CG1 3.38Å; A17-I21 PolarHBondContact O-N 3.09Å
18P90.3Very high85.1Confident73 Ų7377.7 Ų77.747%0.47443%0.433SS..Hα-helixtrans-55.9-41171.9-28.635.2000113.8Y15 I21 A22Y15-P18 HydrophobicContact CD1-CG 4.37Å; Y15-P18 WeakPolarHBondContact O-CD 3.35Å; P18-I21 PolarHBondContact O-N 2.86Å; P18-A22 VanDerWaalsContact O-CB 3.28Å; P18-A22 WeakPolarHBondContact O-CB 3.49Å; P18-A22 PolarHBondContact O-N 3.35Å
19L89.8Confident86.3Confident90 Ų9077.3 Ų77.347%0.47144%0.435SS..Hα-helixtrans-63.7-45.8177.3-179.364.4000111.4L12 Y15 R16 A17 A22 S23L12-L19 HydrophobicContact CD2-CD2 3.89Å; Y15-L19 WeakPolarHBondContact O-CB 3.37Å; Y15-L19 PolarHBondContact O-N 3.21Å; R16-L19 PolarHBondContact O-N 2.9Å; A17-L19 VanDerWaalsContact C-N 3.29Å; A17-L19 PolarHBondContact O-N 2.84Å; L19-A22 PolarHBondContact O-N 3.16Å; L19-S23 WeakPolarHBondContact O-CB 3.12Å; L19-S23 PolarHBondContact O-N 3.38Å; L19-S23 PolarHBondContact O-OG 3.37Å
20L90.5Very high87.5Confident39 Ų3978 Ų7820%0.20444%0.444CS..Hα-helixtrans-61.3-46.6177.2-18063.5000111.3R16 A17 A22 S23 C24 L180 W184R16-L20 WeakPolarHBondContact O-CB 3.39Å; R16-L20 PolarHBondContact O-N 3.48Å; A17-L20 PolarHBondContact O-N 3.34Å; L20-A22 VanDerWaalsContact C-N 3.34Å; L20-A22 PolarHBondContact O-N 3.24Å; L20-S23 PolarHBondContact O-N 3.36Å; L20-C24 WeakPolarHBondContact O-CB 3.26Å; L20-C24 PolarHBondContact O-N 3.25Å; L20-C24 PolarHBondContact O-SG 3.14Å; L20-C24 VanDerWaalsContact O-SG 3.41Å; L20-L180 HydrophobicContact CD1-CD2 4.39Å; L20-L180 HydrophobicContact CD1-CG 4.01Å; L20-W184 HydrophobicContact CD2-CB 3.81Å; L20-W184 HydrophobicContact CD2-CD2 4.06Å; L20-W184 HydrophobicContact CD2-CE3 4.33Å; L20-W184 HydrophobicContact CD2-CG 3.84Å
21I93.6Very high88.6Confident122 Ų12276.7 Ų76.763%0.62643%0.434SS*.Hα-helixtrans-60-46.4177.8-67.6166.6000110.2A17 P18 S23 C24 G25A17-I21 VanDerWaalsContact O-CG1 3.31Å; A17-I21 WeakPolarHBondContact O-CG1 3.38Å; A17-I21 PolarHBondContact O-N 3.09Å; P18-I21 PolarHBondContact O-N 2.86Å; I21-S23 PolarHBondContact O-N 3.49Å; I21-C24 PolarHBondContact O-N 3.35Å; I21-G25 PolarHBondContact O-N 3.18Å
22A95.1Very high89.8Confident65 Ų6572.5 Ų72.554%0.53741%0.412SS..Hα-helixtrans-62.6-40.7177.100000112P18 L19 L20 G26P18-A22 VanDerWaalsContact O-CB 3.28Å; P18-A22 WeakPolarHBondContact O-CB 3.49Å; P18-A22 PolarHBondContact O-N 3.35Å; L19-A22 PolarHBondContact O-N 3.16Å; L20-A22 VanDerWaalsContact C-N 3.34Å; L20-A22 PolarHBondContact O-N 3.24Å; A22-G26 PolarHBondContact O-N 3.24Å
23S93.9Very high90.9Very high50 Ų5074.3 Ų74.335%0.3542%0.416SS..Hα-helixtrans-66.7-48.1176.1-62.70000112.3L19 L20 I21 G25 G26 V27L19-S23 WeakPolarHBondContact O-CB 3.12Å; L19-S23 PolarHBondContact O-N 3.38Å; L19-S23 PolarHBondContact O-OG 3.37Å; L20-S23 PolarHBondContact O-N 3.36Å; I21-S23 PolarHBondContact O-N 3.49Å; S23-G25 PolarHBondContact O-N 2.54Å; S23-G26 PolarHBondContact O-N 2.89Å; S23-V27 WeakPolarHBondContact O-CB 3.46Å; S23-V27 VanDerWaalsContact O-CG2 3.3Å; S23-V27 WeakPolarHBondContact O-CG2 3.49Å; S23-V27 PolarHBondContact O-N 3.23Å
24C95.6Very high91.8Very high26 Ų2674 Ų7418%0.17641%0.412CS..Hα-helixtrans-59.4-47.3175.9-73.80000111.2L20 I21 F28 P177L20-C24 WeakPolarHBondContact O-CB 3.26Å; L20-C24 PolarHBondContact O-N 3.25Å; L20-C24 PolarHBondContact O-SG 3.14Å; L20-C24 VanDerWaalsContact O-SG 3.41Å; I21-C24 PolarHBondContact O-N 3.35Å; C24-F28 WeakPolarHBondContact O-CB 3.34Å; C24-F28 PolarHBondContact O-N 3Å; C24-P177 HydrophobicContact CB-CB 4.05Å; C24-P177 PolarHBondContact SG-O 3.17Å
25G96.9Very high92.5Very high34 Ų3467.2 Ų67.235%0.35138%0.382SS..Hα-helixtrans-63.3-42177.300000112.8I21 S23 F28 T29I21-G25 PolarHBondContact O-N 3.18Å; S23-G25 PolarHBondContact O-N 2.54Å; G25-F28 PolarHBondContact O-N 2.89Å; G25-T29 VanDerWaalsContact O-CB 3.31Å; G25-T29 WeakPolarHBondContact O-CB 3.45Å; G25-T29 PolarHBondContact O-N 3.08Å; G25-T29 PolarHBondContact O-OG1 3.33Å
26G96.8Very high93.1Very high40 Ų4064 Ų6441%0.41237%0.374SS..Hα-helixtrans-63.3-47.817700000112.7A22 S23 T29 A30A22-G26 PolarHBondContact O-N 3.24Å; S23-G26 PolarHBondContact O-N 2.89Å; G26-T29 PolarHBondContact O-N 3.13Å; G26-A30 WeakPolarHBondContact O-CB 3.41Å; G26-A30 PolarHBondContact O-N 3.43Å
27V95.8Very high93.8Very high55 Ų5563 Ų6333%0.33337%0.374SS..Hα-helixtrans-63.8-43.4177.4173.60000111.2S23 A30 N31 A176 P177S23-V27 WeakPolarHBondContact O-CB 3.46Å; S23-V27 VanDerWaalsContact O-CG2 3.3Å; S23-V27 WeakPolarHBondContact O-CG2 3.49Å; S23-V27 PolarHBondContact O-N 3.23Å; V27-A30 PolarHBondContact O-N 3.31Å; V27-N31 PolarHBondContact O-N 2.92Å; V27-A176 HydrophobicContact CG1-CB 3.62Å; V27-P177 HydrophobicContact CG1-CG 4.35Å
28F97.1Very high94.1Very high70 Ų7060.4 Ų60.431%0.30735%0.352SS..Hα-helixtrans-59.8-47.9175.8-176.2-100.6000111.4C24 G25 A30 N31 M32 V170 A173 A174 P177C24-F28 WeakPolarHBondContact O-CB 3.34Å; C24-F28 PolarHBondContact O-N 3Å; G25-F28 PolarHBondContact O-N 2.89Å; F28-A30 PolarHBondContact O-N 3.33Å; F28-N31 PolarHBondContact O-N 2.92Å; F28-M32 HydrophobicContact CD1-CG 4.08Å; F28-M32 HydrophobicContact CD2-CG 4.4Å; F28-M32 HydrophobicContact CE1-CG 3.62Å; F28-M32 HydrophobicContact CE2-CG 3.98Å; F28-M32 HydrophobicContact CG-CG 4.45Å; F28-M32 HydrophobicContact CZ-CG 3.57Å; F28-M32 HydrophobicContact CZ-SD 4.27Å; F28-M32 WeakPolarHBondContact O-CB 3.39Å; F28-M32 WeakPolarHBondContact O-CG 3.31Å; F28-M32 PolarHBondContact O-N 3.39Å; F28-V170 HydrophobicContact CZ-CG1 4.3Å; F28-A173 HydrophobicContact CD2-CB 4.07Å; F28-A173 HydrophobicContact CE2-CB 3.93Å; F28-A174 HydrophobicContact CE2-CB 4.26Å; F28-P177 HydrophobicContact CB-CG 3.71Å; F28-P177 HydrophobicContact CD2-CG 4.28Å
29T96.4Very high94.2Very high90 Ų9060.3 Ų60.355%0.55235%0.348SS*.Hα-helixtrans-61.7-43.7-180-57.50000111.2G25 G26 N31 M32 F33G25-T29 VanDerWaalsContact O-CB 3.31Å; G25-T29 WeakPolarHBondContact O-CB 3.45Å; G25-T29 PolarHBondContact O-N 3.08Å; G25-T29 PolarHBondContact O-OG1 3.33Å; G26-T29 PolarHBondContact O-N 3.13Å; T29-N31 PolarHBondContact O-N 3.01Å; T29-M32 PolarHBondContact O-N 2.82Å; T29-F33 PolarHBondContact O-N 3.2Å
30A94.9Very high94.1Very high65 Ų6560 Ų6054%0.53735%0.353SS..Hα-helixtrans-60.1-44.8176.700000111.8G26 V27 F28 M32 F33G26-A30 WeakPolarHBondContact O-CB 3.41Å; G26-A30 PolarHBondContact O-N 3.43Å; V27-A30 PolarHBondContact O-N 3.31Å; F28-A30 PolarHBondContact O-N 3.33Å; A30-M32 VanDerWaalsContact C-N 3.34Å; A30-M32 PolarHBondContact O-N 3.4Å; A30-F33 WeakPolarHBondContact O-CB 3.49Å; A30-F33 PolarHBondContact O-N 3.03Å
31N93.7Very high94Very high57 Ų5759.4 Ų59.431%0.30535%0.352SS..Hα-helixtrans-70-29.4178.1-72.5-18.9000113.3V27 F28 T29 Y34 A173V27-N31 PolarHBondContact O-N 2.92Å; F28-N31 PolarHBondContact O-N 2.92Å; T29-N31 PolarHBondContact O-N 3.01Å; N31-Y34 WeakPolarHBondContact O-CE1 3.27Å; N31-A173 HydrophobicContact CB-CB 3.71Å
32M95.6Very high93.8Very high10 Ų1054.9 Ų54.95%0.04933%0.327CS..Hα-helixtrans-84.9-14.5178.4-77.9-56.6-59.500113.8F28 T29 A30 Y34 H35 V36 V95 V170 A173F28-M32 HydrophobicContact CD1-CG 4.08Å; F28-M32 HydrophobicContact CD2-CG 4.4Å; F28-M32 HydrophobicContact CE1-CG 3.62Å; F28-M32 HydrophobicContact CE2-CG 3.98Å; F28-M32 HydrophobicContact CG-CG 4.45Å; F28-M32 HydrophobicContact CZ-CG 3.57Å; F28-M32 HydrophobicContact CZ-SD 4.27Å; F28-M32 WeakPolarHBondContact O-CB 3.39Å; F28-M32 WeakPolarHBondContact O-CG 3.31Å; F28-M32 PolarHBondContact O-N 3.39Å; T29-M32 PolarHBondContact O-N 2.82Å; A30-M32 VanDerWaalsContact C-N 3.34Å; A30-M32 PolarHBondContact O-N 3.4Å; M32-Y34 VanDerWaalsContact C-N 3.34Å; M32-Y34 PolarHBondContact O-N 3.12Å; M32-H35 HydrophobicContact CE-CB 3.85Å; M32-H35 CarbonylContact O-C 3.53Å; M32-H35 WeakPolarHBondContact O-CA 3.33Å; M32-H35 WeakPolarHBondContact O-CB 3.3Å; M32-H35 PolarHBondContact O-N 2.93Å; M32-V36 HydrophobicContact CB-CG2 4.21Å; M32-V36 HydrophobicContact CE-CG2 4.27Å; M32-V36 WeakPolarHBondContact O-CG2 3.25Å; M32-V36 PolarHBondContact O-N 3.4Å; M32-V95 HydrophobicContact CE-CG2 3.76Å; M32-V170 HydrophobicContact CE-CG2 3.87Å; M32-V170 HydrophobicContact SD-CG2 4.21Å; M32-A173 HydrophobicContact CG-CB 3.63Å; M32-A173 HydrophobicContact SD-CB 3.47Å; M32-A173 WeakPolarHBondContact SD-CB 3.41Å
33F93.8Very high93.6Very high119 Ų11956 Ų5652%0.52232%0.318SS..Hα-helixtrans-50.6-50.2-169.7178.7-101.4000113.3T29 A30 H35 V36 F37T29-F33 PolarHBondContact O-N 3.2Å; A30-F33 WeakPolarHBondContact O-CB 3.49Å; A30-F33 PolarHBondContact O-N 3.03Å; F33-H35 PolarHBondContact O-N 3.43Å; F33-V36 PolarHBondContact O-N 2.87Å; F33-F37 HydrophobicContact CD2-CD2 4.09Å; F33-F37 HydrophobicContact CD2-CE2 4.48Å; F33-F37 AromaticContact CE2-CD2 3.99Å; F33-F37 HydrophobicContact CE2-CD2 3.99Å; F33-F37 HydrophobicContact CE2-CE2 4.43Å; F33-F37 PolarHBondContact O-N 3.36Å; F33-F37 VanDerWaalsContact O-N 3.07Å
34Y91.1Very high93.3Very high96 Ų9659.9 Ų59.938%0.37633%0.33SS..Hα-helixtrans-76.4-8.4-17862.1-85.1000114.3N31 M32 P38 S41 Y42N31-Y34 WeakPolarHBondContact O-CE1 3.27Å; M32-Y34 VanDerWaalsContact C-N 3.34Å; M32-Y34 PolarHBondContact O-N 3.12Å; Y34-P38 WeakPolarHBondContact O-CA 3.39Å; Y34-S41 VanDerWaalsContact CA-OG 3.23Å; Y34-S41 WeakPolarHBondContact CA-OG 3.25Å; Y34-S41 WeakPolarHBondContact CB-OG 3.23Å; Y34-Y42 HydrophobicContact CD2-CD2 4.27Å
35H94.7Very high93Very high11 Ų1164.8 Ų64.85%0.05135%0.354CS..Hα-helixtrans-98.5-23173.1-65.2-53.7000112.7M32 F33 A93 G94 V95 P169M32-H35 HydrophobicContact CE-CB 3.85Å; M32-H35 CarbonylContact O-C 3.53Å; M32-H35 WeakPolarHBondContact O-CA 3.33Å; M32-H35 WeakPolarHBondContact O-CB 3.3Å; M32-H35 PolarHBondContact O-N 2.93Å; F33-H35 PolarHBondContact O-N 3.43Å; H35-A93 WeakPolarHBondContact ND1-CB 3.2Å; H35-G94 PolarHBondContact ND1-N 3.4Å; H35-G94 VanDerWaalsContact O-CA 3.3Å; H35-G94 WeakPolarHBondContact O-CA 3.34Å; H35-V95 HydrophobicContact CB-CG2 4.45Å; H35-P169 HydrophobicContact CB-CB 4.28Å
36V94.6Very high92.7Very high47 Ų4767 Ų6729%0.28535%0.353SS..Hα-helixtrans-82.1-34.2172.6178.20000110.6M32 F33 P38 L98 A100M32-V36 HydrophobicContact CB-CG2 4.21Å; M32-V36 HydrophobicContact CE-CG2 4.27Å; M32-V36 WeakPolarHBondContact O-CG2 3.25Å; M32-V36 PolarHBondContact O-N 3.4Å; F33-V36 PolarHBondContact O-N 2.87Å; V36-P38 WeakPolarHBondContact O-CD 3.48Å; V36-L98 HydrophobicContact CG2-CD1 4.12Å; V36-A100 WeakPolarHBondContact O-CB 3.29Å
37F93.8Very high92.5Very high109 Ų10965.5 Ų65.548%0.47834%0.335SS..SBendtrans-123.959.6-179.5-53.2-74.7000112.2F33 D39 S40 S41F33-F37 HydrophobicContact CD2-CD2 4.09Å; F33-F37 HydrophobicContact CD2-CE2 4.48Å; F33-F37 AromaticContact CE2-CD2 3.99Å; F33-F37 HydrophobicContact CE2-CD2 3.99Å; F33-F37 HydrophobicContact CE2-CE2 4.43Å; F33-F37 PolarHBondContact O-N 3.36Å; F33-F37 VanDerWaalsContact O-N 3.07Å; F37-D39 VanDerWaalsContact C-N 3.33Å; F37-D39 PolarHBondContact O-N 3.4Å; F37-S40 PolarHBondContact O-N 3.45Å; F37-S41 PolarHBondContact O-N 2.92Å; F37-S41 PolarHBondContact O-OG 3.47Å
38P92.9Very high92.3Very high0 Ų063.2 Ų63.20%032%0.321CS..THydrogen-bonded Turntrans-61.5-35.7-173.425-34.3000113.3Y34 V36 S40 S41 Y42 R43 A100 Q103Y34-P38 WeakPolarHBondContact O-CA 3.39Å; V36-P38 WeakPolarHBondContact O-CD 3.48Å; P38-S40 PolarHBondContact O-N 2.84Å; P38-S41 PolarHBondContact O-N 2.79Å; P38-Y42 PolarHBondContact O-N 2.97Å; P38-R43 WeakPolarHBondContact O-CB 3.35Å; P38-R43 PolarHBondContact O-N 3.36Å; P38-A100 HydrophobicContact CG-CB 4.21Å; P38-Q103 HydrophobicContact CB-CG 4.09Å; P38-Q103 HydrophobicContact CG-CG 4.08Å
39D91Very high91.9Very high72 Ų7266.6 Ų66.639%0.38533%0.332SS..THydrogen-bonded Turntrans-61.9-43.3178.3-78-53.8000113.3F37 S41 R43 Q103F37-D39 VanDerWaalsContact C-N 3.33Å; F37-D39 PolarHBondContact O-N 3.4Å; D39-S41 VanDerWaalsContact C-N 3.32Å; D39-S41 PolarHBondContact O-N 3.29Å; D39-R43 WeakPolarHBondContact OD1-CD 3.48Å; D39-R43 IonicContact OD1-NH1 3.13Å; D39-R43 PolarHBondContact OD1-NH1 3.45Å; D39-R43 VanDerWaalsContact OD1-NH1 3.13Å; D39-Q103 PolarHBondContact OD1-NE2 2.95Å; D39-Q103 PolarHBondContact OD2-NE2 3.37Å
40S88.9Confident91.3Very high82 Ų8267.9 Ų67.957%0.57333%0.332SS*.THydrogen-bonded Turntrans-83.8-6.3-176-51.90000113.7F37 P38F37-S40 PolarHBondContact O-N 3.45Å; P38-S40 PolarHBondContact O-N 2.84Å
41S89Confident90.9Very high27 Ų2773.8 Ų73.819%0.18935%0.345CS..THydrogen-bonded Turntrans-132.3-77-174.358.80000111.5Y34 F37 P38 D39 R43 Q44 L45Y34-S41 VanDerWaalsContact CA-OG 3.23Å; Y34-S41 WeakPolarHBondContact CA-OG 3.25Å; Y34-S41 WeakPolarHBondContact CB-OG 3.23Å; F37-S41 PolarHBondContact O-N 2.92Å; F37-S41 PolarHBondContact O-OG 3.47Å; P38-S41 PolarHBondContact O-N 2.79Å; D39-S41 VanDerWaalsContact C-N 3.32Å; D39-S41 PolarHBondContact O-N 3.29Å; S41-R43 PolarHBondContact O-N 3.47Å; S41-Q44 PolarHBondContact O-N 2.97Å; S41-L45 PolarHBondContact O-N 2.97Å
42Y88.9Confident90.5Very high27 Ų2773.9 Ų73.911%0.10636%0.36CS..Hα-helixtrans-59.6-46.4-175.2-171.1-98.1000112.8Y34 P38 Q44 L45 Y46 F83 V91 G92 A93Y34-Y42 HydrophobicContact CD2-CD2 4.27Å; P38-Y42 PolarHBondContact O-N 2.97Å; Y42-Q44 PolarHBondContact O-N 3.43Å; Y42-L45 PolarHBondContact O-N 2.93Å; Y42-Y46 HydrophobicContact CD1-CD2 4.16Å; Y42-Y46 AromaticContact CD2-CD2 3.89Å; Y42-Y46 HydrophobicContact CD2-CD2 3.89Å; Y42-Y46 AromaticContact CD2-CE2 3.84Å; Y42-Y46 HydrophobicContact CD2-CE2 3.84Å; Y42-Y46 AromaticContact CE1-CD2 3.91Å; Y42-Y46 HydrophobicContact CE1-CD2 3.91Å; Y42-Y46 HydrophobicContact CE1-CE2 4.46Å; Y42-Y46 AromaticContact CE2-CD2 3.61Å; Y42-Y46 HydrophobicContact CE2-CD2 3.61Å; Y42-Y46 AromaticContact CE2-CE2 3.36Å; Y42-Y46 HydrophobicContact CE2-CE2 3.36Å; Y42-Y46 HydrophobicContact CG-CD2 4.16Å; Y42-Y46 AromaticContact CZ-CD2 3.64Å; Y42-Y46 AromaticContact CZ-CE2 3.73Å; Y42-Y46 WeakPolarHBondContact O-CD2 3.28Å; Y42-Y46 PolarHBondContact O-N 3.49Å; Y42-Y46 VanDerWaalsContact O-N 3.13Å; Y42-F83 HydrophobicContact CD1-CZ 4.42Å; Y42-F83 HydrophobicContact CE1-CZ 4.36Å; Y42-V91 HydrophobicContact CE1-CG2 4.11Å; Y42-V91 VanDerWaalsContact OH-C 3.32Å; Y42-V91 WeakPolarHBondContact OH-CB 3.28Å; Y42-V91 WeakPolarHBondContact OH-CG2 3.39Å; Y42-G92 PolarHBondContact OH-N 2.94Å; Y42-G92 PolarHBondContact OH-O 3.48Å; Y42-A93 HydrophobicContact CD1-CB 3.42Å; Y42-A93 VanDerWaalsContact CD1-CB 3.42Å; Y42-A93 HydrophobicContact CD2-CB 3.48Å; Y42-A93 VanDerWaalsContact CD2-CB 3.48Å; Y42-A93 HydrophobicContact CE1-CB 3.69Å; Y42-A93 HydrophobicContact CE2-CB 3.75Å; Y42-A93 HydrophobicContact CG-CB 3.27Å
43R90.6Very high90.3Very high88 Ų8879.9 Ų79.933%0.33239%0.388SS..Hα-helixtrans-63.6-43.4-179.8-171.5175.1179172.71.7111.5P38 D39 S41 L45 Y46 Q47 F83P38-R43 WeakPolarHBondContact O-CB 3.35Å; P38-R43 PolarHBondContact O-N 3.36Å; D39-R43 WeakPolarHBondContact OD1-CD 3.48Å; D39-R43 IonicContact OD1-NH1 3.13Å; D39-R43 PolarHBondContact OD1-NH1 3.45Å; D39-R43 VanDerWaalsContact OD1-NH1 3.13Å; S41-R43 PolarHBondContact O-N 3.47Å; R43-L45 PolarHBondContact O-N 3.38Å; R43-Y46 PolarHBondContact O-N 3.23Å; R43-Q47 HydrophobicContact CG-CB 4.44Å; R43-Q47 WeakPolarHBondContact O-CA 3.23Å; R43-Q47 WeakPolarHBondContact O-CB 3.43Å; R43-Q47 PolarHBondContact O-N 2.97Å; R43-F83 HydrophobicContact CG-CD1 4.43Å; R43-F83 HydrophobicContact CG-CD2 4.22Å; R43-F83 HydrophobicContact CG-CE1 4.5Å; R43-F83 HydrophobicContact CG-CE2 4.3Å; R43-F83 HydrophobicContact CG-CG 4.3Å; R43-F83 HydrophobicContact CG-CZ 4.44Å
44Q88.3Confident90.1Very high132 Ų13277 Ų7762%0.61738%0.381SS*.Hα-helixtrans-58.7-36.4177.4-66.5-171-4.400112.6S41 Y42S41-Q44 PolarHBondContact O-N 2.97Å; Y42-Q44 PolarHBondContact O-N 3.43Å
45L88.3Confident90.1Very high129 Ų12974.4 Ų74.468%0.67538%0.375SS*.Hα-helixtrans-71.9-38.1179.4-177.662.3000113.1S41 Y42 R43S41-L45 PolarHBondContact O-N 2.97Å; Y42-L45 PolarHBondContact O-N 2.93Å; R43-L45 PolarHBondContact O-N 3.38Å
46Y91.3Very high90Very high81 Ų8179.9 Ų79.932%0.31841%0.409SS..Hα-helixtrans-105.8-9.9-172.3-73.2-77.8000114.6Y42 R43 A48 S85 F86 V91Y42-Y46 HydrophobicContact CD1-CD2 4.16Å; Y42-Y46 AromaticContact CD2-CD2 3.89Å; Y42-Y46 HydrophobicContact CD2-CD2 3.89Å; Y42-Y46 AromaticContact CD2-CE2 3.84Å; Y42-Y46 HydrophobicContact CD2-CE2 3.84Å; Y42-Y46 AromaticContact CE1-CD2 3.91Å; Y42-Y46 HydrophobicContact CE1-CD2 3.91Å; Y42-Y46 HydrophobicContact CE1-CE2 4.46Å; Y42-Y46 AromaticContact CE2-CD2 3.61Å; Y42-Y46 HydrophobicContact CE2-CD2 3.61Å; Y42-Y46 AromaticContact CE2-CE2 3.36Å; Y42-Y46 HydrophobicContact CE2-CE2 3.36Å; Y42-Y46 HydrophobicContact CG-CD2 4.16Å; Y42-Y46 AromaticContact CZ-CD2 3.64Å; Y42-Y46 AromaticContact CZ-CE2 3.73Å; Y42-Y46 WeakPolarHBondContact O-CD2 3.28Å; Y42-Y46 PolarHBondContact O-N 3.49Å; Y42-Y46 VanDerWaalsContact O-N 3.13Å; R43-Y46 PolarHBondContact O-N 3.23Å; Y46-A48 PolarHBondContact O-N 3.05Å; Y46-S85 CarbonylContact O-C 3.44Å; Y46-S85 WeakPolarHBondContact O-CA 3.49Å; Y46-S85 WeakPolarHBondContact O-CB 3.46Å; Y46-F86 PolarHBondContact O-N 2.57Å; Y46-V91 HydrophobicContact CD1-CG1 4.44Å; Y46-V91 HydrophobicContact CD1-CG2 3.91Å; Y46-V91 HydrophobicContact CD2-CG2 4.5Å; Y46-V91 HydrophobicContact CE1-CG1 4.35Å; Y46-V91 HydrophobicContact CE1-CG2 4.46Å; Y46-V91 HydrophobicContact CG-CG2 3.93Å
47Q93.1Very high90Very high9 Ų978.7 Ų78.74%0.04240%0.401CS..BIsolated β-bridgetrans-59.4134.7-179.4176.366.959.300110.4R43 W49 P54 V55 A84R43-Q47 HydrophobicContact CG-CB 4.44Å; R43-Q47 WeakPolarHBondContact O-CA 3.23Å; R43-Q47 WeakPolarHBondContact O-CB 3.43Å; R43-Q47 PolarHBondContact O-N 2.97Å; Q47-W49 HydrophobicContact CB-CZ2 4.25Å; Q47-W49 HydrophobicContact CG-CD2 4.34Å; Q47-W49 HydrophobicContact CG-CZ2 3.97Å; Q47-W49 PolarHBondContact O-NE1 3.42Å; Q47-P54 HydrophobicContact CG-CB 4.03Å; Q47-V55 PolarHBondContact NE2-O 2.85Å; Q47-V55 VanDerWaalsContact NE2-O 3.11Å; Q47-A84 PolarHBondContact NE2-O 3.21Å
48A90.4Very high90Very high6 Ų675.2 Ų75.25%0.0539%0.39CS..  trans-75.7134.7168.300000109.5Y46 V55 A84Y46-A48 PolarHBondContact O-N 3.05Å; A48-V55 HydrophobicContact CB-CB 4.03Å; A48-V55 HydrophobicContact CB-CG2 4.15Å; A48-V55 PolarHBondContact O-N 3.25Å; A48-A84 HydrophobicContact CB-CB 4.21Å; A48-A84 WeakPolarHBondContact CB-O 3.25Å; A48-A84 PolarHBondContact N-O 3.2Å
49W88.9Confident90.1Very high141 Ų14183.6 Ų83.653%0.53443%0.429SS..EExtended strand (participates in β ladder)trans-120.9142.9-179.6-60.188.4000110.5Q47 E53 P54Q47-W49 HydrophobicContact CB-CZ2 4.25Å; Q47-W49 HydrophobicContact CG-CD2 4.34Å; Q47-W49 HydrophobicContact CG-CZ2 3.97Å; Q47-W49 PolarHBondContact O-NE1 3.42Å; W49-E53 WeakPolarHBondContact CA-O 3.48Å; W49-E53 VanDerWaalsContact CE3-C 3.49Å; W49-P54 HydrophobicContact CE3-CG 4.11Å; W49-P54 HydrophobicContact CH2-CG 3.9Å; W49-P54 HydrophobicContact CZ3-CB 4.37Å; W49-P54 HydrophobicContact CZ3-CG 3.54Å
50H84.5Confident90.3Very high118 Ų11884.2 Ų84.255%0.54643%0.428SS..EExtended strand (participates in β ladder)trans-139.6120.9172.7174.8-97.2000109.1G52 E53 V55H50-G52 PolarHBondContact O-N 3.21Å; H50-E53 PolarHBondContact N-O 2.83Å; H50-E53 PolarHBondContact O-N 3.2Å; H50-E53 VanDerWaalsContact O-N 3.14Å; H50-V55 HydrophobicContact CB-CG2 3.64Å
51K86.7Confident90.7Very high189 Ų18980.3 Ų80.382%0.82240%0.401SS*.THydrogen-bonded Turntrans5338.9-176.8-60.9-179.3179.3-178.40113.8E53K51-E53 VanDerWaalsContact C-N 3.27Å; K51-E53 PolarHBondContact O-N 3.46Å
52G85.3Confident91Very high59 Ų5982.2 Ų82.261%0.60841%0.407SS*.THydrogen-bonded Turntrans84.5-7.6178.400000115H50H50-G52 PolarHBondContact O-N 3.21Å
53E89.4Confident91.4Very high136 Ų13684.6 Ų84.664%0.63643%0.428SS*.EExtended strand (participates in β ladder)trans-105.8147-179.3-68.4-61.615100112.2W49 H50 K51 V55W49-E53 WeakPolarHBondContact CA-O 3.48Å; W49-E53 VanDerWaalsContact CE3-C 3.49Å; H50-E53 PolarHBondContact N-O 2.83Å; H50-E53 PolarHBondContact O-N 3.2Å; H50-E53 VanDerWaalsContact O-N 3.14Å; K51-E53 VanDerWaalsContact C-N 3.27Å; K51-E53 PolarHBondContact O-N 3.46Å; E53-V55 PolarHBondContact O-N 2.97Å
54P90.8Very high91.7Very high59 Ų5981.3 Ų81.338%0.38342%0.417SS..EExtended strand (participates in β ladder)trans-62128.3172.9-17.829.9000110.8Q47 W49 V56Q47-P54 HydrophobicContact CG-CB 4.03Å; W49-P54 HydrophobicContact CE3-CG 4.11Å; W49-P54 HydrophobicContact CH2-CG 3.9Å; W49-P54 HydrophobicContact CZ3-CB 4.37Å; W49-P54 HydrophobicContact CZ3-CG 3.54Å; P54-V56 PolarHBondContact O-N 2.84Å
55V91.1Very high92.2Very high40 Ų4075 Ų7524%0.24239%0.388CS..PPolyproline II helixtrans-69.1128.4172.6178.90000109.2Q47 A48 H50 E53 A84Q47-V55 PolarHBondContact NE2-O 2.85Å; Q47-V55 VanDerWaalsContact NE2-O 3.11Å; A48-V55 HydrophobicContact CB-CB 4.03Å; A48-V55 HydrophobicContact CB-CG2 4.15Å; A48-V55 PolarHBondContact O-N 3.25Å; H50-V55 HydrophobicContact CB-CG2 3.64Å; E53-V55 PolarHBondContact O-N 2.97Å; V55-A84 HydrophobicContact CB-CB 4.19Å; V55-A84 HydrophobicContact CG1-CB 4.06Å; V55-A84 WeakPolarHBondContact O-CB 3.33Å
56V92.8Very high92.7Very high127 Ų12772.8 Ų72.877%0.7737%0.374SS*.PPolyproline II helixtrans-75.5141.6173.6-175.40000109.3P54P54-V56 PolarHBondContact O-N 2.84Å
57L94Very high92.9Very high22 Ų2272.5 Ų72.512%0.11538%0.376CS..PPolyproline II helixtrans-66.5137.4174.3-16869000109.5L61 E62 A82 A84 I106L57-L61 HydrophobicContact CD1-CB 3.76Å; L57-L61 HydrophobicContact CD1-CD1 3.86Å; L57-L61 HydrophobicContact CD1-CG 4.48Å; L57-L61 HydrophobicContact CD2-CB 4.19Å; L57-L61 HydrophobicContact CG-CB 3.86Å; L57-E62 HydrophobicContact CD2-CB 4.37Å; L57-E62 WeakPolarHBondContact CD2-OE2 3.29Å; L57-A82 HydrophobicContact CD2-CB 3.64Å; L57-A84 HydrophobicContact CD1-CB 4.28Å; L57-I106 HydrophobicContact CD1-CB 4.02Å; L57-I106 HydrophobicContact CD2-CD1 4.16Å
58S94Very high93.2Very high35 Ų3572.1 Ų72.125%0.24537%0.374CS..PPolyproline II helixtrans-68151.517961.50000111.3K60 L61 E62 N111S58-K60 PolarHBondContact O-N 2.98Å; S58-L61 PolarHBondContact O-N 3.45Å; S58-L61 VanDerWaalsContact OG-CG 3.29Å; S58-L61 WeakPolarHBondContact OG-CG 3.22Å; S58-L61 PolarHBondContact OG-N 3.32Å; S58-E62 PolarHBondContact O-N 3.32Å; S58-N111 WeakPolarHBondContact CB-OD1 3.42Å; S58-N111 PolarHBondContact OG-OD1 3.31Å
59E95.7Very high93.5Very high177 Ų17771.9 Ų71.983%0.82737%0.372SS*.Hα-helixtrans-56.6-36.1177.6-64.4-179.3176.500112.5S63E59-S63 VanDerWaalsContact O-CB 3.27Å; E59-S63 WeakPolarHBondContact O-CB 3.36Å; E59-S63 PolarHBondContact O-N 3.38Å
60K94.8Very high93.9Very high84 Ų8473.3 Ų73.337%0.36538%0.382SS..Hα-helixtrans-56.1-51.7173.4-179.3-166.6178.3-164.60111.1S58 S63 V64 F110 N111S58-K60 PolarHBondContact O-N 2.98Å; K60-S63 PolarHBondContact O-N 2.99Å; K60-V64 WeakPolarHBondContact O-CG2 3.49Å; K60-V64 PolarHBondContact O-N 3.35Å; K60-F110 PolarHBondContact NZ-O 3.5Å; K60-N111 PolarHBondContact NZ-O 2.92Å
61L96Very high94.4Very high1 Ų171.2 Ų71.21%0.00537%0.374CS..Hα-helixtrans-74.8-34.1-175.3-64.2179.6000112.1L57 S58 S63 V64 F65 I106 F110L57-L61 HydrophobicContact CD1-CB 3.76Å; L57-L61 HydrophobicContact CD1-CD1 3.86Å; L57-L61 HydrophobicContact CD1-CG 4.48Å; L57-L61 HydrophobicContact CD2-CB 4.19Å; L57-L61 HydrophobicContact CG-CB 3.86Å; S58-L61 PolarHBondContact O-N 3.45Å; S58-L61 VanDerWaalsContact OG-CG 3.29Å; S58-L61 WeakPolarHBondContact OG-CG 3.22Å; S58-L61 PolarHBondContact OG-N 3.32Å; L61-S63 VanDerWaalsContact C-N 3.34Å; L61-V64 PolarHBondContact O-N 3.44Å; L61-F65 WeakPolarHBondContact O-CB 3.48Å; L61-F65 PolarHBondContact O-N 2.84Å; L61-I106 HydrophobicContact CB-CG2 4.44Å; L61-I106 HydrophobicContact CD1-CG2 3.98Å; L61-I106 HydrophobicContact CD2-CG2 4.3Å; L61-I106 HydrophobicContact CG-CG2 4.47Å; L61-F110 HydrophobicContact CD1-CB 4.22Å; L61-F110 HydrophobicContact CD2-CB 3.45Å; L61-F110 VanDerWaalsContact CD2-CB 3.45Å; L61-F110 HydrophobicContact CG-CB 4.49Å
62E96.9Very high94.7Very high67 Ų6763.9 Ų63.931%0.31334%0.343SS..Hα-helixtrans-60.1-46.3170.2-171.862.7-142.600110.3L57 S58 V64 F65 Q66L57-E62 HydrophobicContact CD2-CB 4.37Å; L57-E62 WeakPolarHBondContact CD2-OE2 3.29Å; S58-E62 PolarHBondContact O-N 3.32Å; E62-V64 PolarHBondContact O-N 2.99Å; E62-F65 WeakPolarHBondContact O-CB 3.34Å; E62-F65 PolarHBondContact O-N 2.98Å; E62-Q66 VanDerWaalsContact O-CG 3.31Å; E62-Q66 WeakPolarHBondContact O-CG 3.44Å; E62-Q66 PolarHBondContact O-N 3.48Å; E62-Q66 PolarHBondContact OE1-NE2 3.46Å
63S97.1Very high95.1Very high77 Ų7763.7 Ų63.754%0.53834%0.341SS..Hα-helixtrans-60.7-44.4176.6-178.50000112.6E59 K60 L61 F65 Q66 Q67E59-S63 VanDerWaalsContact O-CB 3.27Å; E59-S63 WeakPolarHBondContact O-CB 3.36Å; E59-S63 PolarHBondContact O-N 3.38Å; K60-S63 PolarHBondContact O-N 2.99Å; L61-S63 VanDerWaalsContact C-N 3.34Å; S63-F65 VanDerWaalsContact C-N 3.33Å; S63-F65 PolarHBondContact O-N 3.17Å; S63-Q66 PolarHBondContact O-N 3.36Å; S63-Q67 WeakPolarHBondContact O-CB 3.23Å; S63-Q67 PolarHBondContact O-N 2.77Å
64V97.3Very high95.3Very high18 Ų1858.3 Ų58.311%0.10932%0.316CS..Hα-helixtrans-61.3-43175.1174.10000111K60 L61 E62 Q67 V68 K154 I157K60-V64 WeakPolarHBondContact O-CG2 3.49Å; K60-V64 PolarHBondContact O-N 3.35Å; L61-V64 PolarHBondContact O-N 3.44Å; E62-V64 PolarHBondContact O-N 2.99Å; V64-Q67 PolarHBondContact O-N 3.42Å; V64-V68 VanDerWaalsContact O-CG2 3.3Å; V64-V68 WeakPolarHBondContact O-CG2 3.34Å; V64-V68 PolarHBondContact O-N 3.41Å; V64-K154 HydrophobicContact CG1-CG 3.94Å; V64-I157 HydrophobicContact CG1-CD1 3.75Å
65F98.1Very high95Very high0 Ų061.5 Ų61.50%034%0.34CS..Hα-helixtrans-61.7-49.7177.2172.7-112.9000112.1L61 E62 S63 Q67 V68 L69 F80 A82 I104 I106 I157L61-F65 WeakPolarHBondContact O-CB 3.48Å; L61-F65 PolarHBondContact O-N 2.84Å; E62-F65 WeakPolarHBondContact O-CB 3.34Å; E62-F65 PolarHBondContact O-N 2.98Å; S63-F65 VanDerWaalsContact C-N 3.33Å; S63-F65 PolarHBondContact O-N 3.17Å; F65-Q67 VanDerWaalsContact C-N 3.3Å; F65-Q67 PolarHBondContact O-N 2.74Å; F65-V68 WeakPolarHBondContact O-CB 3.31Å; F65-V68 PolarHBondContact O-N 3.31Å; F65-V68 VanDerWaalsContact O-N 3.12Å; F65-L69 HydrophobicContact CD1-CD1 4.26Å; F65-L69 HydrophobicContact CE1-CD1 3.68Å; F65-L69 HydrophobicContact CE1-CG 4.41Å; F65-L69 HydrophobicContact CE2-CD1 4.24Å; F65-L69 HydrophobicContact CE2-CD2 4.16Å; F65-L69 HydrophobicContact CE2-CG 4.19Å; F65-L69 HydrophobicContact CZ-CD1 3.7Å; F65-L69 HydrophobicContact CZ-CD2 4.28Å; F65-L69 HydrophobicContact CZ-CG 4.16Å; F65-L69 WeakPolarHBondContact O-CG 3.34Å; F65-L69 PolarHBondContact O-N 2.99Å; F65-F80 HydrophobicContact CZ-CB 3.92Å; F65-A82 HydrophobicContact CB-CB 4.32Å; F65-A82 HydrophobicContact CD1-CB 3.58Å; F65-A82 HydrophobicContact CD2-CB 4.01Å; F65-A82 HydrophobicContact CE1-CB 3.73Å; F65-A82 HydrophobicContact CE2-CB 4.15Å; F65-A82 HydrophobicContact CG-CB 3.71Å; F65-A82 HydrophobicContact CZ-CB 3.98Å; F65-I104 HydrophobicContact CE2-CB 4.35Å; F65-I104 HydrophobicContact CE2-CD1 4.12Å; F65-I106 HydrophobicContact CB-CD1 3.92Å; F65-I106 HydrophobicContact CD2-CD1 4.35Å; F65-I106 HydrophobicContact CG-CD1 4.38Å; F65-I157 HydrophobicContact CD2-CG2 3.88Å
66Q97.6Very high94.9Very high82 Ų8262.1 Ų62.138%0.38335%0.346SS..Hα-helixtrans-61.9-38.9177.4-65-56.7-3100111.9E62 S63 L69 K70E62-Q66 VanDerWaalsContact O-CG 3.31Å; E62-Q66 WeakPolarHBondContact O-CG 3.44Å; E62-Q66 PolarHBondContact O-N 3.48Å; E62-Q66 PolarHBondContact OE1-NE2 3.46Å; S63-Q66 PolarHBondContact O-N 3.36Å; Q66-L69 PolarHBondContact O-N 3.47Å; Q66-K70 WeakPolarHBondContact O-CB 3.28Å; Q66-K70 PolarHBondContact O-N 2.86Å
67Q97.2Very high94.8Very high76 Ų7657.9 Ų57.936%0.35532%0.324SS..Hα-helixtrans-60.2-46172.7177.1165.622.900111.3S63 V64 F65 L69 K70 D71 K154S63-Q67 WeakPolarHBondContact O-CB 3.23Å; S63-Q67 PolarHBondContact O-N 2.77Å; V64-Q67 PolarHBondContact O-N 3.42Å; F65-Q67 VanDerWaalsContact C-N 3.3Å; F65-Q67 PolarHBondContact O-N 2.74Å; Q67-L69 VanDerWaalsContact C-N 3.35Å; Q67-L69 PolarHBondContact O-N 2.89Å; Q67-K70 WeakPolarHBondContact O-CB 3.35Å; Q67-K70 PolarHBondContact O-N 2.88Å; Q67-D71 VanDerWaalsContact CG-OD2 3.32Å; Q67-D71 WeakPolarHBondContact CG-OD2 3.14Å; Q67-D71 WeakPolarHBondContact O-CB 3.29Å; Q67-D71 PolarHBondContact O-N 3.19Å; Q67-K154 VanDerWaalsContact CD-CE 3.5Å
68V98.1Very high94.8Very high0 Ų065.5 Ų65.50%036%0.357CS..Hα-helixtrans-60.4-43.8177.5168.60000111.5V64 F65 K70 D71 F72 K154 I157 A158 V161 Y245V64-V68 VanDerWaalsContact O-CG2 3.3Å; V64-V68 WeakPolarHBondContact O-CG2 3.34Å; V64-V68 PolarHBondContact O-N 3.41Å; F65-V68 WeakPolarHBondContact O-CB 3.31Å; F65-V68 PolarHBondContact O-N 3.31Å; F65-V68 VanDerWaalsContact O-N 3.12Å; V68-K70 VanDerWaalsContact C-N 3.29Å; V68-K70 PolarHBondContact O-N 3.08Å; V68-D71 PolarHBondContact O-N 3.45Å; V68-F72 VanDerWaalsContact O-CB 3.26Å; V68-F72 WeakPolarHBondContact O-CB 3.2Å; V68-F72 PolarHBondContact O-N 2.81Å; V68-K154 HydrophobicContact CG2-CB 4.1Å; V68-K154 HydrophobicContact CG2-CG 4.1Å; V68-I157 HydrophobicContact CB-CG2 4.13Å; V68-I157 HydrophobicContact CG1-CG2 3.95Å; V68-I157 HydrophobicContact CG2-CB 4.23Å; V68-I157 HydrophobicContact CG2-CG2 4.17Å; V68-A158 HydrophobicContact CG1-CB 3.71Å; V68-V161 HydrophobicContact CG1-CG2 4.18Å; V68-Y245 HydrophobicContact CG2-CE1 4.45Å; V68-Y245 WeakPolarHBondContact CG2-OH 3.49Å
69L97.6Very high94.8Very high2 Ų266.2 Ų66.21%0.0136%0.357CS..Hα-helixtrans-60.8-39.9177.1-65.5-178.3000112F65 Q66 Q67 G73 I74 A77 F80 V161F65-L69 HydrophobicContact CD1-CD1 4.26Å; F65-L69 HydrophobicContact CE1-CD1 3.68Å; F65-L69 HydrophobicContact CE1-CG 4.41Å; F65-L69 HydrophobicContact CE2-CD1 4.24Å; F65-L69 HydrophobicContact CE2-CD2 4.16Å; F65-L69 HydrophobicContact CE2-CG 4.19Å; F65-L69 HydrophobicContact CZ-CD1 3.7Å; F65-L69 HydrophobicContact CZ-CD2 4.28Å; F65-L69 HydrophobicContact CZ-CG 4.16Å; F65-L69 WeakPolarHBondContact O-CG 3.34Å; F65-L69 PolarHBondContact O-N 2.99Å; Q66-L69 PolarHBondContact O-N 3.47Å; Q67-L69 VanDerWaalsContact C-N 3.35Å; Q67-L69 PolarHBondContact O-N 2.89Å; L69-G73 PolarHBondContact O-N 3.29Å; L69-I74 HydrophobicContact CD2-CG1 4.07Å; L69-I74 PolarHBondContact O-N 2.87Å; L69-I74 VanDerWaalsContact O-N 3.08Å; L69-A77 HydrophobicContact CD1-CB 4.09Å; L69-F80 HydrophobicContact CD1-CB 3.94Å; L69-F80 HydrophobicContact CD2-CB 3.93Å; L69-F80 HydrophobicContact CD2-CD1 4.24Å; L69-F80 HydrophobicContact CD2-CD2 4.31Å; L69-F80 HydrophobicContact CD2-CG 3.92Å; L69-V161 HydrophobicContact CD2-CG1 4.16Å; L69-V161 HydrophobicContact CD2-CG2 3.94Å
70K96.7Very high94.9Very high171 Ų17158.3 Ų58.374%0.74332%0.32SS*.Hα-helixtrans-66.1-50.8176.3-176.9-177.1177.7-176.30111.5Q66 Q67 V68 F72 G73Q66-K70 WeakPolarHBondContact O-CB 3.28Å; Q66-K70 PolarHBondContact O-N 2.86Å; Q67-K70 WeakPolarHBondContact O-CB 3.35Å; Q67-K70 PolarHBondContact O-N 2.88Å; V68-K70 VanDerWaalsContact C-N 3.29Å; V68-K70 PolarHBondContact O-N 3.08Å; K70-F72 PolarHBondContact O-N 3.39Å; K70-G73 PolarHBondContact O-N 2.89Å
71D96Very high95Very high73 Ų7356.5 Ų56.539%0.3932%0.318SS..Hα-helixtrans-62.6-34.1-178.4-65.9-9.6000110.6Q67 V68 G73 M241 Y245Q67-D71 VanDerWaalsContact CG-OD2 3.32Å; Q67-D71 WeakPolarHBondContact CG-OD2 3.14Å; Q67-D71 WeakPolarHBondContact O-CB 3.29Å; Q67-D71 PolarHBondContact O-N 3.19Å; V68-D71 PolarHBondContact O-N 3.45Å; D71-G73 VanDerWaalsContact C-N 3.27Å; D71-G73 PolarHBondContact O-N 3.44Å; D71-M241 HydrophobicContact CB-CE 3.46Å; D71-M241 VanDerWaalsContact CB-CE 3.46Å; D71-M241 WeakPolarHBondContact O-CE 3.49Å; D71-Y245 HydrophobicContact CB-CE2 4.46Å; D71-Y245 PolarHBondContact OD2-OH 3.47Å
72F92.9Very high95Very high35 Ų3557.3 Ų57.315%0.15433%0.326CS..THydrogen-bonded Turntrans-77.6-9.4177-151.9-85.8000113.4V68 K70 I74 V161 A162 R237 M241V68-F72 VanDerWaalsContact O-CB 3.26Å; V68-F72 WeakPolarHBondContact O-CB 3.2Å; V68-F72 PolarHBondContact O-N 2.81Å; K70-F72 PolarHBondContact O-N 3.39Å; F72-I74 HydrophobicContact CB-CG1 4.25Å; F72-I74 HydrophobicContact CD1-CD1 3.72Å; F72-I74 HydrophobicContact CD1-CG1 4.26Å; F72-I74 HydrophobicContact CE1-CD1 4.43Å; F72-V161 HydrophobicContact CD1-CG1 4.22Å; F72-V161 HydrophobicContact CG-CG1 4.23Å; F72-A162 HydrophobicContact CE2-CB 3.78Å; F72-A162 HydrophobicContact CZ-CB 3.53Å; F72-R237 HydrophobicContact CE2-CB 4.49Å; F72-R237 HydrophobicContact CZ-CB 4.27Å; F72-M241 HydrophobicContact CB-CE 3.92Å; F72-M241 HydrophobicContact CD2-CE 3.95Å; F72-M241 HydrophobicContact CD2-CG 4.25Å; F72-M241 HydrophobicContact CD2-SD 3.41Å; F72-M241 WeakPolarHBondContact CD2-SD 3.18Å; F72-M241 HydrophobicContact CE2-SD 4.02Å; F72-M241 HydrophobicContact CG-CE 4.39Å; F72-M241 HydrophobicContact CG-SD 4.39Å; F72-M241 VanDerWaalsContact N-CE 3.27Å
73G93Very high95Very high56 Ų5654.4 Ų54.458%0.57731%0.312SS*.THydrogen-bonded Turntrans70.932.1179.900000114.1L69 K70 D71 S75L69-G73 PolarHBondContact O-N 3.29Å; K70-G73 PolarHBondContact O-N 2.89Å; D71-G73 VanDerWaalsContact C-N 3.27Å; D71-G73 PolarHBondContact O-N 3.44Å; G73-S75 PolarHBondContact O-N 3.18Å; G73-S75 VanDerWaalsContact O-N 3.13Å
74I92.9Very high94.9Very high22 Ų2251 Ų5111%0.11329%0.288CS..  trans-66.7112.7178.6-61.8-63.2000109.9L69 F72 S76 F80 V161 Q165L69-I74 HydrophobicContact CD2-CG1 4.07Å; L69-I74 PolarHBondContact O-N 2.87Å; L69-I74 VanDerWaalsContact O-N 3.08Å; F72-I74 HydrophobicContact CB-CG1 4.25Å; F72-I74 HydrophobicContact CD1-CD1 3.72Å; F72-I74 HydrophobicContact CD1-CG1 4.26Å; F72-I74 HydrophobicContact CE1-CD1 4.43Å; I74-S76 VanDerWaalsContact C-N 3.28Å; I74-S76 PolarHBondContact O-N 3.01Å; I74-F80 HydrophobicContact CD1-CE2 4.13Å; I74-F80 HydrophobicContact CD1-CZ 4.32Å; I74-F80 HydrophobicContact CG1-CE2 4.43Å; I74-F80 HydrophobicContact CG2-CD2 3.78Å; I74-F80 HydrophobicContact CG2-CE2 3.71Å; I74-V161 HydrophobicContact CD1-CG1 3.9Å; I74-V161 HydrophobicContact CG1-CG1 4.05Å; I74-Q165 HydrophobicContact CD1-CB 4.44Å; I74-Q165 HydrophobicContact CD1-CG 3.99Å
75S84.8Confident94.7Very high127 Ų12750.1 Ų50.189%0.88828%0.283SS*.THydrogen-bonded Turntrans-65.2-30.4-176.6-42.80000113.5G73G73-S75 PolarHBondContact O-N 3.18Å; G73-S75 VanDerWaalsContact O-N 3.13Å
76S88.9Confident94.1Very high53 Ų5357.7 Ų57.737%0.37132%0.316SS..THydrogen-bonded Turntrans-122.868.5-178.5-66.80000110.6I74 K78 N79I74-S76 VanDerWaalsContact C-N 3.28Å; I74-S76 PolarHBondContact O-N 3.01Å; S76-K78 PolarHBondContact O-N 3.09Å; S76-K78 VanDerWaalsContact O-N 3.09Å; S76-N79 WeakPolarHBondContact O-CB 3.49Å; S76-N79 PolarHBondContact O-N 3.35Å
77A91.4Very high93.6Very high37 Ų3755 Ų5531%0.30631%0.311SS..G310 helixtrans-54.1-30.1179.600000113L69 N79 F80L69-A77 HydrophobicContact CD1-CB 4.09Å; A77-N79 PolarHBondContact O-N 2.91Å; A77-N79 VanDerWaalsContact O-N 3.09Å; A77-F80 PolarHBondContact O-N 3.02Å; A77-F80 VanDerWaalsContact O-O 3.07Å
78K93.4Very high93.2Very high183 Ų18353.9 Ų53.980%0.79631%0.305SS*.G310 helixtrans-58.3-19.8174.571.3-178.9-177.6177.40114.9S76 F80S76-K78 PolarHBondContact O-N 3.09Å; S76-K78 VanDerWaalsContact O-N 3.09Å; K78-F80 VanDerWaalsContact C-N 3.25Å
79N95.1Very high92.9Very high49 Ų4957.4 Ų57.426%0.26232%0.321SS..G310 helixtrans-86.6-0.8178-63.31000112.2S76 A77 P96 G101 A102S76-N79 WeakPolarHBondContact O-CB 3.49Å; S76-N79 PolarHBondContact O-N 3.35Å; A77-N79 PolarHBondContact O-N 2.91Å; A77-N79 VanDerWaalsContact O-N 3.09Å; N79-P96 WeakPolarHBondContact CB-O 3.17Å; N79-P96 VanDerWaalsContact CG-O 3.3Å; N79-P96 PolarHBondContact ND2-O 2.7Å; N79-G101 CarbonylContact O-C 3.36Å; N79-G101 VanDerWaalsContact O-CA 3.27Å; N79-G101 WeakPolarHBondContact O-CA 2.99Å; N79-A102 PolarHBondContact O-N 3.4Å
80F96.9Very high92.7Very high11 Ų1157.3 Ų57.35%0.04832%0.321CS..EExtended strand (participates in β ladder)trans-116.8136.6174-74.8-95.5000109.3F65 L69 I74 A77 K78 P96 A102 I104 V161 L164 Q165F65-F80 HydrophobicContact CZ-CB 3.92Å; L69-F80 HydrophobicContact CD1-CB 3.94Å; L69-F80 HydrophobicContact CD2-CB 3.93Å; L69-F80 HydrophobicContact CD2-CD1 4.24Å; L69-F80 HydrophobicContact CD2-CD2 4.31Å; L69-F80 HydrophobicContact CD2-CG 3.92Å; I74-F80 HydrophobicContact CD1-CE2 4.13Å; I74-F80 HydrophobicContact CD1-CZ 4.32Å; I74-F80 HydrophobicContact CG1-CE2 4.43Å; I74-F80 HydrophobicContact CG2-CD2 3.78Å; I74-F80 HydrophobicContact CG2-CE2 3.71Å; A77-F80 PolarHBondContact O-N 3.02Å; A77-F80 VanDerWaalsContact O-O 3.07Å; K78-F80 VanDerWaalsContact C-N 3.25Å; F80-P96 HydrophobicContact CD2-CB 4.41Å; F80-P96 HydrophobicContact CE1-CG 3.9Å; F80-P96 HydrophobicContact CE2-CB 3.65Å; F80-P96 HydrophobicContact CE2-CG 3.78Å; F80-P96 HydrophobicContact CZ-CB 3.76Å; F80-P96 HydrophobicContact CZ-CG 3.31Å; F80-A102 CarbonylContact C-O 3.55Å; F80-A102 VanDerWaalsContact CA-O 3.29Å; F80-A102 WeakPolarHBondContact CA-O 3.41Å; F80-A102 HydrophobicContact CD1-CB 3.8Å; F80-A102 HydrophobicContact CE1-CB 3.81Å; F80-A102 HydrophobicContact CG-CB 4.44Å; F80-A102 HydrophobicContact CZ-CB 4.47Å; F80-I104 HydrophobicContact CD1-CD1 4.48Å; F80-V161 HydrophobicContact CE1-CG1 4.14Å; F80-V161 HydrophobicContact CZ-CG1 4.28Å; F80-L164 HydrophobicContact CE1-CB 4.23Å; F80-Q165 HydrophobicContact CZ-CB 4.28Å
81S96.7Very high92.6Very high46 Ų4649.9 Ų49.932%0.32229%0.29SS..EExtended strand (participates in β ladder)trans-133.3152.4172.363.30000110.9A102 Q103 I104S81-A102 PolarHBondContact N-O 3.29Å; S81-Q103 CarbonylContact O-C 3.53Å; S81-Q103 VanDerWaalsContact O-CA 3.31Å; S81-Q103 WeakPolarHBondContact O-CA 3.46Å; S81-I104 PolarHBondContact O-N 2.93Å
82A97Very high92.5Very high19 Ų1946.6 Ų46.616%0.15727%0.273CS..EExtended strand (participates in β ladder)trans-113.9151.8174.900000111L57 F65 I104 I106L57-A82 HydrophobicContact CD2-CB 3.64Å; F65-A82 HydrophobicContact CB-CB 4.32Å; F65-A82 HydrophobicContact CD1-CB 3.58Å; F65-A82 HydrophobicContact CD2-CB 4.01Å; F65-A82 HydrophobicContact CE1-CB 3.73Å; F65-A82 HydrophobicContact CE2-CB 4.15Å; F65-A82 HydrophobicContact CG-CB 3.71Å; F65-A82 HydrophobicContact CZ-CB 3.98Å; A82-I104 WeakPolarHBondContact CA-O 3.3Å; A82-I106 HydrophobicContact CB-CD1 3.95Å; A82-I106 HydrophobicContact CB-CG1 4.5Å
83F96.3Very high92.7Very high5 Ų544.9 Ų44.92%0.02227%0.266CS..EExtended strand (participates in β ladder)trans-142.9157.6173.167.5-85.2000110.4Y42 R43 S85 Q103 I104 G105 I106Y42-F83 HydrophobicContact CD1-CZ 4.42Å; Y42-F83 HydrophobicContact CE1-CZ 4.36Å; R43-F83 HydrophobicContact CG-CD1 4.43Å; R43-F83 HydrophobicContact CG-CD2 4.22Å; R43-F83 HydrophobicContact CG-CE1 4.5Å; R43-F83 HydrophobicContact CG-CE2 4.3Å; R43-F83 HydrophobicContact CG-CG 4.3Å; R43-F83 HydrophobicContact CG-CZ 4.44Å; F83-S85 PolarHBondContact O-N 3.41Å; F83-Q103 HydrophobicContact CD1-CB 4.32Å; F83-Q103 HydrophobicContact CE1-CB 4.1Å; F83-I104 PolarHBondContact N-O 3.06Å; F83-G105 VanDerWaalsContact CE1-CA 3.49Å; F83-G105 VanDerWaalsContact CZ-CA 3.49Å; F83-G105 CarbonylContact O-C 3.53Å; F83-G105 WeakPolarHBondContact O-CA 3.09Å; F83-I106 PolarHBondContact O-N 3.02Å
84A94.9Very high92.8Very high5 Ų542.2 Ų42.24%0.04124%0.238CC..EExtended strand (participates in β ladder)trans-71.8117.1174.300000109.6Q47 A48 V55 L57Q47-A84 PolarHBondContact NE2-O 3.21Å; A48-A84 HydrophobicContact CB-CB 4.21Å; A48-A84 WeakPolarHBondContact CB-O 3.25Å; A48-A84 PolarHBondContact N-O 3.2Å; V55-A84 HydrophobicContact CB-CB 4.19Å; V55-A84 HydrophobicContact CG1-CB 4.06Å; V55-A84 WeakPolarHBondContact O-CB 3.33Å; L57-A84 HydrophobicContact CD1-CB 4.28Å
85S93.7Very high93Very high0 Ų041.3 Ų41.30%023%0.233CC..EExtended strand (participates in β ladder)trans-97.9152.3178.863.70000113.3Y46 F83 G105 I106Y46-S85 CarbonylContact O-C 3.44Å; Y46-S85 WeakPolarHBondContact O-CA 3.49Å; Y46-S85 WeakPolarHBondContact O-CB 3.46Å; F83-S85 PolarHBondContact O-N 3.41Å; S85-G105 PolarHBondContact OG-O 3.05Å; S85-G105 VanDerWaalsContact OG-O 3.13Å; S85-I106 PolarHBondContact N-O 2.91Å; S85-I106 PolarHBondContact OG-N 2.89Å; S85-I106 PolarHBondContact OG-O 3.24Å
86F85.6Confident93.5Very high159 Ų15935.5 Ų35.570%0.69719%0.193SC*.SBendtrans-81.6129.9163.3178.6-97.6000109.4Y46Y46-F86 PolarHBondContact O-N 2.57Å
87G87.1Confident93.7Very high27 Ų2739.9 Ų39.928%0.27820%0.201SC..SBendtrans132.5-166-176.600000112.4P107G87-P107 WeakPolarHBondContact O-CB 3.44Å
88F88.9Confident93.9Very high51 Ų5140.9 Ų40.922%0.22420%0.201CC..SBendtrans-126.93.2-175.1-60.6-60.1000114.4I125 L146F88-I125 HydrophobicContact CE1-CD1 3.55Å; F88-I125 HydrophobicContact CE1-CG1 4.47Å; F88-I125 HydrophobicContact CZ-CD1 3.6Å; F88-I125 HydrophobicContact CZ-CG1 4.15Å; F88-I125 HydrophobicContact CZ-CG2 3.95Å; F88-L146 HydrophobicContact CB-CD2 3.75Å; F88-L146 HydrophobicContact CD1-CD1 3.9Å; F88-L146 HydrophobicContact CD1-CD2 3.47Å; F88-L146 VanDerWaalsContact CD1-CD2 3.47Å; F88-L146 HydrophobicContact CD1-CG 4.31Å; F88-L146 HydrophobicContact CD2-CD2 4.35Å; F88-L146 HydrophobicContact CE1-CD1 3.69Å; F88-L146 HydrophobicContact CE1-CD2 4.13Å; F88-L146 HydrophobicContact CG-CD2 3.61Å; F88-L146 HydrophobicContact CZ-CD1 4.27Å
89H90.4Very high93.8Very high74 Ų7438.9 Ų38.934%0.34321%0.207SC..SBendtrans-143.2153.417757-82.5000109.7
90P94.9Very high93.7Very high1 Ų138.5 Ų38.51%0.00621%0.21CC..  trans-59.8142.3173.8-26.237000111.8I104 G105 F110 A156 I157 E160P90-I104 HydrophobicContact CB-CG2 4.49Å; P90-G105 VanDerWaalsContact CA-O 3.26Å; P90-G105 WeakPolarHBondContact CA-O 3.48Å; P90-F110 HydrophobicContact CG-CE2 3.79Å; P90-F110 HydrophobicContact CG-CZ 3.83Å; P90-A156 HydrophobicContact CG-CB 3.79Å; P90-I157 HydrophobicContact CG-CG1 4.34Å; P90-E160 HydrophobicContact CB-CG 4.05Å
91V94.1Very high93.7Very high14 Ų1438.2 Ų38.29%0.08521%0.211CC..EExtended strand (participates in β ladder)trans-131.3146.7178.3-57.10000108.3Y42 Y46 I104 G105Y42-V91 HydrophobicContact CE1-CG2 4.11Å; Y42-V91 VanDerWaalsContact OH-C 3.32Å; Y42-V91 WeakPolarHBondContact OH-CB 3.28Å; Y42-V91 WeakPolarHBondContact OH-CG2 3.39Å; Y46-V91 HydrophobicContact CD1-CG1 4.44Å; Y46-V91 HydrophobicContact CD1-CG2 3.91Å; Y46-V91 HydrophobicContact CD2-CG2 4.5Å; Y46-V91 HydrophobicContact CE1-CG1 4.35Å; Y46-V91 HydrophobicContact CE1-CG2 4.46Å; Y46-V91 HydrophobicContact CG-CG2 3.93Å; V91-I104 CarbonylContact O-C 3.54Å; V91-I104 WeakPolarHBondContact O-CA 3.49Å; V91-G105 PolarHBondContact N-O 3.21Å; V91-G105 PolarHBondContact O-N 2.91Å
92G94.5Very high93.7Very high4 Ų436.1 Ų36.14%0.04120%0.196CC..EExtended strand (participates in β ladder)trans-141.8149.5-178.400000115.2Y42 Q103 R163Y42-G92 PolarHBondContact OH-N 2.94Å; Y42-G92 PolarHBondContact OH-O 3.48Å; G92-Q103 VanDerWaalsContact CA-O 3.22Å; G92-Q103 WeakPolarHBondContact CA-O 3.18Å; G92-R163 VanDerWaalsContact C-NH2 3.27Å; G92-R163 PolarHBondContact O-NH2 3.3Å
93A96Very high93.7Very high0 Ų035.3 Ų35.30%019%0.189CC..EExtended strand (participates in β ladder)trans-149.1161.7171.400000110.7H35 Y42 Q103H35-A93 WeakPolarHBondContact ND1-CB 3.2Å; Y42-A93 HydrophobicContact CD1-CB 3.42Å; Y42-A93 VanDerWaalsContact CD1-CB 3.42Å; Y42-A93 HydrophobicContact CD2-CB 3.48Å; Y42-A93 VanDerWaalsContact CD2-CB 3.48Å; Y42-A93 HydrophobicContact CE1-CB 3.69Å; Y42-A93 HydrophobicContact CE2-CB 3.75Å; Y42-A93 HydrophobicContact CG-CB 3.27Å; A93-Q103 PolarHBondContact N-O 3.09Å; A93-Q103 PolarHBondContact O-N 3.32Å
94G96.1Very high93.7Very high0 Ų035 Ų350%019%0.188CC..EExtended strand (participates in β ladder)trans113177176.900000111.7H35 G101 P169H35-G94 PolarHBondContact ND1-N 3.4Å; H35-G94 VanDerWaalsContact O-CA 3.3Å; H35-G94 WeakPolarHBondContact O-CA 3.34Å; G94-G101 CarbonylContact C-O 3.53Å; G94-G101 WeakPolarHBondContact CA-O 3.48Å; G94-P169 WeakPolarHBondContact O-CG 3.37Å
95V96.1Very high93.8Very high2 Ų234.8 Ų34.81%0.01219%0.186CC..  trans-134.1113.4-179.1179.60000107.3M32 H35 W97 L98 G101 P169 V170M32-V95 HydrophobicContact CE-CG2 3.76Å; H35-V95 HydrophobicContact CB-CG2 4.45Å; V95-W97 HydrophobicContact CG1-CD2 3.3Å; V95-W97 HydrophobicContact CG1-CE3 3.7Å; V95-W97 HydrophobicContact CG1-CG 3.87Å; V95-W97 HydrophobicContact CG1-CH2 3.79Å; V95-W97 HydrophobicContact CG1-CZ2 3.36Å; V95-W97 HydrophobicContact CG1-CZ3 3.93Å; V95-W97 PolarHBondContact O-N 2.88Å; V95-L98 HydrophobicContact CB-CB 4.22Å; V95-L98 HydrophobicContact CB-CD1 3.75Å; V95-L98 HydrophobicContact CB-CG 3.77Å; V95-L98 HydrophobicContact CG1-CD1 4.19Å; V95-L98 HydrophobicContact CG1-CG 3.84Å; V95-L98 HydrophobicContact CG2-CD1 4.05Å; V95-L98 PolarHBondContact O-N 3.46Å; V95-G101 CarbonylContact C-O 3.52Å; V95-G101 PolarHBondContact N-O 3.13Å; V95-G101 CarbonylContact O-C 3.55Å; V95-P169 HydrophobicContact CG2-CB 4.41Å; V95-V170 HydrophobicContact CG1-CG2 4.42Å; V95-V170 HydrophobicContact CG2-CG2 3.94Å
96P95.6Very high94Very high6 Ų634.8 Ų34.84%0.03919%0.186CC..THydrogen-bonded Turntrans-60.5-18.9-170.8-24.832.5000115.4N79 F80 A102 L164N79-P96 WeakPolarHBondContact CB-O 3.17Å; N79-P96 VanDerWaalsContact CG-O 3.3Å; N79-P96 PolarHBondContact ND2-O 2.7Å; F80-P96 HydrophobicContact CD2-CB 4.41Å; F80-P96 HydrophobicContact CE1-CG 3.9Å; F80-P96 HydrophobicContact CE2-CB 3.65Å; F80-P96 HydrophobicContact CE2-CG 3.78Å; F80-P96 HydrophobicContact CZ-CB 3.76Å; F80-P96 HydrophobicContact CZ-CG 3.31Å; P96-A102 HydrophobicContact CB-CB 4.38Å; P96-A102 HydrophobicContact CG-CB 3.71Å; P96-L164 WeakPolarHBondContact CD-O 3.13Å; P96-L164 HydrophobicContact CG-CB 4.39Å
97W93.8Very high94.4Very high145 Ų14527.2 Ų27.255%0.54915%0.153SC..THydrogen-bonded Turntrans-98.22.6177.861.785.1000113.8V95 G167 V170V95-W97 HydrophobicContact CG1-CD2 3.3Å; V95-W97 HydrophobicContact CG1-CE3 3.7Å; V95-W97 HydrophobicContact CG1-CG 3.87Å; V95-W97 HydrophobicContact CG1-CH2 3.79Å; V95-W97 HydrophobicContact CG1-CZ2 3.36Å; V95-W97 HydrophobicContact CG1-CZ3 3.93Å; V95-W97 PolarHBondContact O-N 2.88Å; W97-G167 VanDerWaalsContact CH2-CA 3.44Å; W97-V170 HydrophobicContact CZ2-CG2 3.98Å
98L94.2Very high94.5Very high57 Ų5726.1 Ų26.130%0.29814%0.141SC..SBendtrans-93.3158.7170.1-65.7-174.7000110.8V36 V95 A100 G101V36-L98 HydrophobicContact CG2-CD1 4.12Å; V95-L98 HydrophobicContact CB-CB 4.22Å; V95-L98 HydrophobicContact CB-CD1 3.75Å; V95-L98 HydrophobicContact CB-CG 3.77Å; V95-L98 HydrophobicContact CG1-CD1 4.19Å; V95-L98 HydrophobicContact CG1-CG 3.84Å; V95-L98 HydrophobicContact CG2-CD1 4.05Å; V95-L98 PolarHBondContact O-N 3.46Å; L98-A100 VanDerWaalsContact C-N 3.26Å; L98-A100 PolarHBondContact O-N 3.06Å; L98-G101 PolarHBondContact O-N 2.95Å
99P92.6Very high94.7Very high142 Ų14224 Ų2492%0.92213%0.132SC*.THydrogen-bonded Turntrans-57.2-33.3-178.2-2836.1000115G101P99-G101 PolarHBondContact O-N 2.94Å
100A93.4Very high94.9Very high40 Ų4020.4 Ų20.433%0.33112%0.115SC..THydrogen-bonded Turntrans-77.1-9.7177.300000113.6V36 P38 L98V36-A100 WeakPolarHBondContact O-CB 3.29Å; P38-A100 HydrophobicContact CG-CB 4.21Å; L98-A100 VanDerWaalsContact C-N 3.26Å; L98-A100 PolarHBondContact O-N 3.06Å
101G95.8Very high94.7Very high6 Ų622.6 Ų22.66%0.06213%0.127CC..  trans63-154.5-18000000114.1N79 G94 V95 L98 P99N79-G101 CarbonylContact O-C 3.36Å; N79-G101 VanDerWaalsContact O-CA 3.27Å; N79-G101 WeakPolarHBondContact O-CA 2.99Å; G94-G101 CarbonylContact C-O 3.53Å; G94-G101 WeakPolarHBondContact CA-O 3.48Å; V95-G101 CarbonylContact C-O 3.52Å; V95-G101 PolarHBondContact N-O 3.13Å; V95-G101 CarbonylContact O-C 3.55Å; L98-G101 PolarHBondContact O-N 2.95Å; P99-G101 PolarHBondContact O-N 2.94Å
102A96.6Very high94.6Very high1 Ų122 Ų221%0.00812%0.123CC..EExtended strand (participates in β ladder)trans-122.2141.7178.300000110.7N79 F80 S81 P96 L164N79-A102 PolarHBondContact O-N 3.4Å; F80-A102 CarbonylContact C-O 3.55Å; F80-A102 VanDerWaalsContact CA-O 3.29Å; F80-A102 WeakPolarHBondContact CA-O 3.41Å; F80-A102 HydrophobicContact CD1-CB 3.8Å; F80-A102 HydrophobicContact CE1-CB 3.81Å; F80-A102 HydrophobicContact CG-CB 4.44Å; F80-A102 HydrophobicContact CZ-CB 4.47Å; S81-A102 PolarHBondContact N-O 3.29Å; P96-A102 HydrophobicContact CB-CB 4.38Å; P96-A102 HydrophobicContact CG-CB 3.71Å; A102-L164 HydrophobicContact CB-CB 4.24Å; A102-L164 HydrophobicContact CB-CD1 3.9Å
103Q96.7Very high94.3Very high2 Ų224.6 Ų24.61%0.00914%0.138CC..EExtended strand (participates in β ladder)trans-124.1135.1-176.6-52.9-166.5-13.600110.3P38 D39 S81 F83 G92 A93P38-Q103 HydrophobicContact CB-CG 4.09Å; P38-Q103 HydrophobicContact CG-CG 4.08Å; D39-Q103 PolarHBondContact OD1-NE2 2.95Å; D39-Q103 PolarHBondContact OD2-NE2 3.37Å; S81-Q103 CarbonylContact O-C 3.53Å; S81-Q103 VanDerWaalsContact O-CA 3.31Å; S81-Q103 WeakPolarHBondContact O-CA 3.46Å; F83-Q103 HydrophobicContact CD1-CB 4.32Å; F83-Q103 HydrophobicContact CE1-CB 4.1Å; G92-Q103 VanDerWaalsContact CA-O 3.22Å; G92-Q103 WeakPolarHBondContact CA-O 3.18Å; A93-Q103 PolarHBondContact N-O 3.09Å; A93-Q103 PolarHBondContact O-N 3.32Å
104I97.4Very high93.7Very high0 Ų030.5 Ų30.50%018%0.175CC..EExtended strand (participates in β ladder)trans-121.4115.2177.3-64.9173.3000109.1F65 F80 S81 A82 F83 P90 V91 I106 E160 V161 L164F65-I104 HydrophobicContact CE2-CB 4.35Å; F65-I104 HydrophobicContact CE2-CD1 4.12Å; F80-I104 HydrophobicContact CD1-CD1 4.48Å; S81-I104 PolarHBondContact O-N 2.93Å; A82-I104 WeakPolarHBondContact CA-O 3.3Å; F83-I104 PolarHBondContact N-O 3.06Å; P90-I104 HydrophobicContact CB-CG2 4.49Å; V91-I104 CarbonylContact O-C 3.54Å; V91-I104 WeakPolarHBondContact O-CA 3.49Å; I104-I106 HydrophobicContact CG2-CG1 4.12Å; I104-E160 HydrophobicContact CD1-CB 4.03Å; I104-E160 HydrophobicContact CG1-CB 4.29Å; I104-E160 HydrophobicContact CG2-CB 4.42Å; I104-V161 HydrophobicContact CD1-CB 4.32Å; I104-V161 HydrophobicContact CD1-CG2 3.4Å; I104-L164 HydrophobicContact CD1-CD1 4.24Å; I104-L164 HydrophobicContact CG1-CD1 3.84Å
105G96.9Very high93.3Very high0 Ų038 Ų380%022%0.215CC..EExtended strand (participates in β ladder)trans-81.3115.5172.900000110.3F83 S85 P90 V91F83-G105 VanDerWaalsContact CE1-CA 3.49Å; F83-G105 VanDerWaalsContact CZ-CA 3.49Å; F83-G105 CarbonylContact O-C 3.53Å; F83-G105 WeakPolarHBondContact O-CA 3.09Å; S85-G105 PolarHBondContact OG-O 3.05Å; S85-G105 VanDerWaalsContact OG-O 3.13Å; P90-G105 VanDerWaalsContact CA-O 3.26Å; P90-G105 WeakPolarHBondContact CA-O 3.48Å; V91-G105 PolarHBondContact N-O 3.21Å; V91-G105 PolarHBondContact O-N 2.91Å
106I97.3Very high92.9Very high0 Ų041.6 Ų41.60%023%0.234CC..EExtended strand (participates in β ladder)trans-102.4124.7179.9-55.7175.6000109.1L57 L61 F65 A82 F83 S85 I104 F110 I157L57-I106 HydrophobicContact CD1-CB 4.02Å; L57-I106 HydrophobicContact CD2-CD1 4.16Å; L61-I106 HydrophobicContact CB-CG2 4.44Å; L61-I106 HydrophobicContact CD1-CG2 3.98Å; L61-I106 HydrophobicContact CD2-CG2 4.3Å; L61-I106 HydrophobicContact CG-CG2 4.47Å; F65-I106 HydrophobicContact CB-CD1 3.92Å; F65-I106 HydrophobicContact CD2-CD1 4.35Å; F65-I106 HydrophobicContact CG-CD1 4.38Å; A82-I106 HydrophobicContact CB-CD1 3.95Å; A82-I106 HydrophobicContact CB-CG1 4.5Å; F83-I106 PolarHBondContact O-N 3.02Å; S85-I106 PolarHBondContact N-O 2.91Å; S85-I106 PolarHBondContact OG-N 2.89Å; S85-I106 PolarHBondContact OG-O 3.24Å; I104-I106 HydrophobicContact CG2-CG1 4.12Å; I106-F110 HydrophobicContact CG2-CB 4.45Å; I106-F110 HydrophobicContact CG2-CD2 3.88Å; I106-F110 HydrophobicContact CG2-CG 4.38Å; I106-I157 HydrophobicContact CD1-CD1 3.77Å; I106-I157 HydrophobicContact CD1-CG1 4.16Å; I106-I157 HydrophobicContact CG1-CD1 4.37Å; I106-I157 HydrophobicContact CG1-CG1 4.33Å; I106-I157 HydrophobicContact CG2-CD1 4.45Å
107P93.8Very high92.4Very high0 Ų043 Ų430%024%0.243CC..EExtended strand (participates in β ladder)trans-79.3147.2-17436.7-40.4000110.7G87 N109 F110G87-P107 WeakPolarHBondContact O-CB 3.44Å; P107-N109 WeakPolarHBondContact CB-OD1 3.48Å; P107-N109 WeakPolarHBondContact CG-OD1 3.38Å; P107-N109 PolarHBondContact O-N 2.87Å; P107-F110 HydrophobicContact CG-CD1 3.91Å; P107-F110 HydrophobicContact CG-CE1 3.96Å; P107-F110 HydrophobicContact CG-CG 4.36Å; P107-F110 HydrophobicContact CG-CZ 4.44Å; P107-F110 WeakPolarHBondContact O-CB 3.2Å; P107-F110 PolarHBondContact O-N 2.66Å; P107-F110 VanDerWaalsContact O-N 3.16Å
108A89.6Confident92Very high4 Ų437.6 Ų37.63%0.03323%0.228CC..G310 helixtrans-72.6-12.9-171.900000115.1F110 N111A108-F110 PolarHBondContact O-N 2.78Å; A108-F110 VanDerWaalsContact O-N 3.14Å; A108-N111 VanDerWaalsContact O-CB 3.3Å; A108-N111 WeakPolarHBondContact O-CB 3.39Å; A108-N111 PolarHBondContact O-N 3.01Å; A108-N111 PolarHBondContact O-ND2 3.18Å
109N92Very high91.3Very high5 Ų535.4 Ų35.43%0.02722%0.219CC..G310 helixtrans-61.5-17.5171.965.2-64.5000111.9P107 N111 S112 I120 L146 F148P107-N109 WeakPolarHBondContact CB-OD1 3.48Å; P107-N109 WeakPolarHBondContact CG-OD1 3.38Å; P107-N109 PolarHBondContact O-N 2.87Å; N109-N111 PolarHBondContact O-N 2.94Å; N109-S112 VanDerWaalsContact O-CB 3.29Å; N109-S112 WeakPolarHBondContact O-CB 3.37Å; N109-S112 PolarHBondContact O-N 3.17Å; N109-S112 VanDerWaalsContact O-N 3.12Å; N109-I120 HydrophobicContact CB-CD1 4.26Å; N109-I120 HydrophobicContact CB-CG1 3.6Å; N109-L146 PolarHBondContact ND2-O 2.79Å; N109-F148 WeakPolarHBondContact ND2-CE2 3.49Å
110F94.6Very high90.8Very high0 Ų028.8 Ų28.80%018%0.175CC..G310 helixtrans-71.8-15.7173.3-74.621.6000112.6K60 L61 P90 I106 P107 A108 S112 F148 Q153 A156 I157K60-F110 PolarHBondContact NZ-O 3.5Å; L61-F110 HydrophobicContact CD1-CB 4.22Å; L61-F110 HydrophobicContact CD2-CB 3.45Å; L61-F110 VanDerWaalsContact CD2-CB 3.45Å; L61-F110 HydrophobicContact CG-CB 4.49Å; P90-F110 HydrophobicContact CG-CE2 3.79Å; P90-F110 HydrophobicContact CG-CZ 3.83Å; I106-F110 HydrophobicContact CG2-CB 4.45Å; I106-F110 HydrophobicContact CG2-CD2 3.88Å; I106-F110 HydrophobicContact CG2-CG 4.38Å; P107-F110 HydrophobicContact CG-CD1 3.91Å; P107-F110 HydrophobicContact CG-CE1 3.96Å; P107-F110 HydrophobicContact CG-CG 4.36Å; P107-F110 HydrophobicContact CG-CZ 4.44Å; P107-F110 WeakPolarHBondContact O-CB 3.2Å; P107-F110 PolarHBondContact O-N 2.66Å; P107-F110 VanDerWaalsContact O-N 3.16Å; A108-F110 PolarHBondContact O-N 2.78Å; A108-F110 VanDerWaalsContact O-N 3.14Å; F110-S112 VanDerWaalsContact C-N 3.28Å; F110-F148 HydrophobicContact CD1-CD2 4.12Å; F110-F148 AromaticContact CE1-CD2 3.71Å; F110-F148 HydrophobicContact CE1-CD2 3.71Å; F110-F148 HydrophobicContact CE1-CE2 4.02Å; F110-F148 HydrophobicContact CE1-CG 4.17Å; F110-Q153 HydrophobicContact CB-CG 4.15Å; F110-Q153 HydrophobicContact CD1-CG 4.25Å; F110-Q153 HydrophobicContact CD2-CB 3.75Å; F110-Q153 HydrophobicContact CD2-CG 3.54Å; F110-Q153 HydrophobicContact CE2-CB 3.85Å; F110-Q153 HydrophobicContact CE2-CG 3.86Å; F110-Q153 HydrophobicContact CG-CB 4.45Å; F110-Q153 HydrophobicContact CG-CG 3.75Å; F110-Q153 HydrophobicContact CZ-CG 4.33Å; F110-Q153 PolarHBondContact O-NE2 3.15Å; F110-Q153 PolarHBondContact O-OE1 3.03Å; F110-A156 HydrophobicContact CE2-CB 4.01Å; F110-A156 HydrophobicContact CZ-CB 3.79Å; F110-I157 HydrophobicContact CE2-CG1 4.47Å
111N92.4Very high90.2Very high47 Ų4728.8 Ų28.825%0.25117%0.172SC..G310 helixtrans-68.6-31.8168.5-73.2-52000111.9S58 K60 A108 N109S58-N111 WeakPolarHBondContact CB-OD1 3.42Å; S58-N111 PolarHBondContact OG-OD1 3.31Å; K60-N111 PolarHBondContact NZ-O 2.92Å; A108-N111 VanDerWaalsContact O-CB 3.3Å; A108-N111 WeakPolarHBondContact O-CB 3.39Å; A108-N111 PolarHBondContact O-N 3.01Å; A108-N111 PolarHBondContact O-ND2 3.18Å; N109-N111 PolarHBondContact O-N 2.94Å
112S90.7Very high89.6Confident0 Ų034.7 Ų34.70%020%0.202CC..  trans-65149.1-178.2-60.80000112.6N109 F110 D116 P117 G119 I120N109-S112 VanDerWaalsContact O-CB 3.29Å; N109-S112 WeakPolarHBondContact O-CB 3.37Å; N109-S112 PolarHBondContact O-N 3.17Å; N109-S112 VanDerWaalsContact O-N 3.12Å; F110-S112 VanDerWaalsContact C-N 3.28Å; S112-D116 CarbonylContact C-O 3.46Å; S112-D116 VanDerWaalsContact CA-O 3.23Å; S112-D116 WeakPolarHBondContact CA-O 3.28Å; S112-P117 PolarHBondContact OG-O 3.1Å; S112-G119 WeakPolarHBondContact OG-CA 3.27Å; S112-G119 PolarHBondContact OG-N 3.12Å; S112-G119 VanDerWaalsContact OG-N 3.1Å; S112-I120 WeakPolarHBondContact OG-CG1 3.42Å; S112-I120 PolarHBondContact OG-N 3.14Å
113T89Confident88.7Confident59 Ų5938.8 Ų38.836%0.36222%0.217SC..  trans-125.8177168.864.20000108.8D115 D116T113-D115 PolarHBondContact O-N 2.71Å; T113-D115 PolarHBondContact OG1-N 3.11Å; T113-D116 PolarHBondContact N-O 3.07Å; T113-D116 CarbonylContact O-C 3.57Å; T113-D116 PolarHBondContact OG1-N 3.04Å
114T84Confident87.9Confident125 Ų12544.6 Ų44.677%0.76725%0.248SC*.SBendtrans-60.1-38.2174.2-49.90000111.5
115D86.3Confident87.2Confident156 Ų15645.8 Ų45.883%0.83425%0.254SS*.SBendtrans-87.2-27.3-176.8-54.6-46.7000112.7T113T113-D115 PolarHBondContact O-N 2.71Å; T113-D115 PolarHBondContact OG1-N 3.11Å
116D88.3Confident86.7Confident79 Ų7951.9 Ų51.942%0.42228%0.281SS..  trans-125.590.3177.5179.715.3000111.4S112 T113 S118S112-D116 CarbonylContact C-O 3.46Å; S112-D116 VanDerWaalsContact CA-O 3.23Å; S112-D116 WeakPolarHBondContact CA-O 3.28Å; T113-D116 PolarHBondContact N-O 3.07Å; T113-D116 CarbonylContact O-C 3.57Å; T113-D116 PolarHBondContact OG1-N 3.04Å; D116-S118 VanDerWaalsContact CG-OG 3.25Å; D116-S118 PolarHBondContact O-N 3.39Å; D116-S118 WeakPolarHBondContact OD1-CB 3.39Å; D116-S118 PolarHBondContact OD1-N 3.21Å; D116-S118 PolarHBondContact OD1-OG 3.31Å; D116-S118 PolarHBondContact OD2-OG 3.35Å; D116-S118 VanDerWaalsContact OD2-OG 3.11Å
117P85.7Confident86.1Confident36 Ų3653 Ų5323%0.23429%0.286CS..  trans-80.77.8177.832.9-35.3000113.7S112 G119 I120 T121 K143S112-P117 PolarHBondContact OG-O 3.1Å; P117-G119 VanDerWaalsContact C-N 3.25Å; P117-G119 PolarHBondContact O-N 3.29Å; P117-I120 WeakPolarHBondContact O-CB 3.02Å; P117-I120 PolarHBondContact O-N 3.1Å; P117-T121 HydrophobicContact CB-CG2 4.18Å; P117-T121 HydrophobicContact CG-CG2 4.36Å; P117-T121 PolarHBondContact O-N 2.69Å; P117-T121 VanDerWaalsContact O-N 3.11Å; P117-T121 PolarHBondContact O-OG1 3.06Å; P117-K143 HydrophobicContact CB-CD 4.1Å; P117-K143 HydrophobicContact CB-CG 4.4Å
118S84.1Confident85.5Confident31 Ų3156.2 Ų56.222%0.21731%0.309CS..Hα-helixtrans-52.3-35.3-171.460.70000115.1D116 I120 N122D116-S118 VanDerWaalsContact CG-OG 3.25Å; D116-S118 PolarHBondContact O-N 3.39Å; D116-S118 WeakPolarHBondContact OD1-CB 3.39Å; D116-S118 PolarHBondContact OD1-N 3.21Å; D116-S118 PolarHBondContact OD1-OG 3.31Å; D116-S118 PolarHBondContact OD2-OG 3.35Å; D116-S118 VanDerWaalsContact OD2-OG 3.11Å; S118-I120 PolarHBondContact O-N 2.99Å; S118-I120 VanDerWaalsContact O-N 3.1Å; S118-N122 WeakPolarHBondContact CB-ND2 3.35Å; S118-N122 VanDerWaalsContact O-CB 3.23Å; S118-N122 WeakPolarHBondContact O-CB 3.48Å; S118-N122 PolarHBondContact O-N 2.97Å; S118-N122 VanDerWaalsContact O-N 3.08Å
119G79.6Confident85.2Confident11 Ų1159.3 Ų59.311%0.11334%0.341CS..Hα-helixtrans-59.6-18175.200000114.9S112 P117S112-G119 WeakPolarHBondContact OG-CA 3.27Å; S112-G119 PolarHBondContact OG-N 3.12Å; S112-G119 VanDerWaalsContact OG-N 3.1Å; P117-G119 VanDerWaalsContact C-N 3.25Å; P117-G119 PolarHBondContact O-N 3.29Å
120I82.5Confident85Confident2 Ų266.8 Ų66.81%0.0137%0.373CS..Hα-helixtrans-105.6-53.2176.3-62156.2000110N109 S112 P117 S118 R123 I125 W134 L146 V147N109-I120 HydrophobicContact CB-CD1 4.26Å; N109-I120 HydrophobicContact CB-CG1 3.6Å; S112-I120 WeakPolarHBondContact OG-CG1 3.42Å; S112-I120 PolarHBondContact OG-N 3.14Å; P117-I120 WeakPolarHBondContact O-CB 3.02Å; P117-I120 PolarHBondContact O-N 3.1Å; S118-I120 PolarHBondContact O-N 2.99Å; S118-I120 VanDerWaalsContact O-N 3.1Å; I120-R123 PolarHBondContact O-N 3.13Å; I120-I125 HydrophobicContact CG2-CD1 4.26Å; I120-W134 HydrophobicContact CG2-CH2 3.6Å; I120-W134 HydrophobicContact CG2-CZ2 3.94Å; I120-W134 HydrophobicContact CG2-CZ3 3.93Å; I120-L146 HydrophobicContact CD1-CB 3.62Å; I120-L146 HydrophobicContact CG1-CB 4.14Å; I120-L146 HydrophobicContact CG2-CD1 4.04Å; I120-V147 HydrophobicContact CD1-CG2 3.66Å
121T81.4Confident84.7Confident41 Ų4170.2 Ų70.225%0.25240%0.395SS..Hα-helixtrans-76.7-25-167.552.70000114.1P117 R123 W134 K143P117-T121 HydrophobicContact CB-CG2 4.18Å; P117-T121 HydrophobicContact CG-CG2 4.36Å; P117-T121 PolarHBondContact O-N 2.69Å; P117-T121 VanDerWaalsContact O-N 3.11Å; P117-T121 PolarHBondContact O-OG1 3.06Å; T121-R123 PolarHBondContact O-N 3.27Å; T121-W134 HydrophobicContact CG2-CB 4.41Å; T121-W134 HydrophobicContact CG2-CD2 4.28Å; T121-W134 HydrophobicContact CG2-CG 4Å; T121-K143 HydrophobicContact CG2-CD 4.08Å
122N82.3Confident84.5Confident130 Ų13068.7 Ų68.770%0.69539%0.387SS*.THydrogen-bonded Turntrans-7711.2179.3-65.5-2.5000112.8S118S118-N122 WeakPolarHBondContact CB-ND2 3.35Å; S118-N122 VanDerWaalsContact O-CB 3.23Å; S118-N122 WeakPolarHBondContact O-CB 3.48Å; S118-N122 PolarHBondContact O-N 2.97Å; S118-N122 VanDerWaalsContact O-N 3.08Å
123R77.3Confident84.4Confident86 Ų8672.8 Ų72.833%0.32541%0.409SS..SBendtrans-126137.4-176.8-61.6177.8174.9-147.6-9.2109.6I120 T121 I125I120-R123 PolarHBondContact O-N 3.13Å; T121-R123 PolarHBondContact O-N 3.27Å; R123-I125 PolarHBondContact O-N 3.33Å; R123-I125 VanDerWaalsContact O-N 3.09Å
124N80.6Confident84.5Confident125 Ų12572 Ų7267%0.66840%0.399SS*.  trans-76.299.8171.6-67.8-23.6000108.8F126N124-F126 HydrophobicContact CB-CD2 4.46Å; N124-F126 HydrophobicContact CB-CE2 3.69Å; N124-F126 HydrophobicContact CB-CZ 4.06Å
125I83.5Confident84.7Confident25 Ų2570.9 Ų70.913%0.12840%0.397CS..  trans-91.7120.6173-67.7171.2000107.7F88 I120 R123 I127 T131 V132 W134F88-I125 HydrophobicContact CE1-CD1 3.55Å; F88-I125 HydrophobicContact CE1-CG1 4.47Å; F88-I125 HydrophobicContact CZ-CD1 3.6Å; F88-I125 HydrophobicContact CZ-CG1 4.15Å; F88-I125 HydrophobicContact CZ-CG2 3.95Å; I120-I125 HydrophobicContact CG2-CD1 4.26Å; R123-I125 PolarHBondContact O-N 3.33Å; R123-I125 VanDerWaalsContact O-N 3.09Å; I125-I127 HydrophobicContact CG2-CG1 4.35Å; I125-T131 WeakPolarHBondContact O-CA 3.45Å; I125-V132 HydrophobicContact CB-CG2 4.34Å; I125-V132 HydrophobicContact CG2-CG2 3.93Å; I125-V132 PolarHBondContact O-N 3.11Å; I125-W134 HydrophobicContact CB-CH2 4.26Å; I125-W134 HydrophobicContact CB-CZ2 3.93Å; I125-W134 HydrophobicContact CD1-CH2 3.58Å; I125-W134 HydrophobicContact CD1-CZ2 3.55Å; I125-W134 HydrophobicContact CG1-CH2 4.4Å; I125-W134 HydrophobicContact CG1-CZ2 4.05Å
126F85.6Confident84.9Confident128 Ų12865.3 Ų65.356%0.56137%0.37SS*.EExtended strand (participates in β ladder)trans-101.1124.5178.7-65.7-87.8000110.5N124 K130 T131N124-F126 HydrophobicContact CB-CD2 4.46Å; N124-F126 HydrophobicContact CB-CE2 3.69Å; N124-F126 HydrophobicContact CB-CZ 4.06Å; F126-K130 CarbonylContact C-O 3.55Å; F126-K130 VanDerWaalsContact CA-O 3.32Å; F126-K130 WeakPolarHBondContact CA-O 3.42Å; F126-T131 VanDerWaalsContact CE1-OG1 3.3Å; F126-T131 WeakPolarHBondContact CE1-OG1 3.41Å
127I85.1Confident85Confident22 Ų2270 Ų7011%0.11339%0.389CS..EExtended strand (participates in β ladder)trans-119.5123.7171.3-60.1179.2000107.4I125 G129 K130 V132 L142 L263 L266 M267I125-I127 HydrophobicContact CG2-CG1 4.35Å; I127-G129 PolarHBondContact O-N 2.9Å; I127-G129 VanDerWaalsContact O-N 3.15Å; I127-K130 PolarHBondContact N-O 2.86Å; I127-K130 PolarHBondContact O-N 3.1Å; I127-V132 HydrophobicContact CB-CG2 4.28Å; I127-V132 HydrophobicContact CD1-CG2 3.4Å; I127-V132 VanDerWaalsContact CD1-CG2 3.4Å; I127-V132 HydrophobicContact CG1-CG2 3.62Å; I127-L142 HydrophobicContact CD1-CD2 3.71Å; I127-L263 HydrophobicContact CD1-CD2 3.54Å; I127-L263 HydrophobicContact CG1-CD2 4.35Å; I127-L266 HydrophobicContact CD1-CB 4.35Å; I127-L266 HydrophobicContact CD1-CD1 3.85Å; I127-L266 HydrophobicContact CG2-CB 4.06Å; I127-M267 HydrophobicContact CG2-CG 3.42Å; I127-M267 VanDerWaalsContact CG2-CG 3.42Å
128S82Confident85.1Confident69 Ų6969.6 Ų69.648%0.48339%0.389SS..THydrogen-bonded Turntrans51.637.2-176.2-63.20000113.6K130S128-K130 VanDerWaalsContact C-N 3.26Å; S128-K130 PolarHBondContact O-N 2.85Å
129G82.1Confident85.4Confident68 Ų6868.1 Ų68.170%0.70138%0.379SS*.THydrogen-bonded Turntrans77.53.3179.600000115.2I127I127-G129 PolarHBondContact O-N 2.9Å; I127-G129 VanDerWaalsContact O-N 3.15Å
130K87.1Confident85.9Confident162 Ų16270 Ų7070%0.70439%0.39SS*.EExtended strand (participates in β ladder)trans-111.9139.1177.3-62.9-177.7-179.5-179.30110.4F126 I127 S128F126-K130 CarbonylContact C-O 3.55Å; F126-K130 VanDerWaalsContact CA-O 3.32Å; F126-K130 WeakPolarHBondContact CA-O 3.42Å; I127-K130 PolarHBondContact N-O 2.86Å; I127-K130 PolarHBondContact O-N 3.1Å; S128-K130 VanDerWaalsContact C-N 3.26Å; S128-K130 PolarHBondContact O-N 2.85Å
131T88.7Confident86.4Confident73 Ų7371.4 Ų71.445%0.44840%0.402SS..EExtended strand (participates in β ladder)trans-64.9135.8171.3-50.20000109.3I125 F126 D133I125-T131 WeakPolarHBondContact O-CA 3.45Å; F126-T131 VanDerWaalsContact CE1-OG1 3.3Å; F126-T131 WeakPolarHBondContact CE1-OG1 3.41Å; T131-D133 PolarHBondContact O-N 2.89Å
132V88.8Confident86.9Confident15 Ų1569.6 Ų69.69%0.09139%0.391CS..  trans-66125.1175177.70000109.6I125 I127 W134 L142I125-V132 HydrophobicContact CB-CG2 4.34Å; I125-V132 HydrophobicContact CG2-CG2 3.93Å; I125-V132 PolarHBondContact O-N 3.11Å; I127-V132 HydrophobicContact CB-CG2 4.28Å; I127-V132 HydrophobicContact CD1-CG2 3.4Å; I127-V132 VanDerWaalsContact CD1-CG2 3.4Å; I127-V132 HydrophobicContact CG1-CG2 3.62Å; V132-W134 HydrophobicContact CB-CH2 4.17Å; V132-W134 HydrophobicContact CB-CZ2 4.12Å; V132-W134 HydrophobicContact CB-CZ3 4.42Å; V132-W134 HydrophobicContact CG1-CD2 4.04Å; V132-W134 HydrophobicContact CG1-CE3 3.72Å; V132-W134 HydrophobicContact CG1-CH2 3.93Å; V132-W134 HydrophobicContact CG1-CZ2 4.21Å; V132-W134 HydrophobicContact CG1-CZ3 3.68Å; V132-W134 PolarHBondContact O-N 3.36Å; V132-L142 HydrophobicContact CG1-CD2 4.4Å; V132-L142 HydrophobicContact CG2-CD2 4.44Å
133D89.3Confident87.4Confident86 Ų8666 Ų6646%0.4637%0.369SS..  trans-81.9102.7168.8175.68.5000109.8T131 S135 S136 G139T131-D133 PolarHBondContact O-N 2.89Å; D133-S135 PolarHBondContact O-N 2.86Å; D133-S135 WeakPolarHBondContact OD1-CB 3.4Å; D133-S135 PolarHBondContact OD1-N 3.43Å; D133-S135 PolarHBondContact OD1-OG 3.42Å; D133-S135 PolarHBondContact OD2-OG 3.29Å; D133-S136 WeakPolarHBondContact O-CB 3.38Å; D133-S136 PolarHBondContact O-N 2.93Å; D133-S136 PolarHBondContact O-OG 3.47Å; D133-S136 PolarHBondContact OD1-N 3.19Å; D133-G139 WeakPolarHBondContact O-CA 3.16Å
134W90Very high88.2Confident41 Ų4168.1 Ų68.116%0.15538%0.382CS..THydrogen-bonded Turntrans-66.6-13.1179.8-58118.3000114.8I120 T121 I125 V132 L142 K143I120-W134 HydrophobicContact CG2-CH2 3.6Å; I120-W134 HydrophobicContact CG2-CZ2 3.94Å; I120-W134 HydrophobicContact CG2-CZ3 3.93Å; T121-W134 HydrophobicContact CG2-CB 4.41Å; T121-W134 HydrophobicContact CG2-CD2 4.28Å; T121-W134 HydrophobicContact CG2-CG 4Å; I125-W134 HydrophobicContact CB-CH2 4.26Å; I125-W134 HydrophobicContact CB-CZ2 3.93Å; I125-W134 HydrophobicContact CD1-CH2 3.58Å; I125-W134 HydrophobicContact CD1-CZ2 3.55Å; I125-W134 HydrophobicContact CG1-CH2 4.4Å; I125-W134 HydrophobicContact CG1-CZ2 4.05Å; V132-W134 HydrophobicContact CB-CH2 4.17Å; V132-W134 HydrophobicContact CB-CZ2 4.12Å; V132-W134 HydrophobicContact CB-CZ3 4.42Å; V132-W134 HydrophobicContact CG1-CD2 4.04Å; V132-W134 HydrophobicContact CG1-CE3 3.72Å; V132-W134 HydrophobicContact CG1-CH2 3.93Å; V132-W134 HydrophobicContact CG1-CZ2 4.21Å; V132-W134 HydrophobicContact CG1-CZ3 3.68Å; V132-W134 PolarHBondContact O-N 3.36Å; W134-L142 HydrophobicContact CZ3-CD2 4.37Å; W134-L142 HydrophobicContact CZ3-CG 4.47Å; W134-K143 HydrophobicContact CE3-CB 3.95Å; W134-K143 HydrophobicContact CZ3-CB 4.15Å
135S88.3Confident88.8Confident102 Ų10262.2 Ų62.271%0.71335%0.351SS*.THydrogen-bonded Turntrans-89-20.1176.673.80000113D133D133-S135 PolarHBondContact O-N 2.86Å; D133-S135 WeakPolarHBondContact OD1-CB 3.4Å; D133-S135 PolarHBondContact OD1-N 3.43Å; D133-S135 PolarHBondContact OD1-OG 3.42Å; D133-S135 PolarHBondContact OD2-OG 3.29Å
136S90.6Very high89.4Confident39 Ų3961 Ų6127%0.27335%0.345SS..SBendtrans-66.1155.6173.2730000111.8D133 A138 G139 S140D133-S136 WeakPolarHBondContact O-CB 3.38Å; D133-S136 PolarHBondContact O-N 2.93Å; D133-S136 PolarHBondContact O-OG 3.47Å; D133-S136 PolarHBondContact OD1-N 3.19Å; S136-A138 VanDerWaalsContact C-N 3.33Å; S136-A138 PolarHBondContact O-N 3.03Å; S136-G139 PolarHBondContact O-N 3.4Å; S136-G139 PolarHBondContact OG-N 2.92Å; S136-S140 WeakPolarHBondContact O-CB 3.29Å; S136-S140 PolarHBondContact O-N 2.86Å
137E91.2Very high89.9Confident178 Ų17855.8 Ų55.883%0.83232%0.324SS*.Hα-helixtrans-54.7-48.5176.2-176-179.2-178.100111.7G139 S140 A141E137-G139 PolarHBondContact O-N 3.41Å; E137-S140 PolarHBondContact O-N 3.5Å; E137-A141 WeakPolarHBondContact O-CB 3.48Å; E137-A141 PolarHBondContact O-N 2.83Å
138A87.1Confident90.4Very high28 Ų2855 Ų5523%0.23132%0.32CS..Hα-helixtrans-67.4-36.6179.600000112.8S136 L142 L266S136-A138 VanDerWaalsContact C-N 3.33Å; S136-A138 PolarHBondContact O-N 3.03Å; A138-L142 WeakPolarHBondContact O-CB 3.31Å; A138-L142 PolarHBondContact O-N 3.06Å; A138-L266 HydrophobicContact CB-CD2 3.66Å; A138-L266 HydrophobicContact CB-CG 4.3Å
139G90Very high91.1Very high0 Ų053.2 Ų53.20%031%0.307CS..Hα-helixtrans-68.9-38.4174.700000112.7D133 S136 E137 L142 K143D133-G139 WeakPolarHBondContact O-CA 3.16Å; S136-G139 PolarHBondContact O-N 3.4Å; S136-G139 PolarHBondContact OG-N 2.92Å; E137-G139 PolarHBondContact O-N 3.41Å; G139-L142 PolarHBondContact O-N 3.27Å; G139-K143 VanDerWaalsContact O-CB 3.28Å; G139-K143 WeakPolarHBondContact O-CB 3.36Å; G139-K143 PolarHBondContact O-N 3.16Å
140S91.2Very high91.7Very high51 Ų5152.7 Ų52.736%0.35730%0.296SS..Hα-helixtrans-65.9-44.4175-167.20000111.4S136 E137 L142 K143 E144S136-S140 WeakPolarHBondContact O-CB 3.29Å; S136-S140 PolarHBondContact O-N 2.86Å; E137-S140 PolarHBondContact O-N 3.5Å; S140-L142 PolarHBondContact O-N 3.44Å; S140-K143 WeakPolarHBondContact O-CB 3.34Å; S140-K143 PolarHBondContact O-N 3.02Å; S140-E144 PolarHBondContact O-N 2.93Å
141A92.1Very high92.2Very high31 Ų3148.5 Ų48.526%0.25628%0.279SS..Hα-helixtrans-63.3-41.117500000112.2E137 E144 A145 M262E137-A141 WeakPolarHBondContact O-CB 3.48Å; E137-A141 PolarHBondContact O-N 2.83Å; A141-E144 PolarHBondContact O-N 3.42Å; A141-A145 PolarHBondContact O-N 2.93Å; A141-M262 HydrophobicContact CB-CG 4.27Å; A141-M262 HydrophobicContact CB-SD 3.57Å; A141-M262 VanDerWaalsContact CB-SD 3.57Å
142L92.8Very high92.7Very high2 Ų245 Ų451%0.0126%0.258CS..Hα-helixtrans-63.6-43.7173.9179.762.2000111.6I127 V132 W134 A138 G139 S140 E144 A145 L146 R259 M262 L263 L266I127-L142 HydrophobicContact CD1-CD2 3.71Å; V132-L142 HydrophobicContact CG1-CD2 4.4Å; V132-L142 HydrophobicContact CG2-CD2 4.44Å; W134-L142 HydrophobicContact CZ3-CD2 4.37Å; W134-L142 HydrophobicContact CZ3-CG 4.47Å; A138-L142 WeakPolarHBondContact O-CB 3.31Å; A138-L142 PolarHBondContact O-N 3.06Å; G139-L142 PolarHBondContact O-N 3.27Å; S140-L142 PolarHBondContact O-N 3.44Å; L142-E144 VanDerWaalsContact C-N 3.33Å; L142-E144 PolarHBondContact O-N 3.03Å; L142-A145 PolarHBondContact O-N 3.34Å; L142-L146 HydrophobicContact CD1-CD1 4.36Å; L142-L146 HydrophobicContact CD1-CG 4.41Å; L142-L146 HydrophobicContact CG-CD1 4.16Å; L142-L146 VanDerWaalsContact O-CG 3.3Å; L142-L146 WeakPolarHBondContact O-CG 3.21Å; L142-L146 PolarHBondContact O-N 3.49Å; L142-L146 VanDerWaalsContact O-N 3.13Å; L142-R259 HydrophobicContact CD1-CG 3.77Å; L142-M262 HydrophobicContact CB-CB 4.32Å; L142-M262 HydrophobicContact CD1-CB 4.2Å; L142-L263 HydrophobicContact CD1-CD2 4.32Å; L142-L263 HydrophobicContact CD1-CG 4.46Å; L142-L263 HydrophobicContact CD2-CD2 4.39Å; L142-L266 HydrophobicContact CB-CD1 4.38Å; L142-L266 HydrophobicContact CD2-CD1 3.81Å
143K92.3Very high93.1Very high56 Ų5644.6 Ų44.624%0.24325%0.254CS..Hα-helixtrans-57.6-46.8175.8176.6-176.169.5-169.60110.8P117 T121 W134 G139 S140 A145 L146 V147P117-K143 HydrophobicContact CB-CD 4.1Å; P117-K143 HydrophobicContact CB-CG 4.4Å; T121-K143 HydrophobicContact CG2-CD 4.08Å; W134-K143 HydrophobicContact CE3-CB 3.95Å; W134-K143 HydrophobicContact CZ3-CB 4.15Å; G139-K143 VanDerWaalsContact O-CB 3.28Å; G139-K143 WeakPolarHBondContact O-CB 3.36Å; G139-K143 PolarHBondContact O-N 3.16Å; S140-K143 WeakPolarHBondContact O-CB 3.34Å; S140-K143 PolarHBondContact O-N 3.02Å; K143-A145 VanDerWaalsContact C-N 3.31Å; K143-A145 PolarHBondContact O-N 2.82Å; K143-L146 PolarHBondContact O-N 3.21Å; K143-V147 PolarHBondContact O-N 3.5Å
144E93.6Very high93.5Very high129 Ų12942.5 Ų42.560%0.60324%0.241SC*.Hα-helixtrans-60.4-40.6176.7-167-167.1153.300112S140 A141 L142 L146 V147 K255S140-E144 PolarHBondContact O-N 2.93Å; A141-E144 PolarHBondContact O-N 3.42Å; L142-E144 VanDerWaalsContact C-N 3.33Å; L142-E144 PolarHBondContact O-N 3.03Å; E144-L146 PolarHBondContact O-N 3.38Å; E144-V147 PolarHBondContact O-N 3.21Å; E144-K255 PolarHBondContact O-NZ 2.88Å
145A94.6Very high93.9Very high2 Ų240.5 Ų40.52%0.01723%0.234CC..Hα-helixtrans-68.3-15.7176.800000114A141 L142 K143 R259A141-A145 PolarHBondContact O-N 2.93Å; L142-A145 PolarHBondContact O-N 3.34Å; K143-A145 VanDerWaalsContact C-N 3.31Å; K143-A145 PolarHBondContact O-N 2.82Å; A145-R259 HydrophobicContact CB-CB 3.96Å
146L94.7Very high94.4Very high0 Ų035.7 Ų35.70%020%0.2CC..Hα-helixtrans-97.6-10.3179-69.5176.2000113.8F88 N109 I120 L142 K143 E144 F148 R259F88-L146 HydrophobicContact CB-CD2 3.75Å; F88-L146 HydrophobicContact CD1-CD1 3.9Å; F88-L146 HydrophobicContact CD1-CD2 3.47Å; F88-L146 VanDerWaalsContact CD1-CD2 3.47Å; F88-L146 HydrophobicContact CD1-CG 4.31Å; F88-L146 HydrophobicContact CD2-CD2 4.35Å; F88-L146 HydrophobicContact CE1-CD1 3.69Å; F88-L146 HydrophobicContact CE1-CD2 4.13Å; F88-L146 HydrophobicContact CG-CD2 3.61Å; F88-L146 HydrophobicContact CZ-CD1 4.27Å; N109-L146 PolarHBondContact ND2-O 2.79Å; I120-L146 HydrophobicContact CD1-CB 3.62Å; I120-L146 HydrophobicContact CG1-CB 4.14Å; I120-L146 HydrophobicContact CG2-CD1 4.04Å; L142-L146 HydrophobicContact CD1-CD1 4.36Å; L142-L146 HydrophobicContact CD1-CG 4.41Å; L142-L146 HydrophobicContact CG-CD1 4.16Å; L142-L146 VanDerWaalsContact O-CG 3.3Å; L142-L146 WeakPolarHBondContact O-CG 3.21Å; L142-L146 PolarHBondContact O-N 3.49Å; L142-L146 VanDerWaalsContact O-N 3.13Å; K143-L146 PolarHBondContact O-N 3.21Å; E144-L146 PolarHBondContact O-N 3.38Å; L146-F148 VanDerWaalsContact O-CD2 3.25Å; L146-F148 WeakPolarHBondContact O-CD2 3.37Å; L146-F148 WeakPolarHBondContact O-CE2 3.29Å; L146-R259 HydrophobicContact CD2-CG 4.04Å
147V95.4Very high94.8Very high18 Ų1833.8 Ų33.811%0.10919%0.187CC..  trans-89.1123.4172.8178.30000109.2I120 K143 E144 K255I120-V147 HydrophobicContact CD1-CG2 3.66Å; K143-V147 PolarHBondContact O-N 3.5Å; E144-V147 PolarHBondContact O-N 3.21Å; V147-K255 VanDerWaalsContact O-CE 3.22Å; V147-K255 WeakPolarHBondContact O-CE 3.49Å; V147-K255 PolarHBondContact O-NZ 3.08Å
148F95.9Very high95.1Very high6 Ų625.3 Ų25.33%0.02615%0.147CC..  trans-117.6141.4-177.9-68.6-93.8000110.5N109 F110 L146 A152 Q153 F252 K255N109-F148 WeakPolarHBondContact ND2-CE2 3.49Å; F110-F148 HydrophobicContact CD1-CD2 4.12Å; F110-F148 AromaticContact CE1-CD2 3.71Å; F110-F148 HydrophobicContact CE1-CD2 3.71Å; F110-F148 HydrophobicContact CE1-CE2 4.02Å; F110-F148 HydrophobicContact CE1-CG 4.17Å; L146-F148 VanDerWaalsContact O-CD2 3.25Å; L146-F148 WeakPolarHBondContact O-CD2 3.37Å; L146-F148 WeakPolarHBondContact O-CE2 3.29Å; F148-A152 HydrophobicContact CB-CB 4.15Å; F148-A152 HydrophobicContact CD1-CB 3.99Å; F148-Q153 HydrophobicContact CB-CG 3.85Å; F148-Q153 PolarHBondContact O-NE2 2.84Å; F148-F252 HydrophobicContact CD1-CD2 4.08Å; F148-F252 AromaticContact CE1-CD2 3.59Å; F148-F252 HydrophobicContact CE1-CD2 3.59Å; F148-F252 HydrophobicContact CE1-CE2 4.24Å; F148-F252 HydrophobicContact CE1-CG 4.41Å; F148-F252 HydrophobicContact CZ-CD2 4.36Å; F148-K255 HydrophobicContact CD1-CB 4.03Å; F148-K255 HydrophobicContact CD1-CG 4.15Å; F148-K255 HydrophobicContact CE1-CB 3.41Å; F148-K255 VanDerWaalsContact CE1-CB 3.41Å; F148-K255 HydrophobicContact CE1-CG 4.05Å; F148-K255 HydrophobicContact CZ-CB 3.81Å
149S96.5Very high95.6Very high31 Ų3125 Ų2522%0.21714%0.14CC..  trans-61.3164.3168.470.20000112.5E151 A152 Q153 E251S149-E151 VanDerWaalsContact C-N 3.26Å; S149-E151 PolarHBondContact O-N 2.94Å; S149-A152 PolarHBondContact O-N 3.09Å; S149-A152 WeakPolarHBondContact OG-CB 3.41Å; S149-A152 PolarHBondContact OG-N 3.21Å; S149-A152 VanDerWaalsContact OG-N 3.08Å; S149-Q153 VanDerWaalsContact O-CG 3.25Å; S149-Q153 WeakPolarHBondContact O-CG 3.26Å; S149-Q153 PolarHBondContact O-N 3.09Å; S149-E251 WeakPolarHBondContact CB-OE1 3.47Å; S149-E251 WeakPolarHBondContact CB-OE2 3.05Å; S149-E251 PolarHBondContact N-OE1 2.9Å; S149-E251 PolarHBondContact OG-OE1 2.95Å; S149-E251 PolarHBondContact OG-OE2 3.5Å
150A96.3Very high96Very high57 Ų5725.6 Ų25.647%0.47114%0.143SC..Hα-helixtrans-60.9-38.2176.800000111.7Q153 K154A150-Q153 PolarHBondContact O-N 3.42Å; A150-K154 WeakPolarHBondContact O-CB 3.36Å; A150-K154 WeakPolarHBondContact O-CG 3.43Å; A150-K154 PolarHBondContact O-N 2.81Å
151E97.6Very high96.3Very high74 Ų7423.2 Ų23.235%0.34613%0.126SC..Hα-helixtrans-63.7-44.6176.5-65.883.8172.800111.4S149 K154 F155 E244 G248S149-E151 VanDerWaalsContact C-N 3.26Å; S149-E151 PolarHBondContact O-N 2.94Å; E151-K154 PolarHBondContact O-N 3.05Å; E151-F155 WeakPolarHBondContact O-CB 3.49Å; E151-F155 PolarHBondContact O-N 3.04Å; E151-E244 HydrophobicContact CG-CB 4.02Å; E151-G248 VanDerWaalsContact C-CA 3.5Å
152A98Very high96.5Very high0 Ų021.7 Ų21.70%011%0.114CC..Hα-helixtrans-66.9-37.817800000112.2F148 S149 F155 A156 G248 E251 F252F148-A152 HydrophobicContact CB-CB 4.15Å; F148-A152 HydrophobicContact CD1-CB 3.99Å; S149-A152 PolarHBondContact O-N 3.09Å; S149-A152 WeakPolarHBondContact OG-CB 3.41Å; S149-A152 PolarHBondContact OG-N 3.21Å; S149-A152 VanDerWaalsContact OG-N 3.08Å; A152-F155 PolarHBondContact O-N 3.39Å; A152-A156 VanDerWaalsContact O-CB 3.28Å; A152-A156 WeakPolarHBondContact O-CB 3.37Å; A152-A156 PolarHBondContact O-N 3.28Å; A152-G248 WeakPolarHBondContact CA-O 3.43Å; A152-G248 WeakPolarHBondContact CB-O 3.39Å; A152-E251 HydrophobicContact CB-CB 4.2Å; A152-E251 HydrophobicContact CB-CG 4.22Å; A152-F252 HydrophobicContact CB-CB 4.29Å
153Q97.8Very high96.7Very high5 Ų523.7 Ų23.72%0.02312%0.121CC..Hα-helixtrans-63.1-46.4173.8-67.5178.325.900111.6F110 F148 S149 A150 A156 I157F110-Q153 HydrophobicContact CB-CG 4.15Å; F110-Q153 HydrophobicContact CD1-CG 4.25Å; F110-Q153 HydrophobicContact CD2-CB 3.75Å; F110-Q153 HydrophobicContact CD2-CG 3.54Å; F110-Q153 HydrophobicContact CE2-CB 3.85Å; F110-Q153 HydrophobicContact CE2-CG 3.86Å; F110-Q153 HydrophobicContact CG-CB 4.45Å; F110-Q153 HydrophobicContact CG-CG 3.75Å; F110-Q153 HydrophobicContact CZ-CG 4.33Å; F110-Q153 PolarHBondContact O-NE2 3.15Å; F110-Q153 PolarHBondContact O-OE1 3.03Å; F148-Q153 HydrophobicContact CB-CG 3.85Å; F148-Q153 PolarHBondContact O-NE2 2.84Å; S149-Q153 VanDerWaalsContact O-CG 3.25Å; S149-Q153 WeakPolarHBondContact O-CG 3.26Å; S149-Q153 PolarHBondContact O-N 3.09Å; A150-Q153 PolarHBondContact O-N 3.42Å; Q153-A156 PolarHBondContact O-N 2.66Å; Q153-I157 WeakPolarHBondContact O-CG1 3.4Å; Q153-I157 PolarHBondContact O-N 3.43Å; Q153-I157 VanDerWaalsContact O-N 3.09Å
154K98Very high96.9Very high42 Ų4221 Ų2118%0.18311%0.11CC..Hα-helixtrans-59.3-47.7175.9-77.7179.5-178.6-174.80111.9V64 Q67 V68 A150 E151 A156 I157 A158 Y245V64-K154 HydrophobicContact CG1-CG 3.94Å; Q67-K154 VanDerWaalsContact CD-CE 3.5Å; V68-K154 HydrophobicContact CG2-CB 4.1Å; V68-K154 HydrophobicContact CG2-CG 4.1Å; A150-K154 WeakPolarHBondContact O-CB 3.36Å; A150-K154 WeakPolarHBondContact O-CG 3.43Å; A150-K154 PolarHBondContact O-N 2.81Å; E151-K154 PolarHBondContact O-N 3.05Å; K154-A156 PolarHBondContact O-N 3.33Å; K154-I157 PolarHBondContact O-N 3Å; K154-A158 VanDerWaalsContact O-CB 3.28Å; K154-A158 WeakPolarHBondContact O-CB 3.32Å; K154-A158 PolarHBondContact O-N 2.91Å; K154-Y245 HydrophobicContact CB-CD1 4.37Å; K154-Y245 HydrophobicContact CB-CE1 3.71Å; K154-Y245 HydrophobicContact CD-CE2 4.48Å
155F98.5Very high97Very high0 Ų018.3 Ų18.30%010%0.097CC..Hα-helixtrans-58.1-47.4175.8172.6-91.3000111.9E151 A152 I157 A158 R159 D235 A238 A239 Y245 F252 Y253 I301E151-F155 WeakPolarHBondContact O-CB 3.49Å; E151-F155 PolarHBondContact O-N 3.04Å; A152-F155 PolarHBondContact O-N 3.39Å; F155-I157 VanDerWaalsContact C-N 3.28Å; F155-I157 PolarHBondContact O-N 3.01Å; F155-A158 PolarHBondContact O-N 3.03Å; F155-R159 WeakPolarHBondContact O-CG 3.34Å; F155-R159 PolarHBondContact O-N 3.16Å; F155-D235 HydrophobicContact CZ-CB 4.23Å; F155-A238 HydrophobicContact CD2-CB 3.89Å; F155-A238 HydrophobicContact CE2-CB 3.77Å; F155-A239 HydrophobicContact CE2-CB 4.04Å; F155-Y245 HydrophobicContact CB-CD1 4.43Å; F155-Y245 WeakPolarHBondContact CD2-O 3.32Å; F155-F252 HydrophobicContact CD1-CB 3.92Å; F155-F252 AromaticContact CD1-CD1 3.93Å; F155-F252 HydrophobicContact CD1-CD1 3.93Å; F155-F252 HydrophobicContact CD1-CG 4.03Å; F155-F252 HydrophobicContact CE1-CB 4.36Å; F155-F252 AromaticContact CE1-CD1 3.72Å; F155-F252 HydrophobicContact CE1-CD1 3.72Å; F155-F252 HydrophobicContact CE1-CE1 4.34Å; F155-F252 HydrophobicContact CE1-CG 4.28Å; F155-Y253 AromaticContact CE1-CE2 3.94Å; F155-Y253 HydrophobicContact CE1-CE2 3.94Å; F155-Y253 HydrophobicContact CZ-CE2 4.03Å; F155-I301 HydrophobicContact CE1-CD1 4.26Å; F155-I301 HydrophobicContact CE2-CD1 3.75Å; F155-I301 HydrophobicContact CZ-CD1 3.42Å; F155-I301 VanDerWaalsContact CZ-CD1 3.42Å
156A98.1Very high97Very high0 Ų019.9 Ų19.90%011%0.107CC..Hα-helixtrans-61.2-35.9-177.700000112.8P90 F110 A152 Q153 K154 R159 F252P90-A156 HydrophobicContact CG-CB 3.79Å; F110-A156 HydrophobicContact CE2-CB 4.01Å; F110-A156 HydrophobicContact CZ-CB 3.79Å; A152-A156 VanDerWaalsContact O-CB 3.28Å; A152-A156 WeakPolarHBondContact O-CB 3.37Å; A152-A156 PolarHBondContact O-N 3.28Å; Q153-A156 PolarHBondContact O-N 2.66Å; K154-A156 PolarHBondContact O-N 3.33Å; A156-R159 WeakPolarHBondContact O-CG 3.21Å; A156-F252 HydrophobicContact CB-CD2 3.57Å; A156-F252 HydrophobicContact CB-CE2 3.37Å; A156-F252 HydrophobicContact CB-CG 4.31Å; A156-F252 HydrophobicContact CB-CZ 3.96Å
157I98.4Very high97Very high0 Ų020.1 Ų20.10%011%0.11CC..Hα-helixtrans-75.6-44.6174.6-65.2163.5000110.3V64 F65 V68 P90 I106 F110 Q153 K154 F155 R159 E160 V161V64-I157 HydrophobicContact CG1-CD1 3.75Å; F65-I157 HydrophobicContact CD2-CG2 3.88Å; V68-I157 HydrophobicContact CB-CG2 4.13Å; V68-I157 HydrophobicContact CG1-CG2 3.95Å; V68-I157 HydrophobicContact CG2-CB 4.23Å; V68-I157 HydrophobicContact CG2-CG2 4.17Å; P90-I157 HydrophobicContact CG-CG1 4.34Å; I106-I157 HydrophobicContact CD1-CD1 3.77Å; I106-I157 HydrophobicContact CD1-CG1 4.16Å; I106-I157 HydrophobicContact CG1-CD1 4.37Å; I106-I157 HydrophobicContact CG1-CG1 4.33Å; I106-I157 HydrophobicContact CG2-CD1 4.45Å; F110-I157 HydrophobicContact CE2-CG1 4.47Å; Q153-I157 WeakPolarHBondContact O-CG1 3.4Å; Q153-I157 PolarHBondContact O-N 3.43Å; Q153-I157 VanDerWaalsContact O-N 3.09Å; K154-I157 PolarHBondContact O-N 3Å; F155-I157 VanDerWaalsContact C-N 3.28Å; F155-I157 PolarHBondContact O-N 3.01Å; I157-R159 VanDerWaalsContact C-N 3.33Å; I157-R159 PolarHBondContact O-N 3.43Å; I157-E160 PolarHBondContact O-N 2.85Å; I157-E160 VanDerWaalsContact O-N 3.09Å; I157-V161 HydrophobicContact CG2-CG2 4.41Å; I157-V161 PolarHBondContact O-N 2.78Å
158A98.2Very high97Very high0 Ų019.2 Ų19.20%011%0.105CC..Hα-helixtrans-62.1-36.2-177.900000113.4V68 K154 F155 E160 V161 A162 A238 M241 Y245V68-A158 HydrophobicContact CG1-CB 3.71Å; K154-A158 VanDerWaalsContact O-CB 3.28Å; K154-A158 WeakPolarHBondContact O-CB 3.32Å; K154-A158 PolarHBondContact O-N 2.91Å; F155-A158 PolarHBondContact O-N 3.03Å; A158-E160 VanDerWaalsContact C-N 3.31Å; A158-E160 PolarHBondContact O-N 3.13Å; A158-V161 PolarHBondContact O-N 3.19Å; A158-A162 WeakPolarHBondContact O-CB 3.33Å; A158-A162 PolarHBondContact O-N 3.38Å; A158-A238 HydrophobicContact CB-CB 3.87Å; A158-M241 HydrophobicContact CB-SD 3.87Å; A158-Y245 HydrophobicContact CB-CD1 3.98Å; A158-Y245 HydrophobicContact CB-CE1 3.57Å
159R97.6Very high97Very high21 Ų2119.1 Ų19.18%0.07910%0.104CC..Hα-helixtrans-64-35.1174.664.1-178.3-69.9-82.4-1112.4F155 A156 I157 R163 D235 A238 Y253F155-R159 WeakPolarHBondContact O-CG 3.34Å; F155-R159 PolarHBondContact O-N 3.16Å; A156-R159 WeakPolarHBondContact O-CG 3.21Å; I157-R159 VanDerWaalsContact C-N 3.33Å; I157-R159 PolarHBondContact O-N 3.43Å; R159-R163 WeakPolarHBondContact O-CB 3.3Å; R159-R163 PolarHBondContact O-N 2.91Å; R159-D235 IonicContact CZ-OD1 3.28Å; R159-D235 IonicContact NE-OD1 3.31Å; R159-D235 PolarHBondContact NE-OD1 3.28Å; R159-A238 HydrophobicContact CB-CB 4.03Å; R159-Y253 PolarHBondContact NE-OH 3.35Å; R159-Y253 VanDerWaalsContact NE-OH 3.15Å
160E97.4Very high97.1Very high13 Ų1319.6 Ų19.66%0.06111%0.106CC..Hα-helixtrans-71.8-40.4174.3-68.4-54.6132.700111.4P90 I104 I157 A158 A162 R163 L164P90-E160 HydrophobicContact CB-CG 4.05Å; I104-E160 HydrophobicContact CD1-CB 4.03Å; I104-E160 HydrophobicContact CG1-CB 4.29Å; I104-E160 HydrophobicContact CG2-CB 4.42Å; I157-E160 PolarHBondContact O-N 2.85Å; I157-E160 VanDerWaalsContact O-N 3.09Å; A158-E160 VanDerWaalsContact C-N 3.31Å; A158-E160 PolarHBondContact O-N 3.13Å; E160-A162 VanDerWaalsContact C-N 3.35Å; E160-A162 PolarHBondContact O-N 3.49Å; E160-R163 PolarHBondContact O-N 3.25Å; E160-R163 IonicContact OE2-CZ 3.61Å; E160-R163 VanDerWaalsContact OE2-CZ 3.31Å; E160-R163 IonicContact OE2-NE 3.96Å; E160-R163 PolarHBondContact OE2-NE 3.43Å; E160-R163 IonicContact OE2-NH2 2.75Å; E160-R163 PolarHBondContact OE2-NH2 2.93Å; E160-L164 WeakPolarHBondContact O-CG 3.16Å; E160-L164 PolarHBondContact O-N 3.28Å
161V97.9Very high97.1Very high0 Ų020.1 Ų20.10%010%0.1CC..Hα-helixtrans-57.8-48.1171.9174.80000110.6V68 L69 F72 I74 F80 I104 I157 A158 R163 L164 Q165V68-V161 HydrophobicContact CG1-CG2 4.18Å; L69-V161 HydrophobicContact CD2-CG1 4.16Å; L69-V161 HydrophobicContact CD2-CG2 3.94Å; F72-V161 HydrophobicContact CD1-CG1 4.22Å; F72-V161 HydrophobicContact CG-CG1 4.23Å; I74-V161 HydrophobicContact CD1-CG1 3.9Å; I74-V161 HydrophobicContact CG1-CG1 4.05Å; F80-V161 HydrophobicContact CE1-CG1 4.14Å; F80-V161 HydrophobicContact CZ-CG1 4.28Å; I104-V161 HydrophobicContact CD1-CB 4.32Å; I104-V161 HydrophobicContact CD1-CG2 3.4Å; I157-V161 HydrophobicContact CG2-CG2 4.41Å; I157-V161 PolarHBondContact O-N 2.78Å; A158-V161 PolarHBondContact O-N 3.19Å; V161-R163 VanDerWaalsContact C-N 3.32Å; V161-R163 PolarHBondContact O-N 3.49Å; V161-L164 PolarHBondContact O-N 3.23Å; V161-Q165 WeakPolarHBondContact O-CB 3.35Å; V161-Q165 PolarHBondContact O-N 2.91Å
162A97.5Very high97Very high0 Ų019.4 Ų19.40%010%0.101CC..Hα-helixtrans-59.8-41.2178.500000112.4F72 A158 E160 S166 R237F72-A162 HydrophobicContact CE2-CB 3.78Å; F72-A162 HydrophobicContact CZ-CB 3.53Å; A158-A162 WeakPolarHBondContact O-CB 3.33Å; A158-A162 PolarHBondContact O-N 3.38Å; E160-A162 VanDerWaalsContact C-N 3.35Å; E160-A162 PolarHBondContact O-N 3.49Å; A162-S166 VanDerWaalsContact O-CB 3.31Å; A162-S166 WeakPolarHBondContact O-CB 3.32Å; A162-S166 PolarHBondContact O-N 3.08Å; A162-S166 PolarHBondContact O-OG 3.1Å; A162-R237 HydrophobicContact CB-CB 4.05Å
163R96.8Very high96.9Very high43 Ų4319.6 Ų19.616%0.16210%0.103CC..Hα-helixtrans-64.8-45.4178.3-171.8-179.665.175.73.2112.3G92 R159 E160 V161 S166 G168 I230 S234G92-R163 VanDerWaalsContact C-NH2 3.27Å; G92-R163 PolarHBondContact O-NH2 3.3Å; R159-R163 WeakPolarHBondContact O-CB 3.3Å; R159-R163 PolarHBondContact O-N 2.91Å; E160-R163 PolarHBondContact O-N 3.25Å; E160-R163 IonicContact OE2-CZ 3.61Å; E160-R163 VanDerWaalsContact OE2-CZ 3.31Å; E160-R163 IonicContact OE2-NE 3.96Å; E160-R163 PolarHBondContact OE2-NE 3.43Å; E160-R163 IonicContact OE2-NH2 2.75Å; E160-R163 PolarHBondContact OE2-NH2 2.93Å; V161-R163 VanDerWaalsContact C-N 3.32Å; V161-R163 PolarHBondContact O-N 3.49Å; R163-S166 PolarHBondContact O-OG 3.22Å; R163-G168 PolarHBondContact O-N 2.86Å; R163-I230 HydrophobicContact CG-CG2 3.59Å; R163-S234 WeakPolarHBondContact CA-OG 3.23Å; R163-S234 WeakPolarHBondContact CB-OG 3.47Å
164L96.8Very high96.8Very high1 Ų121.1 Ų21.11%0.00512%0.117CC..Hα-helixtrans-72.7-41.7-179.7-63.4176.1000111.2F80 P96 A102 I104 E160 V161 S166 G167 P169F80-L164 HydrophobicContact CE1-CB 4.23Å; P96-L164 WeakPolarHBondContact CD-O 3.13Å; P96-L164 HydrophobicContact CG-CB 4.39Å; A102-L164 HydrophobicContact CB-CB 4.24Å; A102-L164 HydrophobicContact CB-CD1 3.9Å; I104-L164 HydrophobicContact CD1-CD1 4.24Å; I104-L164 HydrophobicContact CG1-CD1 3.84Å; E160-L164 WeakPolarHBondContact O-CG 3.16Å; E160-L164 PolarHBondContact O-N 3.28Å; V161-L164 PolarHBondContact O-N 3.23Å; L164-S166 VanDerWaalsContact C-N 3.3Å; L164-S166 PolarHBondContact O-N 2.94Å; L164-G167 PolarHBondContact O-N 3.44Å; L164-G167 VanDerWaalsContact O-N 3.13Å; L164-P169 HydrophobicContact CD2-CG 3.66Å
165Q95.6Very high96.7Very high72 Ų7219.4 Ų19.434%0.33611%0.11SC..Hα-helixtrans-64.5-31.9178.5-173.362.617.600113.1I74 F80 V161 G167I74-Q165 HydrophobicContact CD1-CB 4.44Å; I74-Q165 HydrophobicContact CD1-CG 3.99Å; F80-Q165 HydrophobicContact CZ-CB 4.28Å; V161-Q165 WeakPolarHBondContact O-CB 3.35Å; V161-Q165 PolarHBondContact O-N 2.91Å; Q165-G167 PolarHBondContact O-N 2.75Å
166S93.9Very high96.6Very high34 Ų3420.3 Ų20.324%0.23812%0.117CC..THydrogen-bonded Turntrans-80.3-0.4176.757.50000114.1A162 R163 L164A162-S166 VanDerWaalsContact O-CB 3.31Å; A162-S166 WeakPolarHBondContact O-CB 3.32Å; A162-S166 PolarHBondContact O-N 3.08Å; A162-S166 PolarHBondContact O-OG 3.1Å; R163-S166 PolarHBondContact O-OG 3.22Å; L164-S166 VanDerWaalsContact C-N 3.3Å; L164-S166 PolarHBondContact O-N 2.94Å
167G95.4Very high96.5Very high5 Ų521.1 Ų21.15%0.05212%0.122CC..THydrogen-bonded Turntrans77.222-178.300000114.7W97 L164 Q165 P169 V170 L171W97-G167 VanDerWaalsContact CH2-CA 3.44Å; L164-G167 PolarHBondContact O-N 3.44Å; L164-G167 VanDerWaalsContact O-N 3.13Å; Q165-G167 PolarHBondContact O-N 2.75Å; G167-P169 VanDerWaalsContact C-N 3.32Å; G167-V170 PolarHBondContact O-N 3.06Å; G167-L171 PolarHBondContact O-N 3.49Å
168G95.8Very high96.4Very high0 Ų028.4 Ų28.40%015%0.154CC..Hα-helixtrans-44.6-51177.900000113.6R163 V170 L171 T172R163-G168 PolarHBondContact O-N 2.86Å; G168-V170 VanDerWaalsContact C-N 3.34Å; G168-V170 PolarHBondContact O-N 2.82Å; G168-L171 PolarHBondContact O-N 3.32Å; G168-T172 PolarHBondContact O-N 3.36Å; G168-T172 PolarHBondContact O-OG1 3.14Å; G168-T172 VanDerWaalsContact O-OG1 3.1Å
169P95.6Very high96.3Very high3 Ų328.8 Ų28.82%0.01916%0.157CC..Hα-helixtrans-49.5-47.1173.8-3642.7000115.5H35 G94 V95 L164 G167 A173H35-P169 HydrophobicContact CB-CB 4.28Å; G94-P169 WeakPolarHBondContact O-CG 3.37Å; V95-P169 HydrophobicContact CG2-CB 4.41Å; L164-P169 HydrophobicContact CD2-CG 3.66Å; G167-P169 VanDerWaalsContact C-N 3.32Å; P169-A173 WeakPolarHBondContact O-CB 3.41Å; P169-A173 PolarHBondContact O-N 3.46Å
170V97.4Very high96.1Very high42 Ų4230.6 Ų30.626%0.25517%0.168SC..Hα-helixtrans-69.5-43.9-177.9177.30000110.6F28 M32 V95 W97 G167 G168 A173 A174F28-V170 HydrophobicContact CZ-CG1 4.3Å; M32-V170 HydrophobicContact CE-CG2 3.87Å; M32-V170 HydrophobicContact SD-CG2 4.21Å; V95-V170 HydrophobicContact CG1-CG2 4.42Å; V95-V170 HydrophobicContact CG2-CG2 3.94Å; W97-V170 HydrophobicContact CZ2-CG2 3.98Å; G167-V170 PolarHBondContact O-N 3.06Å; G168-V170 VanDerWaalsContact C-N 3.34Å; G168-V170 PolarHBondContact O-N 2.82Å; V170-A173 PolarHBondContact O-N 2.85Å; V170-A174 WeakPolarHBondContact O-CB 3.31Å; V170-A174 PolarHBondContact O-N 2.66Å
171L96.8Very high95.9Very high67 Ų6731 Ų3135%0.35118%0.176SC..Hα-helixtrans-61.3-48.2177.8-65.4174.6000110.8G167 G168 A173 A174 L226 W229 I230G167-L171 PolarHBondContact O-N 3.49Å; G168-L171 PolarHBondContact O-N 3.32Å; L171-A173 PolarHBondContact O-N 2.78Å; L171-A174 PolarHBondContact O-N 3.39Å; L171-L226 HydrophobicContact CB-CD1 4.27Å; L171-L226 HydrophobicContact CB-CD2 3.98Å; L171-L226 WeakPolarHBondContact O-CD2 3.47Å; L171-W229 HydrophobicContact CD1-CH2 4.34Å; L171-W229 HydrophobicContact CD1-CZ3 3.72Å; L171-I230 HydrophobicContact CB-CD1 4.43Å
172T94.8Very high95.7Very high59 Ų5931.9 Ų31.936%0.36218%0.184SC..Hα-helixtrans-60.6-43.6177.2-58.40000111.5G168 A174 V175G168-T172 PolarHBondContact O-N 3.36Å; G168-T172 PolarHBondContact O-OG1 3.14Å; G168-T172 VanDerWaalsContact O-OG1 3.1Å; T172-A174 VanDerWaalsContact C-N 3.25Å; T172-A174 PolarHBondContact O-N 2.85Å; T172-V175 PolarHBondContact O-N 3.37Å
173A95.8Very high95.6Very high4 Ų433.1 Ų33.13%0.03319%0.192CC..Hα-helixtrans-65.6-27.2179.200000113.5F28 N31 M32 P169 V170 L171 P177F28-A173 HydrophobicContact CD2-CB 4.07Å; F28-A173 HydrophobicContact CE2-CB 3.93Å; N31-A173 HydrophobicContact CB-CB 3.71Å; M32-A173 HydrophobicContact CG-CB 3.63Å; M32-A173 HydrophobicContact SD-CB 3.47Å; M32-A173 WeakPolarHBondContact SD-CB 3.41Å; P169-A173 WeakPolarHBondContact O-CB 3.41Å; P169-A173 PolarHBondContact O-N 3.46Å; V170-A173 PolarHBondContact O-N 2.85Å; L171-A173 PolarHBondContact O-N 2.78Å; A173-P177 WeakPolarHBondContact O-CD 3.43Å
174A97.1Very high95.4Very high38 Ų3837.4 Ų37.431%0.31421%0.208SC..Hα-helixtrans-77.6-18.7-17900000114.4F28 V170 L171 T172 A176 P177 F178F28-A174 HydrophobicContact CE2-CB 4.26Å; V170-A174 WeakPolarHBondContact O-CB 3.31Å; V170-A174 PolarHBondContact O-N 2.66Å; L171-A174 PolarHBondContact O-N 3.39Å; T172-A174 VanDerWaalsContact C-N 3.25Å; T172-A174 PolarHBondContact O-N 2.85Å; A174-A176 PolarHBondContact O-N 3.28Å; A174-P177 WeakPolarHBondContact O-CD 3.26Å; A174-F178 VanDerWaalsContact O-CB 3.25Å; A174-F178 WeakPolarHBondContact O-CB 3.35Å; A174-F178 PolarHBondContact O-N 2.9Å
175V96.2Very high95.2Very high6 Ų640.6 Ų40.64%0.03623%0.228CC..Hα-helixtrans-60.3-50.5-176.5178.70000112.1T172 F178 C179 Y219 T222 L226T172-V175 PolarHBondContact O-N 3.37Å; V175-F178 WeakPolarHBondContact O-CB 3.41Å; V175-F178 PolarHBondContact O-N 3.21Å; V175-C179 PolarHBondContact O-N 3.36Å; V175-C179 PolarHBondContact O-SG 3.5Å; V175-C179 VanDerWaalsContact O-SG 3.33Å; V175-Y219 HydrophobicContact CG1-CD2 3.9Å; V175-Y219 HydrophobicContact CG1-CE2 4.13Å; V175-T222 HydrophobicContact CG1-CG2 3.9Å; V175-T222 HydrophobicContact CG2-CG2 4.44Å; V175-L226 HydrophobicContact CG2-CD2 3.32Å
176A94.6Very high95.1Very high19 Ų1941 Ų4116%0.15723%0.227CC..Hα-helixtrans-62.9-47.8-177.900000112.8V27 A174 F178 C179 L180 Y219V27-A176 HydrophobicContact CG1-CB 3.62Å; A174-A176 PolarHBondContact O-N 3.28Å; A176-F178 VanDerWaalsContact C-N 3.32Å; A176-F178 PolarHBondContact O-N 3.01Å; A176-C179 PolarHBondContact O-N 3.34Å; A176-L180 WeakPolarHBondContact O-CB 3.32Å; A176-L180 PolarHBondContact O-N 2.78Å; A176-Y219 HydrophobicContact CB-CD2 4.21Å; A176-Y219 HydrophobicContact CB-CE2 3.83Å
177P96.3Very high95Very high17 Ų1740.1 Ų40.111%0.1122%0.221CC..Hα-helixtrans-56.8-41.2171.6-24.531.2000113.7C24 V27 F28 A173 A174 L180 G181C24-P177 HydrophobicContact CB-CB 4.05Å; C24-P177 PolarHBondContact SG-O 3.17Å; V27-P177 HydrophobicContact CG1-CG 4.35Å; F28-P177 HydrophobicContact CB-CG 3.71Å; F28-P177 HydrophobicContact CD2-CG 4.28Å; A173-P177 WeakPolarHBondContact O-CD 3.43Å; A174-P177 WeakPolarHBondContact O-CD 3.26Å; P177-L180 PolarHBondContact O-N 2.81Å; P177-G181 PolarHBondContact O-N 3.42Å
178F96.2Very high94.8Very high152 Ų15242.2 Ų42.267%0.66723%0.232SC*.Hα-helixtrans-61.6-49.7177.7176-100.2000111.4A174 V175 A176 L180 G181 G182A174-F178 VanDerWaalsContact O-CB 3.25Å; A174-F178 WeakPolarHBondContact O-CB 3.35Å; A174-F178 PolarHBondContact O-N 2.9Å; V175-F178 WeakPolarHBondContact O-CB 3.41Å; V175-F178 PolarHBondContact O-N 3.21Å; A176-F178 VanDerWaalsContact C-N 3.32Å; A176-F178 PolarHBondContact O-N 3.01Å; F178-L180 VanDerWaalsContact C-N 3.34Å; F178-L180 PolarHBondContact O-N 2.68Å; F178-G181 PolarHBondContact O-N 2.61Å; F178-G182 PolarHBondContact O-N 2.78Å
179C95.9Very high94.6Very high8 Ų845.7 Ų45.75%0.05425%0.253CS..Hα-helixtrans-67.5-33.8178.5-63.40000112.6V175 A176 G182 V183 Y219V175-C179 PolarHBondContact O-N 3.36Å; V175-C179 PolarHBondContact O-SG 3.5Å; V175-C179 VanDerWaalsContact O-SG 3.33Å; A176-C179 PolarHBondContact O-N 3.34Å; C179-G182 CarbonylContact O-C 3.56Å; C179-G182 WeakPolarHBondContact O-CA 3.18Å; C179-G182 PolarHBondContact O-N 2.91Å; C179-G182 VanDerWaalsContact O-N 3.15Å; C179-V183 PolarHBondContact O-N 2.99Å; C179-Y219 VanDerWaalsContact SG-CA 3.5Å
180L93.9Very high94.4Very high59 Ų5947.3 Ų47.331%0.30926%0.262SS..Hα-helixtrans-64.6-41.8173.9-175.264.4000111.7L20 A176 P177 F178 G182 V183 W184L20-L180 HydrophobicContact CD1-CD2 4.39Å; L20-L180 HydrophobicContact CD1-CG 4.01Å; A176-L180 WeakPolarHBondContact O-CB 3.32Å; A176-L180 PolarHBondContact O-N 2.78Å; P177-L180 PolarHBondContact O-N 2.81Å; F178-L180 VanDerWaalsContact C-N 3.34Å; F178-L180 PolarHBondContact O-N 2.68Å; L180-G182 VanDerWaalsContact C-N 3.28Å; L180-G182 PolarHBondContact O-N 2.86Å; L180-V183 WeakPolarHBondContact O-CB 3.46Å; L180-V183 PolarHBondContact O-N 3.13Å; L180-W184 PolarHBondContact O-N 3.31Å
181G93.9Very high94.1Very high22 Ų2246.4 Ų46.423%0.22725%0.254CS..Hα-helixtrans-59.8-41169.300000111.9P177 F178 V183 W184 V185P177-G181 PolarHBondContact O-N 3.42Å; F178-G181 PolarHBondContact O-N 2.61Å; G181-V183 PolarHBondContact O-N 3.37Å; G181-W184 WeakPolarHBondContact O-CB 3.4Å; G181-W184 PolarHBondContact O-N 2.91Å; G181-W184 VanDerWaalsContact O-N 3.16Å; G181-V185 PolarHBondContact O-N 3.02Å
182G94.4Very high93.8Very high18 Ų1849.7 Ų49.719%0.18627%0.268CS..Hα-helixtrans-56.8-42.9173.200000113.5F178 C179 L180 W184 V185 Y186F178-G182 PolarHBondContact O-N 2.78Å; C179-G182 CarbonylContact O-C 3.56Å; C179-G182 WeakPolarHBondContact O-CA 3.18Å; C179-G182 PolarHBondContact O-N 2.91Å; C179-G182 VanDerWaalsContact O-N 3.15Å; L180-G182 VanDerWaalsContact C-N 3.28Å; L180-G182 PolarHBondContact O-N 2.86Å; G182-W184 VanDerWaalsContact C-N 3.26Å; G182-W184 PolarHBondContact O-N 3.1Å; G182-V185 PolarHBondContact O-N 2.75Å; G182-V185 VanDerWaalsContact O-N 3.08Å; G182-Y186 VanDerWaalsContact O-CD2 3.25Å; G182-Y186 WeakPolarHBondContact O-CD2 3.36Å; G182-Y186 VanDerWaalsContact O-CG 3.22Å; G182-Y186 PolarHBondContact O-N 3.26Å
183V94.9Very high93.6Very high27 Ų2752 Ų5216%0.16428%0.282CS..Hα-helixtrans-56.1-41.7175.6172.90000111.5C179 L180 G181 S187 L212C179-V183 PolarHBondContact O-N 2.99Å; L180-V183 WeakPolarHBondContact O-CB 3.46Å; L180-V183 PolarHBondContact O-N 3.13Å; G181-V183 PolarHBondContact O-N 3.37Å; V183-S187 VanDerWaalsContact O-CB 3.23Å; V183-S187 WeakPolarHBondContact O-CB 3.27Å; V183-S187 PolarHBondContact O-N 3.41Å; V183-L212 HydrophobicContact CG1-CD1 4.49Å
184W91.9Very high93.3Very high132 Ų13258 Ų5850%0.531%0.307SS..Hα-helixtrans-64.1-44177.3177.473.9000111.6L20 L180 G181 G182 S187 V188L20-W184 HydrophobicContact CD2-CB 3.81Å; L20-W184 HydrophobicContact CD2-CD2 4.06Å; L20-W184 HydrophobicContact CD2-CE3 4.33Å; L20-W184 HydrophobicContact CD2-CG 3.84Å; L180-W184 PolarHBondContact O-N 3.31Å; G181-W184 WeakPolarHBondContact O-CB 3.4Å; G181-W184 PolarHBondContact O-N 2.91Å; G181-W184 VanDerWaalsContact O-N 3.16Å; G182-W184 VanDerWaalsContact C-N 3.26Å; G182-W184 PolarHBondContact O-N 3.1Å; W184-S187 WeakPolarHBondContact O-CB 3.31Å; W184-S187 PolarHBondContact O-N 3.01Å; W184-V188 HydrophobicContact CZ2-CG2 4.49Å; W184-V188 WeakPolarHBondContact O-CG2 3.17Å; W184-V188 PolarHBondContact O-N 2.96Å
185V93Very high92.9Very high69 Ų6959 Ų5942%0.41832%0.321SS..Hα-helixtrans-62.4-50.4175.9176.80000111.1G181 G182 S187 V188 V189G181-V185 PolarHBondContact O-N 3.02Å; G182-V185 PolarHBondContact O-N 2.75Å; G182-V185 VanDerWaalsContact O-N 3.08Å; V185-S187 VanDerWaalsContact C-N 3.26Å; V185-S187 PolarHBondContact O-N 3.05Å; V185-V188 PolarHBondContact O-N 3.28Å; V185-V188 VanDerWaalsContact O-N 3.13Å; V185-V189 HydrophobicContact CG1-CG2 4.09Å; V185-V189 WeakPolarHBondContact O-CG2 3.43Å; V185-V189 PolarHBondContact O-N 2.83Å
186Y93.9Very high92.4Very high81 Ų8159.4 Ų59.432%0.31832%0.323SS..Hα-helixtrans-55.8-43.6176.8-62-34.5000111.5G182 V188 V189 L190 I214 S218G182-Y186 VanDerWaalsContact O-CD2 3.25Å; G182-Y186 WeakPolarHBondContact O-CD2 3.36Å; G182-Y186 VanDerWaalsContact O-CG 3.22Å; G182-Y186 PolarHBondContact O-N 3.26Å; Y186-V188 PolarHBondContact O-N 2.73Å; Y186-V189 PolarHBondContact O-N 3.25Å; Y186-L190 VanDerWaalsContact O-CB 3.26Å; Y186-L190 WeakPolarHBondContact O-CB 3.5Å; Y186-L190 WeakPolarHBondContact O-CD1 3.39Å; Y186-L190 WeakPolarHBondContact O-CG 3.22Å; Y186-L190 PolarHBondContact O-N 2.92Å; Y186-I214 HydrophobicContact CD2-CB 4.11Å; Y186-I214 HydrophobicContact CD2-CG2 3.7Å; Y186-I214 HydrophobicContact CE1-CG2 4.39Å; Y186-I214 HydrophobicContact CE2-CB 4.32Å; Y186-I214 HydrophobicContact CE2-CG2 3.52Å; Y186-I214 HydrophobicContact CG-CG2 4.23Å; Y186-S218 PolarHBondContact OH-OG 3.11Å; Y186-S218 VanDerWaalsContact OH-OG 3.09Å
187S91.6Very high91.6Very high15 Ų1563.6 Ų63.611%0.10534%0.339CS..Hα-helixtrans-58.4-49.8177179.40000111.2V183 W184 V185 K191 N208V183-S187 VanDerWaalsContact O-CB 3.23Å; V183-S187 WeakPolarHBondContact O-CB 3.27Å; V183-S187 PolarHBondContact O-N 3.41Å; W184-S187 WeakPolarHBondContact O-CB 3.31Å; W184-S187 PolarHBondContact O-N 3.01Å; V185-S187 VanDerWaalsContact C-N 3.26Å; V185-S187 PolarHBondContact O-N 3.05Å; S187-K191 WeakPolarHBondContact O-CB 3.38Å; S187-K191 WeakPolarHBondContact O-CE 3.34Å; S187-K191 PolarHBondContact O-N 2.84Å; S187-K191 VanDerWaalsContact OG-CE 3.32Å; S187-K191 WeakPolarHBondContact OG-CE 3.14Å; S187-K191 PolarHBondContact OG-NZ 2.91Å; S187-N208 PolarHBondContact OG-OD1 3.04Å
188V90.4Very high90.6Very high48 Ų4866.7 Ų66.729%0.29137%0.374SS..Hα-helixtrans-63.8-51179.5173.70000111.2W184 V185 Y186 L190 K191 Q192W184-V188 HydrophobicContact CZ2-CG2 4.49Å; W184-V188 WeakPolarHBondContact O-CG2 3.17Å; W184-V188 PolarHBondContact O-N 2.96Å; V185-V188 PolarHBondContact O-N 3.28Å; V185-V188 VanDerWaalsContact O-N 3.13Å; Y186-V188 PolarHBondContact O-N 2.73Å; V188-L190 PolarHBondContact O-N 2.75Å; V188-K191 PolarHBondContact O-N 3.29Å; V188-Q192 PolarHBondContact O-N 2.94Å
189V92.3Very high89.6Confident73 Ų7360.2 Ų60.244%0.44235%0.35SS..Hα-helixtrans-61.4-47.2-176.8172.60000111.3V185 Y186 K191 Q192 V193V185-V189 HydrophobicContact CG1-CG2 4.09Å; V185-V189 WeakPolarHBondContact O-CG2 3.43Å; V185-V189 PolarHBondContact O-N 2.83Å; Y186-V189 PolarHBondContact O-N 3.25Å; V189-K191 VanDerWaalsContact C-N 3.34Å; V189-K191 PolarHBondContact O-N 2.91Å; V189-Q192 WeakPolarHBondContact O-CB 3.47Å; V189-Q192 PolarHBondContact O-N 2.71Å; V189-Q192 VanDerWaalsContact O-N 3.12Å; V189-V193 HydrophobicContact CG1-CG2 4.16Å; V189-V193 VanDerWaalsContact O-CG2 3.32Å; V189-V193 WeakPolarHBondContact O-CG2 3.15Å; V189-V193 PolarHBondContact O-N 3.42Å
190L91.8Very high89Confident37 Ų3763.8 Ų63.819%0.19437%0.374CS..Hα-helixtrans-62-42.9179-70168.8000111.3Y186 V188 Q192 V193 F194 V207 V210 A211 I214Y186-L190 VanDerWaalsContact O-CB 3.26Å; Y186-L190 WeakPolarHBondContact O-CB 3.5Å; Y186-L190 WeakPolarHBondContact O-CD1 3.39Å; Y186-L190 WeakPolarHBondContact O-CG 3.22Å; Y186-L190 PolarHBondContact O-N 2.92Å; V188-L190 PolarHBondContact O-N 2.75Å; L190-Q192 VanDerWaalsContact C-N 3.27Å; L190-Q192 PolarHBondContact O-N 2.86Å; L190-V193 PolarHBondContact O-N 3.09Å; L190-F194 HydrophobicContact CB-CD2 4.46Å; L190-F194 HydrophobicContact CD2-CE2 3.99Å; L190-F194 WeakPolarHBondContact O-CD2 3.44Å; L190-F194 PolarHBondContact O-N 2.92Å; L190-V207 HydrophobicContact CB-CG1 3.41Å; L190-V207 VanDerWaalsContact CB-CG1 3.41Å; L190-V207 HydrophobicContact CD1-CG1 4.22Å; L190-V207 HydrophobicContact CG-CG1 4.47Å; L190-V210 HydrophobicContact CD1-CG1 4.19Å; L190-A211 HydrophobicContact CD1-CB 4.19Å; L190-I214 HydrophobicContact CD1-CD1 4.09Å
191K91.3Very high88.5Confident24 Ų2468 Ų6810%0.10439%0.394CS..Hα-helixtrans-62.9-35.5175.8-81.3176.3-68.6-153.30112.2S187 V188 V189 G195 L196 R204 V207 N208S187-K191 WeakPolarHBondContact O-CB 3.38Å; S187-K191 WeakPolarHBondContact O-CE 3.34Å; S187-K191 PolarHBondContact O-N 2.84Å; S187-K191 VanDerWaalsContact OG-CE 3.32Å; S187-K191 WeakPolarHBondContact OG-CE 3.14Å; S187-K191 PolarHBondContact OG-NZ 2.91Å; V188-K191 PolarHBondContact O-N 3.29Å; V189-K191 VanDerWaalsContact C-N 3.34Å; V189-K191 PolarHBondContact O-N 2.91Å; K191-G195 PolarHBondContact O-N 3.43Å; K191-L196 HydrophobicContact CG-CB 4.44Å; K191-L196 PolarHBondContact O-N 3.36Å; K191-R204 HydrophobicContact CD-CG 4.44Å; K191-V207 HydrophobicContact CG-CB 4.32Å; K191-V207 HydrophobicContact CG-CG1 3.85Å; K191-N208 PolarHBondContact NZ-OD1 3.32Å
192Q90.3Very high88.1Confident135 Ų13574.4 Ų74.463%0.63142%0.422SS*.Hα-helixtrans-69.4-48.7177-174.9172.7-8.200111.7V188 V189 L190 F194 G195 H197V188-Q192 PolarHBondContact O-N 2.94Å; V189-Q192 WeakPolarHBondContact O-CB 3.47Å; V189-Q192 PolarHBondContact O-N 2.71Å; V189-Q192 VanDerWaalsContact O-N 3.12Å; L190-Q192 VanDerWaalsContact C-N 3.27Å; L190-Q192 PolarHBondContact O-N 2.86Å; Q192-F194 VanDerWaalsContact C-N 3.31Å; Q192-F194 PolarHBondContact O-N 2.96Å; Q192-G195 PolarHBondContact O-N 3.07Å; Q192-H197 PolarHBondContact N-NE2 3.01Å
193V90.4Very high87.8Confident108 Ų10878.4 Ų78.466%0.65544%0.437SS*.Hα-helixtrans-60.2-40.8180169.80000111.6V189 L190 G195V189-V193 HydrophobicContact CG1-CG2 4.16Å; V189-V193 VanDerWaalsContact O-CG2 3.32Å; V189-V193 WeakPolarHBondContact O-CG2 3.15Å; V189-V193 PolarHBondContact O-N 3.42Å; L190-V193 PolarHBondContact O-N 3.09Å; V193-G195 VanDerWaalsContact C-N 3.32Å; V193-G195 PolarHBondContact O-N 3.28Å
194F89.1Confident87.4Confident129 Ų12981.3 Ų81.357%0.56645%0.445SS*.THydrogen-bonded Turntrans-86.12.9178.1-66.3-64.2000114L190 Q192 L196L190-F194 HydrophobicContact CB-CD2 4.46Å; L190-F194 HydrophobicContact CD2-CE2 3.99Å; L190-F194 WeakPolarHBondContact O-CD2 3.44Å; L190-F194 PolarHBondContact O-N 2.92Å; Q192-F194 VanDerWaalsContact C-N 3.31Å; Q192-F194 PolarHBondContact O-N 2.96Å; F194-L196 HydrophobicContact CB-CD1 3.57Å; F194-L196 HydrophobicContact CB-CG 3.69Å; F194-L196 HydrophobicContact CG-CD1 4.39Å; F194-L196 WeakPolarHBondContact O-CG 3.45Å; F194-L196 PolarHBondContact O-N 2.92Å
195G87.9Confident87.1Confident59 Ų5976.5 Ų76.561%0.60844%0.436SS*.THydrogen-bonded Turntrans64.621.9-178.700000114.4K191 Q192 V193 H197K191-G195 PolarHBondContact O-N 3.43Å; Q192-G195 PolarHBondContact O-N 3.07Å; V193-G195 VanDerWaalsContact C-N 3.32Å; V193-G195 PolarHBondContact O-N 3.28Å; G195-H197 PolarHBondContact O-N 2.85Å
196L86.2Confident87.1Confident16 Ų1675.7 Ų75.78%0.08444%0.437CS..THydrogen-bonded Turntrans-88.87.5-168.7-67173.4000114.3K191 F194 G198 G199 M203 R204 V207K191-L196 HydrophobicContact CG-CB 4.44Å; K191-L196 PolarHBondContact O-N 3.36Å; F194-L196 HydrophobicContact CB-CD1 3.57Å; F194-L196 HydrophobicContact CB-CG 3.69Å; F194-L196 HydrophobicContact CG-CD1 4.39Å; F194-L196 WeakPolarHBondContact O-CG 3.45Å; F194-L196 PolarHBondContact O-N 2.92Å; L196-G198 VanDerWaalsContact C-N 3.31Å; L196-G198 PolarHBondContact O-N 3.38Å; L196-G199 PolarHBondContact O-N 3.3Å; L196-G199 VanDerWaalsContact O-N 3.17Å; L196-M203 HydrophobicContact CD1-CB 4.23Å; L196-M203 HydrophobicContact CD1-CE 4.49Å; L196-M203 HydrophobicContact CD2-CB 3.96Å; L196-M203 HydrophobicContact CD2-CE 4.19Å; L196-M203 HydrophobicContact CD2-SD 3.92Å; L196-R204 HydrophobicContact CB-CG 4.43Å; L196-R204 VanDerWaalsContact O-CD 3.22Å; L196-R204 WeakPolarHBondContact O-CD 3.3Å; L196-R204 WeakPolarHBondContact O-CG 3.18Å; L196-V207 HydrophobicContact CD1-CG2 3.54Å
197H78.2Confident86.9Confident106 Ų10672.6 Ų72.649%0.49143%0.426SS..THydrogen-bonded Turntrans-61.3-39.6177.4-77.7-78.9000112.6Q192 G195Q192-H197 PolarHBondContact N-NE2 3.01Å; G195-H197 PolarHBondContact O-N 2.85Å
198G74.3Confident86.9Confident82 Ų8275 Ų7585%0.84544%0.438SS*.SBendtrans-94.81.8172.800000114.7L196L196-G198 VanDerWaalsContact C-N 3.31Å; L196-G198 PolarHBondContact O-N 3.38Å
199G75.7Confident87.1Confident16 Ų1678.6 Ų78.617%0.16545%0.454CS..SBendtrans-79.7175.7-171.300000115.3L196 R204L196-G199 PolarHBondContact O-N 3.3Å; L196-G199 VanDerWaalsContact O-N 3.17Å; G199-R204 VanDerWaalsContact O-CZ 3.3Å; G199-R204 PolarHBondContact O-NE 3.28Å; G199-R204 PolarHBondContact O-NH2 2.94Å
200P84.6Confident87.3Confident84 Ų8479 Ų7955%0.54546%0.457SS..  trans-53.9145.3179.5-24.933.7000112.9L202 M203 R204P200-L202 VanDerWaalsContact C-N 3.26Å; P200-L202 PolarHBondContact O-N 3.42Å; P200-M203 PolarHBondContact O-N 2.97Å; P200-R204 PolarHBondContact O-N 2.85Å
201M81.7Confident87.4Confident148 Ų14877.2 Ų77.273%0.72945%0.447SS*.Hα-helixtrans-59.5-36.1-178.2-172.8170178.100112.7R204 G205M201-R204 PolarHBondContact O-N 3.11Å; M201-G205 PolarHBondContact O-N 3.47Å
202L87.2Confident87.6Confident156 Ų15681.2 Ų81.282%0.81747%0.469SS*.Hα-helixtrans-62.4-45.9178.3-68.9174.3000112.4P200 R204 G205 A206P200-L202 VanDerWaalsContact C-N 3.26Å; P200-L202 PolarHBondContact O-N 3.42Å; L202-R204 PolarHBondContact O-N 3.14Å; L202-G205 WeakPolarHBondContact O-CA 3.26Å; L202-G205 PolarHBondContact O-N 3.44Å; L202-G205 VanDerWaalsContact O-N 3.15Å; L202-A206 PolarHBondContact O-N 2.92Å
203M86.8Confident87.9Confident102 Ų10276.6 Ų76.650%0.50246%0.458SS..Hα-helixtrans-66-38.9178.9-67-162.280.500112L196 P200 G205 A206 V207L196-M203 HydrophobicContact CD1-CB 4.23Å; L196-M203 HydrophobicContact CD1-CE 4.49Å; L196-M203 HydrophobicContact CD2-CB 3.96Å; L196-M203 HydrophobicContact CD2-CE 4.19Å; L196-M203 HydrophobicContact CD2-SD 3.92Å; P200-M203 PolarHBondContact O-N 2.97Å; M203-G205 VanDerWaalsContact C-N 3.29Å; M203-G205 PolarHBondContact O-N 2.69Å; M203-A206 PolarHBondContact O-N 2.82Å; M203-V207 WeakPolarHBondContact O-CG2 3.47Å; M203-V207 PolarHBondContact O-N 3.09Å
204R86.4Confident88.1Confident88 Ų8874.5 Ų74.533%0.33244%0.442SS..Hα-helixtrans-62.8-37.3173-70.5-177.7-73.5177.41.3112K191 L196 G199 P200 M201 L202 N208K191-R204 HydrophobicContact CD-CG 4.44Å; L196-R204 HydrophobicContact CB-CG 4.43Å; L196-R204 VanDerWaalsContact O-CD 3.22Å; L196-R204 WeakPolarHBondContact O-CD 3.3Å; L196-R204 WeakPolarHBondContact O-CG 3.18Å; G199-R204 VanDerWaalsContact O-CZ 3.3Å; G199-R204 PolarHBondContact O-NE 3.28Å; G199-R204 PolarHBondContact O-NH2 2.94Å; P200-R204 PolarHBondContact O-N 2.85Å; M201-R204 PolarHBondContact O-N 3.11Å; L202-R204 PolarHBondContact O-N 3.14Å; R204-N208 PolarHBondContact O-N 2.92Å; R204-N208 PolarHBondContact O-ND2 3.13Å
205G87Confident88.4Confident30 Ų3068.5 Ų68.531%0.30942%0.417SS..Hα-helixtrans-61.7-50.4172.200000111.9M201 L202 M203 V207 N208 I209M201-G205 PolarHBondContact O-N 3.47Å; L202-G205 WeakPolarHBondContact O-CA 3.26Å; L202-G205 PolarHBondContact O-N 3.44Å; L202-G205 VanDerWaalsContact O-N 3.15Å; M203-G205 VanDerWaalsContact C-N 3.29Å; M203-G205 PolarHBondContact O-N 2.69Å; G205-V207 PolarHBondContact O-N 3.2Å; G205-N208 PolarHBondContact O-N 3.05Å; G205-N208 VanDerWaalsContact O-N 3.12Å; G205-I209 WeakPolarHBondContact O-CG1 3.43Å; G205-I209 PolarHBondContact O-N 3.21Å
206A91.4Very high88.6Confident53 Ų5367.9 Ų67.944%0.43841%0.406SS..Hα-helixtrans-57.8-45.1178.300000112.2L202 M203 N208 I209 V210L202-A206 PolarHBondContact O-N 2.92Å; M203-A206 PolarHBondContact O-N 2.82Å; A206-N208 VanDerWaalsContact C-N 3.32Å; A206-N208 PolarHBondContact O-N 2.76Å; A206-I209 WeakPolarHBondContact O-CB 3.36Å; A206-I209 PolarHBondContact O-N 3.35Å; A206-I209 VanDerWaalsContact O-N 3.14Å; A206-V210 WeakPolarHBondContact O-CG2 3.39Å; A206-V210 PolarHBondContact O-N 3.23Å
207V91.3Very high89Confident16 Ų1671.1 Ų71.110%0.09743%0.426CS..Hα-helixtrans-62.3-37.9176.1171.40000112.5L190 K191 L196 M203 G205 I209 V210 A211L190-V207 HydrophobicContact CB-CG1 3.41Å; L190-V207 VanDerWaalsContact CB-CG1 3.41Å; L190-V207 HydrophobicContact CD1-CG1 4.22Å; L190-V207 HydrophobicContact CG-CG1 4.47Å; K191-V207 HydrophobicContact CG-CB 4.32Å; K191-V207 HydrophobicContact CG-CG1 3.85Å; L196-V207 HydrophobicContact CD1-CG2 3.54Å; M203-V207 WeakPolarHBondContact O-CG2 3.47Å; M203-V207 PolarHBondContact O-N 3.09Å; G205-V207 PolarHBondContact O-N 3.2Å; V207-I209 VanDerWaalsContact C-N 3.32Å; V207-I209 PolarHBondContact O-N 3Å; V207-V210 PolarHBondContact O-N 2.82Å; V207-A211 WeakPolarHBondContact O-CB 3.48Å; V207-A211 PolarHBondContact O-N 3.42Å
208N91.9Very high89.8Confident66 Ų6667 Ų6735%0.35341%0.409SS..Hα-helixtrans-66.4-35.5175.7-65.5-26.2000111.9S187 K191 R204 G205 A206 A211 L212S187-N208 PolarHBondContact OG-OD1 3.04Å; K191-N208 PolarHBondContact NZ-OD1 3.32Å; R204-N208 PolarHBondContact O-N 2.92Å; R204-N208 PolarHBondContact O-ND2 3.13Å; G205-N208 PolarHBondContact O-N 3.05Å; G205-N208 VanDerWaalsContact O-N 3.12Å; A206-N208 VanDerWaalsContact C-N 3.32Å; A206-N208 PolarHBondContact O-N 2.76Å; N208-A211 PolarHBondContact O-N 2.85Å; N208-L212 WeakPolarHBondContact O-CB 3.48Å; N208-L212 PolarHBondContact O-N 3.38Å
209I94.3Very high90.7Very high123 Ų12367.1 Ų67.163%0.63139%0.385SS*.Hα-helixtrans-64.8-44.1174.2-65.5169.9000110.2G205 A206 V207 L212 G213G205-I209 WeakPolarHBondContact O-CG1 3.43Å; G205-I209 PolarHBondContact O-N 3.21Å; A206-I209 WeakPolarHBondContact O-CB 3.36Å; A206-I209 PolarHBondContact O-N 3.35Å; A206-I209 VanDerWaalsContact O-N 3.14Å; V207-I209 VanDerWaalsContact C-N 3.32Å; V207-I209 PolarHBondContact O-N 3Å; I209-L212 WeakPolarHBondContact O-CB 3.4Å; I209-L212 PolarHBondContact O-N 3.29Å; I209-G213 PolarHBondContact O-N 3.45Å
210V95.4Very high91.5Very high81 Ų8169.8 Ų69.849%0.49139%0.392SS..Hα-helixtrans-61-47175172.80000111L190 A206 V207 L212 G213 I214L190-V210 HydrophobicContact CD1-CG1 4.19Å; A206-V210 WeakPolarHBondContact O-CG2 3.39Å; A206-V210 PolarHBondContact O-N 3.23Å; V207-V210 PolarHBondContact O-N 2.82Å; V210-L212 VanDerWaalsContact C-N 3.28Å; V210-L212 PolarHBondContact O-N 3.38Å; V210-G213 PolarHBondContact O-N 3.24Å; V210-G213 VanDerWaalsContact O-N 3.11Å; V210-I214 HydrophobicContact CG1-CD1 3.94Å; V210-I214 HydrophobicContact CG1-CG1 4.45Å; V210-I214 WeakPolarHBondContact O-CG1 3.19Å; V210-I214 PolarHBondContact O-N 2.76Å
211A94.9Very high91.8Very high0 Ų071.4 Ų71.40%040%0.396CS..Hα-helixtrans-59-39.4176.600000112.4L190 V207 N208 I214 G215L190-A211 HydrophobicContact CD1-CB 4.19Å; V207-A211 WeakPolarHBondContact O-CB 3.48Å; V207-A211 PolarHBondContact O-N 3.42Å; N208-A211 PolarHBondContact O-N 2.85Å; A211-I214 PolarHBondContact O-N 3.44Å; A211-G215 PolarHBondContact O-N 2.89Å
212L94.9Very high92.4Very high107 Ų10766.8 Ų66.856%0.5638%0.375SS*.Hα-helixtrans-64.3-43.6174.3-177.565.6000111.4V183 N208 I209 V210 G215 A216V183-L212 HydrophobicContact CG1-CD1 4.49Å; N208-L212 WeakPolarHBondContact O-CB 3.48Å; N208-L212 PolarHBondContact O-N 3.38Å; I209-L212 WeakPolarHBondContact O-CB 3.4Å; I209-L212 PolarHBondContact O-N 3.29Å; V210-L212 VanDerWaalsContact C-N 3.28Å; V210-L212 PolarHBondContact O-N 3.38Å; L212-G215 PolarHBondContact O-N 3.28Å; L212-A216 PolarHBondContact O-N 2.9Å
213G95.8Very high92.7Very high38 Ų3859.9 Ų59.939%0.39234%0.34SS..Hα-helixtrans-59.4-46.5175.100000112.5I209 V210 G215 A216 V217I209-G213 PolarHBondContact O-N 3.45Å; V210-G213 PolarHBondContact O-N 3.24Å; V210-G213 VanDerWaalsContact O-N 3.11Å; G213-G215 VanDerWaalsContact C-N 3.31Å; G213-G215 PolarHBondContact O-N 3.09Å; G213-A216 PolarHBondContact O-N 3.13Å; G213-V217 WeakPolarHBondContact O-CG2 3.21Å; G213-V217 PolarHBondContact O-N 3.19Å
214I95.4Very high92.8Very high65 Ų6556 Ų5633%0.33332%0.321SS..Hα-helixtrans-62.1-40.8175.6-62.6167.8000110.7Y186 L190 V210 A211 V217 S218Y186-I214 HydrophobicContact CD2-CB 4.11Å; Y186-I214 HydrophobicContact CD2-CG2 3.7Å; Y186-I214 HydrophobicContact CE1-CG2 4.39Å; Y186-I214 HydrophobicContact CE2-CB 4.32Å; Y186-I214 HydrophobicContact CE2-CG2 3.52Å; Y186-I214 HydrophobicContact CG-CG2 4.23Å; L190-I214 HydrophobicContact CD1-CD1 4.09Å; V210-I214 HydrophobicContact CG1-CD1 3.94Å; V210-I214 HydrophobicContact CG1-CG1 4.45Å; V210-I214 WeakPolarHBondContact O-CG1 3.19Å; V210-I214 PolarHBondContact O-N 2.76Å; A211-I214 PolarHBondContact O-N 3.44Å; I214-V217 PolarHBondContact O-N 3.23Å; I214-S218 WeakPolarHBondContact O-CB 3.25Å; I214-S218 PolarHBondContact O-N 3.25Å; I214-S218 PolarHBondContact O-OG 3.45Å
215G94.6Very high93.1Very high3 Ų354.5 Ų54.53%0.03133%0.328CS..Hα-helixtrans-63.2-40.4175.500000113.6A211 L212 G213 S218 Y219A211-G215 PolarHBondContact O-N 2.89Å; L212-G215 PolarHBondContact O-N 3.28Å; G213-G215 VanDerWaalsContact C-N 3.31Å; G213-G215 PolarHBondContact O-N 3.09Å; G215-S218 WeakPolarHBondContact O-CB 3.4Å; G215-S218 PolarHBondContact O-N 2.67Å; G215-Y219 WeakPolarHBondContact O-CB 3.32Å; G215-Y219 PolarHBondContact O-N 2.84Å
216A93.1Very high93.5Very high45 Ų4554.6 Ų54.637%0.37232%0.321SS..Hα-helixtrans-62.8-46.3175.100000111.4L212 G213 S218 Y219 F220L212-A216 PolarHBondContact O-N 2.9Å; G213-A216 PolarHBondContact O-N 3.13Å; A216-S218 VanDerWaalsContact C-N 3.34Å; A216-S218 PolarHBondContact O-N 3.48Å; A216-Y219 WeakPolarHBondContact O-CB 3.3Å; A216-Y219 PolarHBondContact O-N 3.44Å; A216-F220 WeakPolarHBondContact O-CD2 3.31Å; A216-F220 PolarHBondContact O-N 3.26Å
217V93.9Very high93.5Very high84 Ų8453.3 Ų53.351%0.50931%0.309SS..Hα-helixtrans-60.5-44.7174.1174.30000111G213 I214 Y219 F220 L221G213-V217 WeakPolarHBondContact O-CG2 3.21Å; G213-V217 PolarHBondContact O-N 3.19Å; I214-V217 PolarHBondContact O-N 3.23Å; V217-Y219 VanDerWaalsContact C-N 3.27Å; V217-Y219 PolarHBondContact O-N 3.5Å; V217-F220 PolarHBondContact O-N 3.07Å; V217-L221 HydrophobicContact CG1-CD1 3.84Å; V217-L221 HydrophobicContact CG1-CG 4.29Å; V217-L221 WeakPolarHBondContact O-CG 3.35Å; V217-L221 PolarHBondContact O-N 3.11Å
218S94.9Very high93.6Very high21 Ų2155.3 Ų55.315%0.14732%0.318CS..Hα-helixtrans-58.3-40.6176.5-57.80000111.5Y186 I214 G215 A216 T222Y186-S218 PolarHBondContact OH-OG 3.11Å; Y186-S218 VanDerWaalsContact OH-OG 3.09Å; I214-S218 WeakPolarHBondContact O-CB 3.25Å; I214-S218 PolarHBondContact O-N 3.25Å; I214-S218 PolarHBondContact O-OG 3.45Å; G215-S218 WeakPolarHBondContact O-CB 3.4Å; G215-S218 PolarHBondContact O-N 2.67Å; A216-S218 VanDerWaalsContact C-N 3.34Å; A216-S218 PolarHBondContact O-N 3.48Å; S218-T222 WeakPolarHBondContact O-CB 3.4Å; S218-T222 PolarHBondContact O-N 3.22Å; S218-T222 PolarHBondContact O-OG1 3.47Å
219Y94.2Very high93.8Very high84 Ų8459 Ų5933%0.32933%0.327SS..Hα-helixtrans-62.5-50176.3170-101.5000112V175 A176 C179 G215 A216 V217 L221 T222 S223V175-Y219 HydrophobicContact CG1-CD2 3.9Å; V175-Y219 HydrophobicContact CG1-CE2 4.13Å; A176-Y219 HydrophobicContact CB-CD2 4.21Å; A176-Y219 HydrophobicContact CB-CE2 3.83Å; C179-Y219 VanDerWaalsContact SG-CA 3.5Å; G215-Y219 WeakPolarHBondContact O-CB 3.32Å; G215-Y219 PolarHBondContact O-N 2.84Å; A216-Y219 WeakPolarHBondContact O-CB 3.3Å; A216-Y219 PolarHBondContact O-N 3.44Å; V217-Y219 VanDerWaalsContact C-N 3.27Å; V217-Y219 PolarHBondContact O-N 3.5Å; Y219-L221 PolarHBondContact O-N 3Å; Y219-T222 PolarHBondContact O-N 2.84Å; Y219-S223 WeakPolarHBondContact O-CB 3.41Å; Y219-S223 PolarHBondContact O-N 3.38Å
220F91.4Very high93.9Very high72 Ų7253.5 Ų53.532%0.31630%0.298SS..Hα-helixtrans-60.4-49179.2-69.4-62.3000111.6A216 V217 T222 S223 D224 Q288A216-F220 WeakPolarHBondContact O-CD2 3.31Å; A216-F220 PolarHBondContact O-N 3.26Å; V217-F220 PolarHBondContact O-N 3.07Å; F220-T222 PolarHBondContact O-N 2.95Å; F220-S223 PolarHBondContact O-N 2.99Å; F220-D224 WeakPolarHBondContact O-CB 3.34Å; F220-D224 PolarHBondContact O-N 3.26Å; F220-Q288 HydrophobicContact CD1-CB 4.47Å; F220-Q288 HydrophobicContact CD1-CG 4.31Å
221L91.9Very high93.8Very high118 Ų11850.4 Ų50.462%0.61828%0.279SS*.Hα-helixtrans-63.6-44-180-65.7177.1000112.4V217 Y219 A225V217-L221 HydrophobicContact CG1-CD1 3.84Å; V217-L221 HydrophobicContact CG1-CG 4.29Å; V217-L221 WeakPolarHBondContact O-CG 3.35Å; V217-L221 PolarHBondContact O-N 3.11Å; Y219-L221 PolarHBondContact O-N 3Å; L221-A225 WeakPolarHBondContact O-CB 3.4Å; L221-A225 PolarHBondContact O-N 2.89Å
222T94.3Very high93.9Very high50 Ų5054.3 Ų54.331%0.30729%0.294SS..Hα-helixtrans-69.4-41-179.4-530000111.1V175 S218 Y219 F220 L226V175-T222 HydrophobicContact CG1-CG2 3.9Å; V175-T222 HydrophobicContact CG2-CG2 4.44Å; S218-T222 WeakPolarHBondContact O-CB 3.4Å; S218-T222 PolarHBondContact O-N 3.22Å; S218-T222 PolarHBondContact O-OG1 3.47Å; Y219-T222 PolarHBondContact O-N 2.84Å; F220-T222 PolarHBondContact O-N 2.95Å; T222-L226 WeakPolarHBondContact O-CB 3.47Å; T222-L226 PolarHBondContact O-N 2.67Å
223S92.2Very high94Very high11 Ų1150.4 Ų50.48%0.07728%0.276CS..Hα-helixtrans-63.5-45.4178.2-171.30000111.3Y219 F220 S227Y219-S223 WeakPolarHBondContact O-CB 3.41Å; Y219-S223 PolarHBondContact O-N 3.38Å; F220-S223 PolarHBondContact O-N 2.99Å; S223-S227 VanDerWaalsContact O-CB 3.26Å; S223-S227 WeakPolarHBondContact O-CB 3.41Å; S223-S227 PolarHBondContact O-N 3.32Å; S223-S227 PolarHBondContact O-OG 3.15Å
224D90.5Very high94.1Very high20 Ų2048.8 Ų48.811%0.10726%0.258CS..Hα-helixtrans-68.5-46.4179-756.2000111.3F220 L226 S227 Q228 Q288 L289F220-D224 WeakPolarHBondContact O-CB 3.34Å; F220-D224 PolarHBondContact O-N 3.26Å; D224-L226 VanDerWaalsContact C-N 3.35Å; D224-L226 PolarHBondContact O-N 3.34Å; D224-S227 PolarHBondContact O-N 3.32Å; D224-Q228 WeakPolarHBondContact O-CB 3.47Å; D224-Q228 VanDerWaalsContact O-CG 3.3Å; D224-Q228 WeakPolarHBondContact O-CG 3.48Å; D224-Q228 PolarHBondContact O-N 3.07Å; D224-Q288 WeakPolarHBondContact OD1-CG 3.44Å; D224-Q288 WeakPolarHBondContact OD2-CA 3.42Å; D224-L289 PolarHBondContact OD2-N 3.44Å
225A92.9Very high94.2Very high57 Ų5745.9 Ų45.947%0.47124%0.244SC..Hα-helixtrans-60.9-43.7177.800000112L221 Q228 W229L221-A225 WeakPolarHBondContact O-CB 3.4Å; L221-A225 PolarHBondContact O-N 2.89Å; A225-Q228 PolarHBondContact O-N 3.29Å; A225-W229 WeakPolarHBondContact O-CB 3.4Å; A225-W229 PolarHBondContact O-N 2.88Å
226L94.9Very high94.3Very high33 Ų3351.7 Ų51.717%0.17327%0.268CS..Hα-helixtrans-66.9-42.9177.4-178.766.9000111.5L171 V175 T222 D224 Q228 W229 I230L171-L226 HydrophobicContact CB-CD1 4.27Å; L171-L226 HydrophobicContact CB-CD2 3.98Å; L171-L226 WeakPolarHBondContact O-CD2 3.47Å; V175-L226 HydrophobicContact CG2-CD2 3.32Å; T222-L226 WeakPolarHBondContact O-CB 3.47Å; T222-L226 PolarHBondContact O-N 2.67Å; D224-L226 VanDerWaalsContact C-N 3.35Å; D224-L226 PolarHBondContact O-N 3.34Å; L226-Q228 VanDerWaalsContact C-N 3.31Å; L226-Q228 PolarHBondContact O-N 3.46Å; L226-W229 HydrophobicContact CD1-CE3 3.89Å; L226-W229 HydrophobicContact CD1-CZ3 4.37Å; L226-W229 PolarHBondContact O-N 3.26Å; L226-I230 HydrophobicContact CD1-CD1 4.2Å; L226-I230 HydrophobicContact CD1-CG1 4.28Å; L226-I230 HydrophobicContact CD2-CD1 4.4Å; L226-I230 HydrophobicContact CG-CD1 3.89Å; L226-I230 HydrophobicContact CG-CG1 4.36Å; L226-I230 WeakPolarHBondContact O-CB 3.03Å; L226-I230 VanDerWaalsContact O-CG1 3.29Å; L226-I230 WeakPolarHBondContact O-CG1 3.44Å; L226-I230 PolarHBondContact O-N 3.49Å
227S92Very high94.5Very high26 Ų2655.2 Ų55.218%0.18227%0.272CS..Hα-helixtrans-60.7-43178.1-61.40000111.2S223 D224 I230 D231S223-S227 VanDerWaalsContact O-CB 3.26Å; S223-S227 WeakPolarHBondContact O-CB 3.41Å; S223-S227 PolarHBondContact O-N 3.32Å; S223-S227 PolarHBondContact O-OG 3.15Å; D224-S227 PolarHBondContact O-N 3.32Å; S227-I230 PolarHBondContact O-N 3.46Å; S227-D231 WeakPolarHBondContact O-CB 3.36Å; S227-D231 PolarHBondContact O-N 3.28Å
228Q93Very high94.7Very high58 Ų5851.2 Ų51.227%0.27125%0.248SC..Hα-helixtrans-63.6-45.8174.5-71.1176.89.100112.3D224 A225 L226 I230 D231 Y232 T292D224-Q228 WeakPolarHBondContact O-CB 3.47Å; D224-Q228 VanDerWaalsContact O-CG 3.3Å; D224-Q228 WeakPolarHBondContact O-CG 3.48Å; D224-Q228 PolarHBondContact O-N 3.07Å; A225-Q228 PolarHBondContact O-N 3.29Å; L226-Q228 VanDerWaalsContact C-N 3.31Å; L226-Q228 PolarHBondContact O-N 3.46Å; Q228-I230 VanDerWaalsContact C-N 3.34Å; Q228-I230 PolarHBondContact O-N 3.25Å; Q228-D231 WeakPolarHBondContact O-CB 3.36Å; Q228-D231 PolarHBondContact O-N 3.2Å; Q228-Y232 HydrophobicContact CB-CD2 4.33Å; Q228-Y232 HydrophobicContact CB-CE2 4.22Å; Q228-Y232 WeakPolarHBondContact O-CD2 3.07Å; Q228-Y232 PolarHBondContact O-N 3.39Å; Q228-T292 WeakPolarHBondContact CA-OG1 3.25Å
229W95.2Very high94.8Very high143 Ų14350.3 Ų50.354%0.54224%0.241SC..Hα-helixtrans-60.8-42.7177.2177.182.1000112.1L171 A225 L226 S233L171-W229 HydrophobicContact CD1-CH2 4.34Å; L171-W229 HydrophobicContact CD1-CZ3 3.72Å; A225-W229 WeakPolarHBondContact O-CB 3.4Å; A225-W229 PolarHBondContact O-N 2.88Å; L226-W229 HydrophobicContact CD1-CE3 3.89Å; L226-W229 HydrophobicContact CD1-CZ3 4.37Å; L226-W229 PolarHBondContact O-N 3.26Å; W229-S233 WeakPolarHBondContact O-CB 3.11Å; W229-S233 PolarHBondContact O-N 3.49Å; W229-S233 PolarHBondContact O-OG 3.14Å
230I95.8Very high94.9Very high7 Ų748.7 Ų48.74%0.03625%0.25CC..Hα-helixtrans-61.8-46.2175.2-70.6171.7000110.3R163 L171 L226 S227 Q228 S233 S234R163-I230 HydrophobicContact CG-CG2 3.59Å; L171-I230 HydrophobicContact CB-CD1 4.43Å; L226-I230 HydrophobicContact CD1-CD1 4.2Å; L226-I230 HydrophobicContact CD1-CG1 4.28Å; L226-I230 HydrophobicContact CD2-CD1 4.4Å; L226-I230 HydrophobicContact CG-CD1 3.89Å; L226-I230 HydrophobicContact CG-CG1 4.36Å; L226-I230 WeakPolarHBondContact O-CB 3.03Å; L226-I230 VanDerWaalsContact O-CG1 3.29Å; L226-I230 WeakPolarHBondContact O-CG1 3.44Å; L226-I230 PolarHBondContact O-N 3.49Å; S227-I230 PolarHBondContact O-N 3.46Å; Q228-I230 VanDerWaalsContact C-N 3.34Å; Q228-I230 PolarHBondContact O-N 3.25Å; I230-S233 WeakPolarHBondContact CA-OG 3.32Å; I230-S233 PolarHBondContact O-OG 3.42Å; I230-S233 VanDerWaalsContact O-OG 3.13Å; I230-S234 WeakPolarHBondContact O-CB 3.3Å; I230-S234 PolarHBondContact O-N 2.94Å; I230-S234 PolarHBondContact O-OG 2.89Å
231D94.8Very high95Very high16 Ų1647.7 Ų47.79%0.08625%0.247CC..Hα-helixtrans-59.1-54.1179-88-26.4000112.2S227 Q228 S234 D235 T292 R297S227-D231 WeakPolarHBondContact O-CB 3.36Å; S227-D231 PolarHBondContact O-N 3.28Å; Q228-D231 WeakPolarHBondContact O-CB 3.36Å; Q228-D231 PolarHBondContact O-N 3.2Å; D231-S234 PolarHBondContact O-N 3.48Å; D231-D235 VanDerWaalsContact O-CG 3.29Å; D231-D235 PolarHBondContact O-N 3.15Å; D231-T292 WeakPolarHBondContact CB-OG1 3.48Å; D231-T292 WeakPolarHBondContact OD2-CB 3.19Å; D231-T292 PolarHBondContact OD2-N 2.97Å; D231-T292 PolarHBondContact OD2-OG1 3.04Å; D231-R297 VanDerWaalsContact CG-CZ 3.46Å; D231-R297 PolarHBondContact O-NH2 3.45Å; D231-R297 IonicContact OD1-CZ 2.66Å; D231-R297 VanDerWaalsContact OD1-CZ 3.31Å; D231-R297 IonicContact OD1-NH1 3.93Å; D231-R297 PolarHBondContact OD1-NH1 3.2Å; D231-R297 IonicContact OD1-NH2 2.89Å; D231-R297 PolarHBondContact OD1-NH2 2.89Å; D231-R297 IonicContact OD2-CZ 3.87Å; D231-R297 IonicContact OD2-NH1 2.82Å; D231-R297 PolarHBondContact OD2-NH1 3.49Å
232Y96.1Very high95.2Very high83 Ų8343.7 Ų43.733%0.32523%0.229SC..Hα-helixtrans-66.3-42-179.3-72-60.3000112.4Q228 S234 D235 K236 T292 S296 R297Q228-Y232 HydrophobicContact CB-CD2 4.33Å; Q228-Y232 HydrophobicContact CB-CE2 4.22Å; Q228-Y232 WeakPolarHBondContact O-CD2 3.07Å; Q228-Y232 PolarHBondContact O-N 3.39Å; Y232-S234 VanDerWaalsContact C-N 3.35Å; Y232-D235 PolarHBondContact O-N 3.33Å; Y232-K236 WeakPolarHBondContact O-CB 3.48Å; Y232-K236 PolarHBondContact O-N 3.45Å; Y232-T292 HydrophobicContact CD1-CG2 4.48Å; Y232-T292 HydrophobicContact CD2-CG2 4.35Å; Y232-T292 HydrophobicContact CE1-CG2 3.74Å; Y232-T292 HydrophobicContact CE2-CG2 3.56Å; Y232-T292 WeakPolarHBondContact OH-CG2 3.39Å; Y232-S296 PolarHBondContact OH-OG 3.14Å; Y232-R297 HydrophobicContact CE1-CG 4.34Å
233S96.9Very high95.3Very high25 Ų2547.8 Ų47.818%0.17524%0.239CC..Hα-helixtrans-66.5-38.6179.4620000111.7W229 I230 R237W229-S233 WeakPolarHBondContact O-CB 3.11Å; W229-S233 PolarHBondContact O-N 3.49Å; W229-S233 PolarHBondContact O-OG 3.14Å; I230-S233 WeakPolarHBondContact CA-OG 3.32Å; I230-S233 PolarHBondContact O-OG 3.42Å; I230-S233 VanDerWaalsContact O-OG 3.13Å; S233-R237 WeakPolarHBondContact O-CB 3.34Å; S233-R237 VanDerWaalsContact O-CG 3.23Å; S233-R237 WeakPolarHBondContact O-CG 3.43Å; S233-R237 PolarHBondContact O-N 3.42Å
234S97.3Very high95.5Very high3 Ų351.2 Ų51.22%0.02125%0.253CS..Hα-helixtrans-66.1-44177-57.90000111.5R163 I230 D231 Y232 R237 A238R163-S234 WeakPolarHBondContact CA-OG 3.23Å; R163-S234 WeakPolarHBondContact CB-OG 3.47Å; I230-S234 WeakPolarHBondContact O-CB 3.3Å; I230-S234 PolarHBondContact O-N 2.94Å; I230-S234 PolarHBondContact O-OG 2.89Å; D231-S234 PolarHBondContact O-N 3.48Å; Y232-S234 VanDerWaalsContact C-N 3.35Å; S234-R237 PolarHBondContact O-N 2.9Å; S234-A238 WeakPolarHBondContact O-CB 3.38Å; S234-A238 PolarHBondContact O-N 2.91Å
235D97.9Very high95.8Very high4 Ų450.6 Ų50.62%0.02125%0.25CC..Hα-helixtrans-66.4-43.9176.3-70.4-14.8000112.2F155 R159 D231 Y232 R237 A238 A239 Y253 R297 I301F155-D235 HydrophobicContact CZ-CB 4.23Å; R159-D235 IonicContact CZ-OD1 3.28Å; R159-D235 IonicContact NE-OD1 3.31Å; R159-D235 PolarHBondContact NE-OD1 3.28Å; D231-D235 VanDerWaalsContact O-CG 3.29Å; D231-D235 PolarHBondContact O-N 3.15Å; Y232-D235 PolarHBondContact O-N 3.33Å; D235-R237 VanDerWaalsContact C-N 3.32Å; D235-R237 PolarHBondContact O-N 3.36Å; D235-A238 PolarHBondContact O-N 3.41Å; D235-A239 VanDerWaalsContact O-CB 3.25Å; D235-A239 WeakPolarHBondContact O-CB 3.02Å; D235-A239 PolarHBondContact O-N 3.25Å; D235-Y253 PolarHBondContact OD1-OH 2.84Å; D235-Y253 PolarHBondContact OD2-OH 2.91Å; D235-R297 IonicContact OD1-CZ 3.95Å; D235-R297 IonicContact OD1-NE 3.24Å; D235-R297 IonicContact OD1-NH2 2.74Å; D235-R297 PolarHBondContact OD1-NH2 3Å; D235-R297 IonicContact OD2-CZ 2.91Å; D235-R297 IonicContact OD2-NE 2.91Å; D235-R297 PolarHBondContact OD2-NE 3.39Å; D235-R297 IonicContact OD2-NH2 2.92Å; D235-R297 PolarHBondContact OD2-NH2 3.17Å; D235-I301 HydrophobicContact CB-CD1 4.37Å
236K97.3Very high96Very high125 Ų12548 Ų4854%0.54323%0.228SC..Hα-helixtrans-61-42.6177.6178.2167.1-177.2169.90110.9Y232 G240 L304Y232-K236 WeakPolarHBondContact O-CB 3.48Å; Y232-K236 PolarHBondContact O-N 3.45Å; K236-G240 PolarHBondContact O-N 2.98Å; K236-L304 HydrophobicContact CB-CD1 4.07Å; K236-L304 HydrophobicContact CD-CD1 4.46Å; K236-L304 HydrophobicContact CD-CD2 4.16Å; K236-L304 HydrophobicContact CG-CD1 3.8Å; K236-L304 HydrophobicContact CG-CD2 4.21Å
237R97.3Very high96.2Very high120 Ų12052.1 Ų52.145%0.45324%0.241SC..Hα-helixtrans-66.4-40.8176.8-74.2-177.275.7163.26112.4F72 A162 S233 S234 D235 M241F72-R237 HydrophobicContact CE2-CB 4.49Å; F72-R237 HydrophobicContact CZ-CB 4.27Å; A162-R237 HydrophobicContact CB-CB 4.05Å; S233-R237 WeakPolarHBondContact O-CB 3.34Å; S233-R237 VanDerWaalsContact O-CG 3.23Å; S233-R237 WeakPolarHBondContact O-CG 3.43Å; S233-R237 PolarHBondContact O-N 3.42Å; S234-R237 PolarHBondContact O-N 2.9Å; D235-R237 VanDerWaalsContact C-N 3.32Å; D235-R237 PolarHBondContact O-N 3.36Å; R237-M241 WeakPolarHBondContact O-CG 3.23Å
238A97.8Very high96.5Very high0 Ų050.9 Ų50.90%023%0.233CC..Hα-helixtrans-69-48.1177.400000111.9F155 A158 R159 S234 D235 G240 M241 Y245F155-A238 HydrophobicContact CD2-CB 3.89Å; F155-A238 HydrophobicContact CE2-CB 3.77Å; A158-A238 HydrophobicContact CB-CB 3.87Å; R159-A238 HydrophobicContact CB-CB 4.03Å; S234-A238 WeakPolarHBondContact O-CB 3.38Å; S234-A238 PolarHBondContact O-N 2.91Å; D235-A238 PolarHBondContact O-N 3.41Å; A238-G240 VanDerWaalsContact C-N 3.34Å; A238-G240 PolarHBondContact O-N 2.98Å; A238-M241 WeakPolarHBondContact O-CB 3.48Å; A238-M241 VanDerWaalsContact O-CG 3.31Å; A238-M241 WeakPolarHBondContact O-CG 3.37Å; A238-M241 PolarHBondContact O-N 3.33Å; A238-Y245 WeakPolarHBondContact O-CB 3.19Å
239A97.6Very high96.7Very high2 Ų248.1 Ų48.12%0.01722%0.22CC..Hα-helixtrans-64.9-37.5178.600000112.3F155 D235 M241 S242 A246 I301 L304F155-A239 HydrophobicContact CE2-CB 4.04Å; D235-A239 VanDerWaalsContact O-CB 3.25Å; D235-A239 WeakPolarHBondContact O-CB 3.02Å; D235-A239 PolarHBondContact O-N 3.25Å; A239-M241 PolarHBondContact O-N 3.49Å; A239-S242 VanDerWaalsContact O-O 3.1Å; A239-A246 HydrophobicContact CB-CB 4.2Å; A239-I301 HydrophobicContact CB-CG1 4.19Å; A239-I301 HydrophobicContact CB-CG2 3.94Å; A239-L304 HydrophobicContact CB-CD1 4.48Å
240G95.8Very high96.9Very high49 Ų4942.1 Ų42.151%0.50520%0.199SC..THydrogen-bonded Turntrans-73.73.318000000115.1K236 A238K236-G240 PolarHBondContact O-N 2.98Å; A238-G240 VanDerWaalsContact C-N 3.34Å; A238-G240 PolarHBondContact O-N 2.98Å
241M94.3Very high97Very high51 Ų5144.6 Ų44.625%0.25121%0.21SC..THydrogen-bonded Turntrans-71.5-44.5174.8-65.5175.46600111.8D71 F72 A158 R237 A238 A239 Y245D71-M241 HydrophobicContact CB-CE 3.46Å; D71-M241 VanDerWaalsContact CB-CE 3.46Å; D71-M241 WeakPolarHBondContact O-CE 3.49Å; F72-M241 HydrophobicContact CB-CE 3.92Å; F72-M241 HydrophobicContact CD2-CE 3.95Å; F72-M241 HydrophobicContact CD2-CG 4.25Å; F72-M241 HydrophobicContact CD2-SD 3.41Å; F72-M241 WeakPolarHBondContact CD2-SD 3.18Å; F72-M241 HydrophobicContact CE2-SD 4.02Å; F72-M241 HydrophobicContact CG-CE 4.39Å; F72-M241 HydrophobicContact CG-SD 4.39Å; F72-M241 VanDerWaalsContact N-CE 3.27Å; A158-M241 HydrophobicContact CB-SD 3.87Å; R237-M241 WeakPolarHBondContact O-CG 3.23Å; A238-M241 WeakPolarHBondContact O-CB 3.48Å; A238-M241 VanDerWaalsContact O-CG 3.31Å; A238-M241 WeakPolarHBondContact O-CG 3.37Å; A238-M241 PolarHBondContact O-N 3.33Å; A239-M241 PolarHBondContact O-N 3.49Å; M241-Y245 HydrophobicContact CB-CD2 3.99Å; M241-Y245 HydrophobicContact CB-CE2 4.45Å; M241-Y245 HydrophobicContact CB-CG 4.03Å; M241-Y245 HydrophobicContact CE-CE1 4.06Å; M241-Y245 HydrophobicContact CE-CE2 4.03Å; M241-Y245 HydrophobicContact SD-CD1 3.82Å; M241-Y245 HydrophobicContact SD-CE1 3.69Å; M241-Y245 HydrophobicContact SD-CE2 4.41Å; M241-Y245 HydrophobicContact SD-CG 4.25Å
242S95.2Very high97.1Very high35 Ų3543.9 Ų43.925%0.24521%0.207CC..  trans-164.9166.917789.80000110.9A239 E244 Y245 A246A239-S242 VanDerWaalsContact O-O 3.1Å; S242-E244 VanDerWaalsContact CB-OE2 3.31Å; S242-E244 WeakPolarHBondContact CB-OE2 3.34Å; S242-E244 PolarHBondContact O-N 2.87Å; S242-E244 PolarHBondContact OG-N 3.29Å; S242-E244 PolarHBondContact OG-OE2 3.44Å; S242-Y245 PolarHBondContact O-N 3.24Å; S242-Y245 VanDerWaalsContact O-N 3.09Å; S242-Y245 WeakPolarHBondContact OG-CD2 3.25Å; S242-Y245 PolarHBondContact OG-N 2.75Å; S242-A246 PolarHBondContact O-N 3.41Å
243R95.4Very high97.2Very high136 Ų13640 Ų4051%0.51319%0.191SC..Hα-helixtrans-62.7-27.7177.1-171.5170.4175.4-179.8-4.4113.1R247R243-R247 WeakPolarHBondContact O-CB 3.39Å; R243-R247 WeakPolarHBondContact O-CG 3.34Å; R243-R247 PolarHBondContact O-N 2.81Å; R243-R247 VanDerWaalsContact O-N 3.08Å; R243-R247 PolarHBondContact O-NE 2.92Å
244E96.6Very high97.3Very high82 Ų8241.8 Ų41.838%0.38320%0.199SC..Hα-helixtrans-65.5-47.6172.9-64.461.9-128.800110.2E151 S242 A246 R247 G248E151-E244 HydrophobicContact CG-CB 4.02Å; S242-E244 VanDerWaalsContact CB-OE2 3.31Å; S242-E244 WeakPolarHBondContact CB-OE2 3.34Å; S242-E244 PolarHBondContact O-N 2.87Å; S242-E244 PolarHBondContact OG-N 3.29Å; S242-E244 PolarHBondContact OG-OE2 3.44Å; E244-A246 PolarHBondContact O-N 3.49Å; E244-R247 PolarHBondContact O-N 3.21Å; E244-R247 IonicContact OE1-NH2 2.78Å; E244-R247 PolarHBondContact OE1-NH2 3.33Å; E244-G248 PolarHBondContact O-N 3.35Å
245Y97.8Very high97.3Very high7 Ų743.6 Ų43.63%0.02721%0.207CC..Hα-helixtrans-62.9-41.7177.1-81.9-97.6000112.3V68 D71 K154 F155 A158 A238 M241 S242 G248 G249V68-Y245 HydrophobicContact CG2-CE1 4.45Å; V68-Y245 WeakPolarHBondContact CG2-OH 3.49Å; D71-Y245 HydrophobicContact CB-CE2 4.46Å; D71-Y245 PolarHBondContact OD2-OH 3.47Å; K154-Y245 HydrophobicContact CB-CD1 4.37Å; K154-Y245 HydrophobicContact CB-CE1 3.71Å; K154-Y245 HydrophobicContact CD-CE2 4.48Å; F155-Y245 HydrophobicContact CB-CD1 4.43Å; F155-Y245 WeakPolarHBondContact CD2-O 3.32Å; A158-Y245 HydrophobicContact CB-CD1 3.98Å; A158-Y245 HydrophobicContact CB-CE1 3.57Å; A238-Y245 WeakPolarHBondContact O-CB 3.19Å; M241-Y245 HydrophobicContact CB-CD2 3.99Å; M241-Y245 HydrophobicContact CB-CE2 4.45Å; M241-Y245 HydrophobicContact CB-CG 4.03Å; M241-Y245 HydrophobicContact CE-CE1 4.06Å; M241-Y245 HydrophobicContact CE-CE2 4.03Å; M241-Y245 HydrophobicContact SD-CD1 3.82Å; M241-Y245 HydrophobicContact SD-CE1 3.69Å; M241-Y245 HydrophobicContact SD-CE2 4.41Å; M241-Y245 HydrophobicContact SD-CG 4.25Å; S242-Y245 PolarHBondContact O-N 3.24Å; S242-Y245 VanDerWaalsContact O-N 3.09Å; S242-Y245 WeakPolarHBondContact OG-CD2 3.25Å; S242-Y245 PolarHBondContact OG-N 2.75Å; Y245-G248 PolarHBondContact O-N 2.93Å; Y245-G249 PolarHBondContact O-N 2.84Å
246A97.9Very high97.2Very high3 Ų343.6 Ų43.63%0.02521%0.207CC..Hα-helixtrans-62.5-45.6176.500000112.1A239 S242 E244 G248 G249 V250 I301 M305A239-A246 HydrophobicContact CB-CB 4.2Å; S242-A246 PolarHBondContact O-N 3.41Å; E244-A246 PolarHBondContact O-N 3.49Å; A246-G248 PolarHBondContact O-N 2.72Å; A246-G249 PolarHBondContact O-N 2.91Å; A246-V250 PolarHBondContact O-N 3.04Å; A246-V250 VanDerWaalsContact O-N 3.17Å; A246-I301 HydrophobicContact CB-CG2 4.35Å; A246-I301 WeakPolarHBondContact O-CG2 3.31Å; A246-M305 HydrophobicContact CB-CG 3.55Å; A246-M305 HydrophobicContact CB-SD 3.94Å
247R97.8Very high97.1Very high119 Ų11938.2 Ų38.245%0.44918%0.184SC..Hα-helixtrans-59.2-46.7173.6-77.9-176.2-72.3175.8-1.5111.7R243 E244 G249 V250 E251 M305R243-R247 WeakPolarHBondContact O-CB 3.39Å; R243-R247 WeakPolarHBondContact O-CG 3.34Å; R243-R247 PolarHBondContact O-N 2.81Å; R243-R247 VanDerWaalsContact O-N 3.08Å; R243-R247 PolarHBondContact O-NE 2.92Å; E244-R247 PolarHBondContact O-N 3.21Å; E244-R247 IonicContact OE1-NH2 2.78Å; E244-R247 PolarHBondContact OE1-NH2 3.33Å; R247-G249 VanDerWaalsContact C-N 3.25Å; R247-G249 PolarHBondContact O-N 3.25Å; R247-V250 PolarHBondContact O-N 3.47Å; R247-E251 PolarHBondContact O-N 2.89Å; R247-E251 VanDerWaalsContact O-N 3.14Å; R247-M305 HydrophobicContact CG-CE 3.66Å
248G98Very high97.1Very high0 Ų035 Ų350%018%0.18CC..Hα-helixtrans-58.3-37.1175.500000112.8E151 A152 E244 Y245 A246 E251 F252E151-G248 VanDerWaalsContact C-CA 3.5Å; A152-G248 WeakPolarHBondContact CA-O 3.43Å; A152-G248 WeakPolarHBondContact CB-O 3.39Å; E244-G248 PolarHBondContact O-N 3.35Å; Y245-G248 PolarHBondContact O-N 2.93Å; A246-G248 PolarHBondContact O-N 2.72Å; G248-E251 PolarHBondContact O-N 3.41Å; G248-F252 VanDerWaalsContact O-CB 3.23Å; G248-F252 WeakPolarHBondContact O-CB 3.4Å; G248-F252 PolarHBondContact O-N 3.43Å
249G97.9Very high97Very high0 Ų035.7 Ų35.70%018%0.182CC..Hα-helixtrans-67.6-37.9177.200000114.5Y245 A246 R247 Y253Y245-G249 PolarHBondContact O-N 2.84Å; A246-G249 PolarHBondContact O-N 2.91Å; R247-G249 VanDerWaalsContact C-N 3.25Å; R247-G249 PolarHBondContact O-N 3.25Å; G249-Y253 VanDerWaalsContact O-CD2 3.28Å; G249-Y253 WeakPolarHBondContact O-CD2 3.46Å; G249-Y253 PolarHBondContact O-N 3.46Å
250V98.3Very high96.9Very high18 Ų1835.7 Ų35.711%0.10918%0.182CC..Hα-helixtrans-63.7-49.6173.2178.30000110.4A246 R247 F252 Y253 D254 R298 I301 L302 M305A246-V250 PolarHBondContact O-N 3.04Å; A246-V250 VanDerWaalsContact O-N 3.17Å; R247-V250 PolarHBondContact O-N 3.47Å; V250-F252 VanDerWaalsContact C-N 3.34Å; V250-F252 PolarHBondContact O-N 2.81Å; V250-Y253 PolarHBondContact O-N 2.97Å; V250-D254 PolarHBondContact O-N 3.5Å; V250-R298 HydrophobicContact CG1-CG 4.33Å; V250-I301 HydrophobicContact CG2-CB 4.4Å; V250-I301 HydrophobicContact CG2-CG2 3.83Å; V250-L302 HydrophobicContact CG1-CD2 4Å; V250-L302 HydrophobicContact CG1-CG 4.35Å; V250-L302 HydrophobicContact CG2-CD2 3.66Å; V250-L302 HydrophobicContact CG2-CG 3.88Å; V250-M305 HydrophobicContact CG2-SD 3.82Å
251E98.2Very high96.8Very high58 Ų5837.9 Ų37.927%0.27118%0.178SC..Hα-helixtrans-60.1-44.4177.7-177-167.914700111.5S149 A152 R247 G248 Y253 D254 K255S149-E251 WeakPolarHBondContact CB-OE1 3.47Å; S149-E251 WeakPolarHBondContact CB-OE2 3.05Å; S149-E251 PolarHBondContact N-OE1 2.9Å; S149-E251 PolarHBondContact OG-OE1 2.95Å; S149-E251 PolarHBondContact OG-OE2 3.5Å; A152-E251 HydrophobicContact CB-CB 4.2Å; A152-E251 HydrophobicContact CB-CG 4.22Å; R247-E251 PolarHBondContact O-N 2.89Å; R247-E251 VanDerWaalsContact O-N 3.14Å; G248-E251 PolarHBondContact O-N 3.41Å; E251-Y253 VanDerWaalsContact C-N 3.32Å; E251-Y253 PolarHBondContact O-N 2.92Å; E251-D254 PolarHBondContact O-N 2.85Å; E251-D254 VanDerWaalsContact O-N 3.17Å; E251-K255 HydrophobicContact CG-CG 4.13Å; E251-K255 WeakPolarHBondContact O-CB 3.3Å; E251-K255 WeakPolarHBondContact O-CG 3.4Å; E251-K255 PolarHBondContact O-N 3.35Å
252F98.1Very high96.8Very high1 Ų137.7 Ų37.70%0.00418%0.176CC..Hα-helixtrans-55.1-47.8179.8172.9-103.7000111.8F148 A152 F155 A156 G248 V250 K255 I256F148-F252 HydrophobicContact CD1-CD2 4.08Å; F148-F252 AromaticContact CE1-CD2 3.59Å; F148-F252 HydrophobicContact CE1-CD2 3.59Å; F148-F252 HydrophobicContact CE1-CE2 4.24Å; F148-F252 HydrophobicContact CE1-CG 4.41Å; F148-F252 HydrophobicContact CZ-CD2 4.36Å; A152-F252 HydrophobicContact CB-CB 4.29Å; F155-F252 HydrophobicContact CD1-CB 3.92Å; F155-F252 AromaticContact CD1-CD1 3.93Å; F155-F252 HydrophobicContact CD1-CD1 3.93Å; F155-F252 HydrophobicContact CD1-CG 4.03Å; F155-F252 HydrophobicContact CE1-CB 4.36Å; F155-F252 AromaticContact CE1-CD1 3.72Å; F155-F252 HydrophobicContact CE1-CD1 3.72Å; F155-F252 HydrophobicContact CE1-CE1 4.34Å; F155-F252 HydrophobicContact CE1-CG 4.28Å; A156-F252 HydrophobicContact CB-CD2 3.57Å; A156-F252 HydrophobicContact CB-CE2 3.37Å; A156-F252 HydrophobicContact CB-CG 4.31Å; A156-F252 HydrophobicContact CB-CZ 3.96Å; G248-F252 VanDerWaalsContact O-CB 3.23Å; G248-F252 WeakPolarHBondContact O-CB 3.4Å; G248-F252 PolarHBondContact O-N 3.43Å; V250-F252 VanDerWaalsContact C-N 3.34Å; V250-F252 PolarHBondContact O-N 2.81Å; F252-K255 PolarHBondContact O-N 3.13Å; F252-I256 HydrophobicContact CD1-CD1 4.05Å; F252-I256 HydrophobicContact CD2-CD1 4.43Å; F252-I256 HydrophobicContact CE1-CD1 3.4Å; F252-I256 HydrophobicContact CE1-CG1 4.5Å; F252-I256 HydrophobicContact CE2-CD1 3.83Å; F252-I256 HydrophobicContact CE2-CG1 4.41Å; F252-I256 HydrophobicContact CZ-CD1 3.29Å; F252-I256 HydrophobicContact CZ-CG1 4.32Å; F252-I256 WeakPolarHBondContact O-CG1 3.43Å; F252-I256 PolarHBondContact O-N 3.19Å
253Y98Very high96.6Very high1 Ų136.7 Ų36.70%0.00417%0.168CC..Hα-helixtrans-71.8-35.8177.8-74.7-59.1000113F155 R159 D235 G249 V250 E251 K255 I256 L257 Y294 R297 R298 I301F155-Y253 AromaticContact CE1-CE2 3.94Å; F155-Y253 HydrophobicContact CE1-CE2 3.94Å; F155-Y253 HydrophobicContact CZ-CE2 4.03Å; R159-Y253 PolarHBondContact NE-OH 3.35Å; R159-Y253 VanDerWaalsContact NE-OH 3.15Å; D235-Y253 PolarHBondContact OD1-OH 2.84Å; D235-Y253 PolarHBondContact OD2-OH 2.91Å; G249-Y253 VanDerWaalsContact O-CD2 3.28Å; G249-Y253 WeakPolarHBondContact O-CD2 3.46Å; G249-Y253 PolarHBondContact O-N 3.46Å; V250-Y253 PolarHBondContact O-N 2.97Å; E251-Y253 VanDerWaalsContact C-N 3.32Å; E251-Y253 PolarHBondContact O-N 2.92Å; Y253-K255 VanDerWaalsContact C-N 3.33Å; Y253-K255 PolarHBondContact O-N 3.3Å; Y253-I256 PolarHBondContact O-N 3.05Å; Y253-L257 WeakPolarHBondContact O-CB 3.42Å; Y253-L257 WeakPolarHBondContact O-CG 3.47Å; Y253-L257 PolarHBondContact O-N 3.45Å; Y253-Y294 AromaticContact CD1-CD1 3.89Å; Y253-Y294 HydrophobicContact CD1-CD1 3.89Å; Y253-Y294 HydrophobicContact CD1-CG 4.33Å; Y253-Y294 AromaticContact CE1-CD1 3.73Å; Y253-Y294 HydrophobicContact CE1-CD1 3.73Å; Y253-Y294 HydrophobicContact CE1-CE1 4.43Å; Y253-R297 HydrophobicContact CD2-CB 4.28Å; Y253-R297 HydrophobicContact CE1-CB 4.17Å; Y253-R297 HydrophobicContact CE2-CB 3.85Å; Y253-R297 PolarHBondContact OH-NE 3.41Å; Y253-R297 PolarHBondContact OH-NH2 3.41Å; Y253-R298 HydrophobicContact CD2-CB 4.36Å; Y253-R298 HydrophobicContact CG-CB 4.29Å; Y253-I301 HydrophobicContact CD2-CD1 3.9Å; Y253-I301 HydrophobicContact CE2-CD1 3.71Å
254D98Very high96.5Very high63 Ų6332.3 Ų32.334%0.33715%0.152SC..Hα-helixtrans-59.9-43.6173.2-83.2-33.4000111.8V250 E251 L257 S258 R298V250-D254 PolarHBondContact O-N 3.5Å; E251-D254 PolarHBondContact O-N 2.85Å; E251-D254 VanDerWaalsContact O-N 3.17Å; D254-L257 PolarHBondContact O-N 2.91Å; D254-S258 WeakPolarHBondContact O-CB 3.31Å; D254-S258 PolarHBondContact O-N 3.41Å; D254-R298 VanDerWaalsContact OD1-CD 3.29Å; D254-R298 WeakPolarHBondContact OD1-CD 3.5Å; D254-R298 IonicContact OD1-CZ 3.36Å; D254-R298 VanDerWaalsContact OD1-CZ 3.26Å; D254-R298 IonicContact OD1-NE 3.33Å; D254-R298 PolarHBondContact OD1-NE 3.41Å; D254-R298 IonicContact OD1-NH2 2.89Å; D254-R298 PolarHBondContact OD1-NH2 3.24Å; D254-R298 IonicContact OD2-CZ 2.98Å; D254-R298 IonicContact OD2-NE 3.31Å; D254-R298 PolarHBondContact OD2-NE 3.47Å; D254-R298 IonicContact OD2-NH2 3.26Å; D254-R298 PolarHBondContact OD2-NH2 3.47Å
255K97.4Very high96.2Very high41 Ų4132 Ų3218%0.17816%0.159CC..Hα-helixtrans-65.5-41.8175.5-70.8-72.4-175.1178.20112.1E144 V147 F148 E251 F252 Y253 S258 R259E144-K255 PolarHBondContact O-NZ 2.88Å; V147-K255 VanDerWaalsContact O-CE 3.22Å; V147-K255 WeakPolarHBondContact O-CE 3.49Å; V147-K255 PolarHBondContact O-NZ 3.08Å; F148-K255 HydrophobicContact CD1-CB 4.03Å; F148-K255 HydrophobicContact CD1-CG 4.15Å; F148-K255 HydrophobicContact CE1-CB 3.41Å; F148-K255 VanDerWaalsContact CE1-CB 3.41Å; F148-K255 HydrophobicContact CE1-CG 4.05Å; F148-K255 HydrophobicContact CZ-CB 3.81Å; E251-K255 HydrophobicContact CG-CG 4.13Å; E251-K255 WeakPolarHBondContact O-CB 3.3Å; E251-K255 WeakPolarHBondContact O-CG 3.4Å; E251-K255 PolarHBondContact O-N 3.35Å; F252-K255 PolarHBondContact O-N 3.13Å; Y253-K255 VanDerWaalsContact C-N 3.33Å; Y253-K255 PolarHBondContact O-N 3.3Å; K255-S258 PolarHBondContact O-N 3.44Å; K255-R259 VanDerWaalsContact O-CB 3.27Å; K255-R259 WeakPolarHBondContact O-CB 3.5Å; K255-R259 PolarHBondContact O-N 3.42Å
256I95.8Very high95.8Very high5 Ų534.3 Ų34.33%0.02617%0.171CC..Hα-helixtrans-60.4-47.4173.5-77.2-177.5000111.6F252 Y253 R259 N260 Y294F252-I256 HydrophobicContact CD1-CD1 4.05Å; F252-I256 HydrophobicContact CD2-CD1 4.43Å; F252-I256 HydrophobicContact CE1-CD1 3.4Å; F252-I256 HydrophobicContact CE1-CG1 4.5Å; F252-I256 HydrophobicContact CE2-CD1 3.83Å; F252-I256 HydrophobicContact CE2-CG1 4.41Å; F252-I256 HydrophobicContact CZ-CD1 3.29Å; F252-I256 HydrophobicContact CZ-CG1 4.32Å; F252-I256 WeakPolarHBondContact O-CG1 3.43Å; F252-I256 PolarHBondContact O-N 3.19Å; Y253-I256 PolarHBondContact O-N 3.05Å; I256-R259 PolarHBondContact O-N 2.86Å; I256-N260 WeakPolarHBondContact O-CB 3.44Å; I256-N260 PolarHBondContact O-N 3.37Å; I256-N260 PolarHBondContact O-OD1 3.16Å; I256-Y294 HydrophobicContact CG2-CD1 4.27Å; I256-Y294 HydrophobicContact CG2-CD2 3.62Å; I256-Y294 HydrophobicContact CG2-CE1 4.36Å; I256-Y294 HydrophobicContact CG2-CE2 3.73Å; I256-Y294 HydrophobicContact CG2-CG 3.91Å
257L96.7Very high95.5Very high12 Ų1236.2 Ų36.26%0.06318%0.18CC..Hα-helixtrans-63.1-44.2180-71.4168.3000110.6Y253 D254 N260 K261 T295Y253-L257 WeakPolarHBondContact O-CB 3.42Å; Y253-L257 WeakPolarHBondContact O-CG 3.47Å; Y253-L257 PolarHBondContact O-N 3.45Å; D254-L257 PolarHBondContact O-N 2.91Å; L257-N260 PolarHBondContact O-N 3.12Å; L257-K261 WeakPolarHBondContact O-CG 3.19Å; L257-K261 PolarHBondContact O-N 3.29Å; L257-T295 HydrophobicContact CD1-CG2 3.94Å; L257-T295 HydrophobicContact CD2-CG2 3.91Å
258S96.8Very high95.1Very high52 Ų5232.3 Ų32.336%0.36418%0.177SC..Hα-helixtrans-60.6-49.6175.6-173.80000111.8D254 K255 N260 K261 M262D254-S258 WeakPolarHBondContact O-CB 3.31Å; D254-S258 PolarHBondContact O-N 3.41Å; K255-S258 PolarHBondContact O-N 3.44Å; S258-N260 VanDerWaalsContact C-N 3.3Å; S258-N260 PolarHBondContact O-N 2.95Å; S258-K261 WeakPolarHBondContact O-CB 3.39Å; S258-K261 PolarHBondContact O-N 3.28Å; S258-K261 VanDerWaalsContact O-N 3.16Å; S258-M262 WeakPolarHBondContact O-CG 3.49Å; S258-M262 PolarHBondContact O-N 3.03Å
259R95.1Very high94.8Very high15 Ų1539.2 Ų39.26%0.05721%0.209CC..Hα-helixtrans-54.2-48.1175.6-178.9-16268.4-154.8-1.7111L142 A145 L146 K255 I256 K261 M262 L263L142-R259 HydrophobicContact CD1-CG 3.77Å; A145-R259 HydrophobicContact CB-CB 3.96Å; L146-R259 HydrophobicContact CD2-CG 4.04Å; K255-R259 VanDerWaalsContact O-CB 3.27Å; K255-R259 WeakPolarHBondContact O-CB 3.5Å; K255-R259 PolarHBondContact O-N 3.42Å; I256-R259 PolarHBondContact O-N 2.86Å; R259-K261 PolarHBondContact O-N 3.07Å; R259-M262 PolarHBondContact O-N 3.38Å; R259-M262 VanDerWaalsContact O-N 3.14Å; R259-L263 HydrophobicContact CG-CD1 4.1Å; R259-L263 HydrophobicContact CG-CG 4.39Å; R259-L263 WeakPolarHBondContact O-CG 2.93Å; R259-L263 PolarHBondContact O-N 3.38Å
260N94.8Very high94.4Very high1 Ų146 Ų461%0.00524%0.239CC..Hα-helixtrans-65.5-36.6-178.1-71.61000112.4I256 L257 S258 M262 L263 R264 Y275 G279I256-N260 WeakPolarHBondContact O-CB 3.44Å; I256-N260 PolarHBondContact O-N 3.37Å; I256-N260 PolarHBondContact O-OD1 3.16Å; L257-N260 PolarHBondContact O-N 3.12Å; S258-N260 VanDerWaalsContact C-N 3.3Å; S258-N260 PolarHBondContact O-N 2.95Å; N260-M262 VanDerWaalsContact C-N 3.32Å; N260-M262 PolarHBondContact O-N 3.19Å; N260-L263 PolarHBondContact O-N 3.42Å; N260-R264 WeakPolarHBondContact O-CB 3.49Å; N260-R264 PolarHBondContact O-N 3.03Å; N260-Y275 HydrophobicContact CB-CD1 3.5Å; N260-Y275 HydrophobicContact CB-CE1 3.8Å; N260-Y275 HydrophobicContact CB-CG 4.22Å; N260-Y275 VanDerWaalsContact CG-CE1 3.47Å; N260-G279 WeakPolarHBondContact CB-O 3.43Å; N260-G279 PolarHBondContact ND2-O 3.35Å
261K94.6Very high94Very high96 Ų9645.2 Ų45.242%0.41723%0.234SC..Hα-helixtrans-62.5-39.1171.4-70.4172.1-174.4177.70111.9L257 S258 R259 R264 S265 P277 S278L257-K261 WeakPolarHBondContact O-CG 3.19Å; L257-K261 PolarHBondContact O-N 3.29Å; S258-K261 WeakPolarHBondContact O-CB 3.39Å; S258-K261 PolarHBondContact O-N 3.28Å; S258-K261 VanDerWaalsContact O-N 3.16Å; R259-K261 PolarHBondContact O-N 3.07Å; K261-R264 VanDerWaalsContact O-CB 3.32Å; K261-R264 WeakPolarHBondContact O-CB 3.47Å; K261-R264 PolarHBondContact O-N 3.5Å; K261-S265 PolarHBondContact O-N 3.28Å; K261-P277 WeakPolarHBondContact CE-O 3.26Å; K261-S278 WeakPolarHBondContact CE-O 3.47Å
262M93.5Very high93.7Very high46 Ų4647.4 Ų47.423%0.22724%0.244CC..Hα-helixtrans-68.8-43.5175.8-62.8-65.874.100112.3A141 L142 S258 R259 N260 R264 S265 L266A141-M262 HydrophobicContact CB-CG 4.27Å; A141-M262 HydrophobicContact CB-SD 3.57Å; A141-M262 VanDerWaalsContact CB-SD 3.57Å; L142-M262 HydrophobicContact CB-CB 4.32Å; L142-M262 HydrophobicContact CD1-CB 4.2Å; S258-M262 WeakPolarHBondContact O-CG 3.49Å; S258-M262 PolarHBondContact O-N 3.03Å; R259-M262 PolarHBondContact O-N 3.38Å; R259-M262 VanDerWaalsContact O-N 3.14Å; N260-M262 VanDerWaalsContact C-N 3.32Å; N260-M262 PolarHBondContact O-N 3.19Å; M262-R264 VanDerWaalsContact C-N 3.27Å; M262-R264 PolarHBondContact O-N 2.85Å; M262-S265 PolarHBondContact O-N 3.47Å; M262-L266 WeakPolarHBondContact O-CB 3.23Å; M262-L266 VanDerWaalsContact O-CG 3.26Å; M262-L266 WeakPolarHBondContact O-CG 3.47Å; M262-L266 PolarHBondContact O-N 2.91Å
263L91.9Very high93.3Very high15 Ų1553.6 Ų53.68%0.07927%0.273CS..Hα-helixtrans-61.5-36.7173.3-67177.6000111.8I127 L142 R259 N260 S265 L266 M267 Y275I127-L263 HydrophobicContact CD1-CD2 3.54Å; I127-L263 HydrophobicContact CG1-CD2 4.35Å; L142-L263 HydrophobicContact CD1-CD2 4.32Å; L142-L263 HydrophobicContact CD1-CG 4.46Å; L142-L263 HydrophobicContact CD2-CD2 4.39Å; R259-L263 HydrophobicContact CG-CD1 4.1Å; R259-L263 HydrophobicContact CG-CG 4.39Å; R259-L263 WeakPolarHBondContact O-CG 2.93Å; R259-L263 PolarHBondContact O-N 3.38Å; N260-L263 PolarHBondContact O-N 3.42Å; L263-S265 VanDerWaalsContact C-N 3.33Å; L263-S265 PolarHBondContact O-N 3.5Å; L263-L266 PolarHBondContact O-N 3.48Å; L263-M267 HydrophobicContact CB-SD 4.26Å; L263-M267 WeakPolarHBondContact O-CB 3.41Å; L263-M267 WeakPolarHBondContact O-CG 3.1Å; L263-M267 PolarHBondContact O-N 2.91Å; L263-Y275 HydrophobicContact CB-CD2 4.18Å; L263-Y275 HydrophobicContact CB-CE2 3.63Å; L263-Y275 HydrophobicContact CD1-CE2 4.38Å; L263-Y275 WeakPolarHBondContact CD1-OH 3.48Å
264R92.3Very high92.8Very high43 Ų4357.7 Ų57.716%0.16229%0.293CS..Hα-helixtrans-54.4-49.4173.9-170.1-171.4161.964.88111.5N260 K261 M262 E272 Y275N260-R264 WeakPolarHBondContact O-CB 3.49Å; N260-R264 PolarHBondContact O-N 3.03Å; K261-R264 VanDerWaalsContact O-CB 3.32Å; K261-R264 WeakPolarHBondContact O-CB 3.47Å; K261-R264 PolarHBondContact O-N 3.5Å; M262-R264 VanDerWaalsContact C-N 3.27Å; M262-R264 PolarHBondContact O-N 2.85Å; R264-E272 VanDerWaalsContact CZ-CB 3.47Å; R264-E272 IonicContact CZ-OE1 3.17Å; R264-E272 IonicContact NE-OE1 3.76Å; R264-E272 VanDerWaalsContact NH1-C 3.32Å; R264-E272 VanDerWaalsContact NH1-CA 3.3Å; R264-E272 VanDerWaalsContact NH1-CB 3.27Å; R264-E272 PolarHBondContact NH1-O 2.93Å; R264-E272 VanDerWaalsContact NH2-CB 3.25Å; R264-E272 VanDerWaalsContact NH2-CG 3.26Å; R264-E272 IonicContact NH2-OE1 3.01Å; R264-E272 PolarHBondContact NH2-OE1 3.45Å; R264-E272 IonicContact NH2-OE2 3.98Å; R264-Y275 HydrophobicContact CB-CD2 4.38Å; R264-Y275 WeakPolarHBondContact CD-O 3.32Å; R264-Y275 PolarHBondContact NH1-O 3.47Å
265S90.9Very high92.5Very high76 Ų7655.9 Ų55.953%0.53128%0.282SS..Hα-helixtrans-72.7-45.8-178.9114.20000111.7K261 M262 L263 M267 G268K261-S265 PolarHBondContact O-N 3.28Å; M262-S265 PolarHBondContact O-N 3.47Å; L263-S265 VanDerWaalsContact C-N 3.33Å; L263-S265 PolarHBondContact O-N 3.5Å; S265-M267 VanDerWaalsContact C-N 3.26Å; S265-M267 PolarHBondContact O-N 3.11Å; S265-G268 PolarHBondContact O-N 2.93Å; S265-G268 VanDerWaalsContact O-N 3.14Å
266L89.9Confident92.2Very high56 Ų5654.6 Ų54.629%0.29328%0.278SS..Hα-helixtrans-65.1-28.8-176.6-72.1169.9000113I127 A138 L142 M262 L263I127-L266 HydrophobicContact CD1-CB 4.35Å; I127-L266 HydrophobicContact CD1-CD1 3.85Å; I127-L266 HydrophobicContact CG2-CB 4.06Å; A138-L266 HydrophobicContact CB-CD2 3.66Å; A138-L266 HydrophobicContact CB-CG 4.3Å; L142-L266 HydrophobicContact CB-CD1 4.38Å; L142-L266 HydrophobicContact CD2-CD1 3.81Å; M262-L266 WeakPolarHBondContact O-CB 3.23Å; M262-L266 VanDerWaalsContact O-CG 3.26Å; M262-L266 WeakPolarHBondContact O-CG 3.47Å; M262-L266 PolarHBondContact O-N 2.91Å; L263-L266 PolarHBondContact O-N 3.48Å
267M91Very high92Very high43 Ų4358.9 Ų58.921%0.21231%0.307CS..THydrogen-bonded Turntrans-89.5-5.7179-65.6173.265.500113.7I127 L263 S265 K270 Y275I127-M267 HydrophobicContact CG2-CG 3.42Å; I127-M267 VanDerWaalsContact CG2-CG 3.42Å; L263-M267 HydrophobicContact CB-SD 4.26Å; L263-M267 WeakPolarHBondContact O-CB 3.41Å; L263-M267 WeakPolarHBondContact O-CG 3.1Å; L263-M267 PolarHBondContact O-N 2.91Å; S265-M267 VanDerWaalsContact C-N 3.26Å; S265-M267 PolarHBondContact O-N 3.11Å; M267-K270 HydrophobicContact CB-CB 4.43Å; M267-K270 HydrophobicContact CE-CB 4.22Å; M267-K270 PolarHBondContact O-N 3.27Å; M267-Y275 HydrophobicContact SD-CE2 4.03Å
268G90.3Very high91.8Very high36 Ų3660.6 Ų60.637%0.37132%0.32SS..THydrogen-bonded Turntrans57.4-134.6-174.500000111.9S265 K270 G271 E272S265-G268 PolarHBondContact O-N 2.93Å; S265-G268 VanDerWaalsContact O-N 3.14Å; G268-K270 PolarHBondContact O-N 3.35Å; G268-K270 VanDerWaalsContact O-N 3.11Å; G268-G271 WeakPolarHBondContact O-CA 3.46Å; G268-G271 PolarHBondContact O-N 2.89Å; G268-E272 WeakPolarHBondContact O-CG 3.28Å; G268-E272 PolarHBondContact O-N 3.34Å; G268-E272 VanDerWaalsContact O-N 3.09Å
269Q90.6Very high91.6Very high146 Ų14658.1 Ų58.168%0.68230%0.302SS*.Hα-helixtrans-56.3-28.9-177.8-173.3179.60.400114.4G271 E272 E273Q269-G271 VanDerWaalsContact C-N 3.34Å; Q269-E272 VanDerWaalsContact O-CA 3.25Å; Q269-E272 WeakPolarHBondContact O-CA 3.31Å; Q269-E273 WeakPolarHBondContact O-CG 3.49Å; Q269-E273 PolarHBondContact O-N 3.22Å
270K89.4Confident91.5Very high143 Ų14358.3 Ų58.362%0.62230%0.304SS*.Hα-helixtrans-72.5-31.4174.3-70.6-176.4177.4-179.90112.2M267 G268 E273 M274M267-K270 HydrophobicContact CB-CB 4.43Å; M267-K270 HydrophobicContact CE-CB 4.22Å; M267-K270 PolarHBondContact O-N 3.27Å; G268-K270 PolarHBondContact O-N 3.35Å; G268-K270 VanDerWaalsContact O-N 3.11Å; K270-E273 PolarHBondContact O-N 2.93Å; K270-M274 WeakPolarHBondContact O-CB 3.41Å; K270-M274 PolarHBondContact O-N 3.42Å
271G90.7Very high91.2Very high0 Ų061.2 Ų61.20%032%0.32CS..Hα-helixtrans-72.6-56.7177.900000111.5G268 Q269 E273 M274 Y275G268-G271 WeakPolarHBondContact O-CA 3.46Å; G268-G271 PolarHBondContact O-N 2.89Å; Q269-G271 VanDerWaalsContact C-N 3.34Å; G271-E273 PolarHBondContact O-N 3.45Å; G271-M274 PolarHBondContact O-N 3.46Å; G271-Y275 PolarHBondContact O-N 2.98Å
272E91.5Very high90.5Very high105 Ų10560.9 Ų60.949%0.49132%0.319SS..Hα-helix27.4-93.3122.319.2-177.5122.400119.1R264 G268 Q269 F282R264-E272 VanDerWaalsContact CZ-CB 3.47Å; R264-E272 IonicContact CZ-OE1 3.17Å; R264-E272 IonicContact NE-OE1 3.76Å; R264-E272 VanDerWaalsContact NH1-C 3.32Å; R264-E272 VanDerWaalsContact NH1-CA 3.3Å; R264-E272 VanDerWaalsContact NH1-CB 3.27Å; R264-E272 PolarHBondContact NH1-O 2.93Å; R264-E272 VanDerWaalsContact NH2-CB 3.25Å; R264-E272 VanDerWaalsContact NH2-CG 3.26Å; R264-E272 IonicContact NH2-OE1 3.01Å; R264-E272 PolarHBondContact NH2-OE1 3.45Å; R264-E272 IonicContact NH2-OE2 3.98Å; G268-E272 WeakPolarHBondContact O-CG 3.28Å; G268-E272 PolarHBondContact O-N 3.34Å; G268-E272 VanDerWaalsContact O-N 3.09Å; Q269-E272 VanDerWaalsContact O-CA 3.25Å; Q269-E272 WeakPolarHBondContact O-CA 3.31Å; E272-F282 VanDerWaalsContact O-CE2 3.31Å; E272-F282 WeakPolarHBondContact O-CE2 3.22Å
273E89.6Confident89Confident130 Ų13061.9 Ų61.961%0.60733%0.329SS*.Hα-helixtrans-79.8-20.2-173.6-66162.6-177.100112.5Q269 K270 G271 F282Q269-E273 WeakPolarHBondContact O-CG 3.49Å; Q269-E273 PolarHBondContact O-N 3.22Å; K270-E273 PolarHBondContact O-N 2.93Å; G271-E273 PolarHBondContact O-N 3.45Å; E273-F282 WeakPolarHBondContact O-CB 3.2Å
274M88.4Confident87.3Confident88 Ų8864.3 Ų64.343%0.43335%0.351SS..Hα-helixtrans-94.8-37.4-173.6-174.3171.7-66.500113.7K270 G271 F282K270-M274 WeakPolarHBondContact O-CB 3.41Å; K270-M274 PolarHBondContact O-N 3.42Å; G271-M274 PolarHBondContact O-N 3.46Å; M274-F282 PolarHBondContact O-N 3.4Å
275Y91.4Very high85.4Confident25 Ų2568.3 Ų68.310%0.09837%0.371CS..BIsolated β-bridgetrans-123.8125-170.5-58.5-72.5000111.3N260 L263 R264 M267 G271 N280 L281 F282N260-Y275 HydrophobicContact CB-CD1 3.5Å; N260-Y275 HydrophobicContact CB-CE1 3.8Å; N260-Y275 HydrophobicContact CB-CG 4.22Å; N260-Y275 VanDerWaalsContact CG-CE1 3.47Å; L263-Y275 HydrophobicContact CB-CD2 4.18Å; L263-Y275 HydrophobicContact CB-CE2 3.63Å; L263-Y275 HydrophobicContact CD1-CE2 4.38Å; L263-Y275 WeakPolarHBondContact CD1-OH 3.48Å; R264-Y275 HydrophobicContact CB-CD2 4.38Å; R264-Y275 WeakPolarHBondContact CD-O 3.32Å; R264-Y275 PolarHBondContact NH1-O 3.47Å; M267-Y275 HydrophobicContact SD-CE2 4.03Å; G271-Y275 PolarHBondContact O-N 2.98Å; Y275-N280 CarbonylContact C-O 3.53Å; Y275-N280 WeakPolarHBondContact CA-O 2.91Å; Y275-L281 HydrophobicContact CD1-CD2 3.73Å; Y275-L281 HydrophobicContact CE1-CD2 3.53Å; Y275-F282 VanDerWaalsContact C-CD2 3.45Å; Y275-F282 VanDerWaalsContact C-CE2 3.47Å; Y275-F282 VanDerWaalsContact O-CE2 3.31Å; Y275-F282 WeakPolarHBondContact O-CE2 3.49Å
276A91.4Very high83.3Confident13 Ų1371.9 Ų71.911%0.10739%0.389CS..  trans-64157.1170.500000111.5S278 G279 N280 F282A276-S278 PolarHBondContact O-N 3.23Å; A276-G279 PolarHBondContact O-N 2.83Å; A276-N280 HydrophobicContact CB-CB 4.36Å; A276-N280 PolarHBondContact N-O 3.01Å; A276-F282 VanDerWaalsContact CA-CE2 3.45Å; A276-F282 HydrophobicContact CB-CD1 4.44Å; A276-F282 HydrophobicContact CB-CE1 4.09Å; A276-F282 HydrophobicContact CB-CE2 4.18Å; A276-F282 HydrophobicContact CB-CZ 3.95Å
277P91.9Very high81.1Confident95 Ų9575.7 Ų75.762%0.61741%0.409SS*.THydrogen-bonded Turntrans-55.2-26173.9-26.935.4000113.9K261 G279K261-P277 WeakPolarHBondContact CE-O 3.26Å; P277-G279 VanDerWaalsContact C-N 3.26Å; P277-G279 PolarHBondContact O-N 3.46Å
278S92.3Very high79.1Confident48 Ų4875.5 Ų75.534%0.33641%0.408SS..THydrogen-bonded Turntrans-71.1-16.2174.155.90000114K261 A276 N280K261-S278 WeakPolarHBondContact CE-O 3.47Å; A276-S278 PolarHBondContact O-N 3.23Å; S278-N280 PolarHBondContact OG-ND2 3.37Å
279G92.4Very high77.5Confident0 Ų077.3 Ų77.30%041%0.409CS..SBendtrans92.5-2.6-171.700000113.9N260 A276 P277N260-G279 WeakPolarHBondContact CB-O 3.43Å; N260-G279 PolarHBondContact ND2-O 3.35Å; A276-G279 PolarHBondContact O-N 2.83Å; P277-G279 VanDerWaalsContact C-N 3.26Å; P277-G279 PolarHBondContact O-N 3.46Å
280N93.1Very high76Confident19 Ų1976.5 Ų76.510%0.10240%0.403CS..PPolyproline II helixtrans-69158.3170.5-73.1-39.7000111.1Y275 A276 S278 Y294 T295Y275-N280 CarbonylContact C-O 3.53Å; Y275-N280 WeakPolarHBondContact CA-O 2.91Å; A276-N280 HydrophobicContact CB-CB 4.36Å; A276-N280 PolarHBondContact N-O 3.01Å; S278-N280 PolarHBondContact OG-ND2 3.37Å; N280-Y294 PolarHBondContact OD1-N 3.34Å; N280-T295 WeakPolarHBondContact ND2-CG2 3.5Å; N280-T295 PolarHBondContact ND2-OG1 3.49Å; N280-T295 PolarHBondContact OD1-N 2.97Å; N280-T295 VanDerWaalsContact OD1-N 3.1Å
281L88.1Confident75.1Confident63 Ų6373.9 Ų73.933%0.3339%0.392SS..BIsolated β-bridgetrans-73.3139.5169-61.2175.1000109.4Y275 Y294Y275-L281 HydrophobicContact CD1-CD2 3.73Å; Y275-L281 HydrophobicContact CE1-CD2 3.53Å; L281-Y294 HydrophobicContact CD1-CE2 4.16Å; L281-Y294 HydrophobicContact CG-CE2 3.89Å
282F80Confident74.8Confident89 Ų8974 Ų7439%0.3939%0.393SS..PPolyproline II helixtrans-69.2146.9166.8-85.8-63.5000110.1E272 E273 M274 Y275 A276 A284E272-F282 VanDerWaalsContact O-CE2 3.31Å; E272-F282 WeakPolarHBondContact O-CE2 3.22Å; E273-F282 WeakPolarHBondContact O-CB 3.2Å; M274-F282 PolarHBondContact O-N 3.4Å; Y275-F282 VanDerWaalsContact C-CD2 3.45Å; Y275-F282 VanDerWaalsContact C-CE2 3.47Å; Y275-F282 VanDerWaalsContact O-CE2 3.31Å; Y275-F282 WeakPolarHBondContact O-CE2 3.49Å; A276-F282 VanDerWaalsContact CA-CE2 3.45Å; A276-F282 HydrophobicContact CB-CD1 4.44Å; A276-F282 HydrophobicContact CB-CE1 4.09Å; A276-F282 HydrophobicContact CB-CE2 4.18Å; A276-F282 HydrophobicContact CB-CZ 3.95Å; F282-A284 PolarHBondContact O-N 2.81Å
283P61.2Low74.8Confident67 Ų6771.2 Ų71.244%0.43539%0.385SS..PPolyproline II helixtrans-57.4129.2174.3-15.927.7000109.2H285 L289P283-H285 PolarHBondContact O-N 3.24Å; P283-L289 HydrophobicContact CB-CD2 4.11Å; P283-L289 HydrophobicContact CG-CD2 3.89Å
284A55.9Low75Confident66 Ų6666.7 Ų66.755%0.54536%0.362SS..SBendtrans-59.6-31.6178.100000111.5F282F282-A284 PolarHBondContact O-N 2.81Å
285H54.3Low75.3Confident126 Ų12664.5 Ų64.558%0.58335%0.354SS*.BIsolated β-bridgetrans-145.1153.6178-52.9-57.9000110.6P283 L287 Q288P283-H285 PolarHBondContact O-N 3.24Å; H285-L287 PolarHBondContact O-N 3.22Å; H285-Q288 PolarHBondContact O-N 2.95Å; H285-Q288 VanDerWaalsContact O-N 3.11Å
286V46.7Very low75.5Confident152 Ų15265 Ų6592%0.92136%0.361SS*.THydrogen-bonded Turntrans-53.8-22.7-178.6179.60000113.6
287L42.2Very low75.8Confident136 Ų13664.7 Ų64.771%0.71236%0.357SS*.THydrogen-bonded Turntrans-112.54.3-174.5-62.6173.4000114.4H285H285-L287 PolarHBondContact O-N 3.22Å
288Q49.8Very low76Confident39 Ų3963.5 Ų63.518%0.18234%0.34CS..BIsolated β-bridgetrans-140.8117.4-175.4-157.7178.6-1.400113.5F220 D224 H285 K290F220-Q288 HydrophobicContact CD1-CB 4.47Å; F220-Q288 HydrophobicContact CD1-CG 4.31Å; D224-Q288 WeakPolarHBondContact OD1-CG 3.44Å; D224-Q288 WeakPolarHBondContact OD2-CA 3.42Å; H285-Q288 PolarHBondContact O-N 2.95Å; H285-Q288 VanDerWaalsContact O-N 3.11Å; Q288-K290 PolarHBondContact O-N 2.71Å
289L57.2Low76.2Confident74 Ų7466.8 Ų66.839%0.38735%0.35SS..  trans-9383.3167.5-69.9171.6000108.5D224 P283 H291D224-L289 PolarHBondContact OD2-N 3.44Å; P283-L289 HydrophobicContact CB-CD2 4.11Å; P283-L289 HydrophobicContact CG-CD2 3.89Å; L289-H291 PolarHBondContact O-N 2.76Å; L289-H291 VanDerWaalsContact O-N 3.07Å
290K59.2Low76.4Confident128 Ų12868.2 Ų68.256%0.55737%0.365SS*.  trans-57.7-25.7-178.9-168.6176.5178.9-179.50113.4Q288Q288-K290 PolarHBondContact O-N 2.71Å
291H69Low76.6Confident88 Ų8867.4 Ų67.441%0.40736%0.361SS..SBendtrans-138.2143.4179.2-64.6-64.3000111.6L289L289-H291 PolarHBondContact O-N 2.76Å; L289-H291 VanDerWaalsContact O-N 3.07Å
292T84.4Confident77Confident2 Ų266.9 Ų66.91%0.01236%0.358CS..  trans-62.9133172.7-47.50000110Q228 D231 Y232 Y294 R297Q228-T292 WeakPolarHBondContact CA-OG1 3.25Å; D231-T292 WeakPolarHBondContact CB-OG1 3.48Å; D231-T292 WeakPolarHBondContact OD2-CB 3.19Å; D231-T292 PolarHBondContact OD2-N 2.97Å; D231-T292 PolarHBondContact OD2-OG1 3.04Å; Y232-T292 HydrophobicContact CD1-CG2 4.48Å; Y232-T292 HydrophobicContact CD2-CG2 4.35Å; Y232-T292 HydrophobicContact CE1-CG2 3.74Å; Y232-T292 HydrophobicContact CE2-CG2 3.56Å; Y232-T292 WeakPolarHBondContact OH-CG2 3.39Å; T292-Y294 PolarHBondContact O-N 3.29Å; T292-R297 HydrophobicContact CG2-CG 3.7Å
293P91.6Very high77.7Confident48 Ų4864.6 Ų64.631%0.31236%0.356SS..  trans-53126.3176.7-26.634.7000111.8T295 S296 R297P293-T295 PolarHBondContact O-N 3.44Å; P293-S296 WeakPolarHBondContact O-CB 3.17Å; P293-S296 PolarHBondContact O-N 2.97Å; P293-R297 WeakPolarHBondContact O-CG 3.47Å; P293-R297 PolarHBondContact O-N 3.12Å; P293-R297 VanDerWaalsContact O-N 3.1Å
294Y94.6Very high79.2Confident35 Ų3563 Ų6314%0.13734%0.343CS..Hα-helixtrans-57.6-33-179.9-61.3-52.4000112.6Y253 I256 N280 L281 T292 R297 R298Y253-Y294 AromaticContact CD1-CD1 3.89Å; Y253-Y294 HydrophobicContact CD1-CD1 3.89Å; Y253-Y294 HydrophobicContact CD1-CG 4.33Å; Y253-Y294 AromaticContact CE1-CD1 3.73Å; Y253-Y294 HydrophobicContact CE1-CD1 3.73Å; Y253-Y294 HydrophobicContact CE1-CE1 4.43Å; I256-Y294 HydrophobicContact CG2-CD1 4.27Å; I256-Y294 HydrophobicContact CG2-CD2 3.62Å; I256-Y294 HydrophobicContact CG2-CE1 4.36Å; I256-Y294 HydrophobicContact CG2-CE2 3.73Å; I256-Y294 HydrophobicContact CG2-CG 3.91Å; N280-Y294 PolarHBondContact OD1-N 3.34Å; L281-Y294 HydrophobicContact CD1-CE2 4.16Å; L281-Y294 HydrophobicContact CG-CE2 3.89Å; T292-Y294 PolarHBondContact O-N 3.29Å; Y294-R297 PolarHBondContact O-N 3.18Å; Y294-R298 WeakPolarHBondContact O-CB 3.26Å; Y294-R298 PolarHBondContact O-N 3.01Å
295T95.3Very high80.9Confident42 Ų4261.2 Ų61.226%0.25832%0.324SS..Hα-helixtrans-59.2-45.7172.952.90000112.1L257 N280 P293 R298 E299L257-T295 HydrophobicContact CD1-CG2 3.94Å; L257-T295 HydrophobicContact CD2-CG2 3.91Å; N280-T295 WeakPolarHBondContact ND2-CG2 3.5Å; N280-T295 PolarHBondContact ND2-OG1 3.49Å; N280-T295 PolarHBondContact OD1-N 2.97Å; N280-T295 VanDerWaalsContact OD1-N 3.1Å; P293-T295 PolarHBondContact O-N 3.44Å; T295-R298 WeakPolarHBondContact O-CB 3.47Å; T295-R298 PolarHBondContact O-N 3.23Å; T295-E299 WeakPolarHBondContact O-CG 3.4Å; T295-E299 PolarHBondContact O-N 2.95Å
296S95.4Very high82.6Confident36 Ų3662.5 Ų62.525%0.25233%0.328SS..Hα-helixtrans-68.1-38.4179.3-1790000111.9Y232 P293 E299 G300Y232-S296 PolarHBondContact OH-OG 3.14Å; P293-S296 WeakPolarHBondContact O-CB 3.17Å; P293-S296 PolarHBondContact O-N 2.97Å; S296-E299 PolarHBondContact O-N 3.06Å; S296-G300 PolarHBondContact O-N 3.28Å
297R96.7Very high84.3Confident6 Ų661.5 Ų61.52%0.02331%0.313CS..Hα-helixtrans-61.3-44.9175.2-61.617876147.812.3111.7D231 Y232 D235 Y253 T292 P293 Y294 G300 I301D231-R297 VanDerWaalsContact CG-CZ 3.46Å; D231-R297 PolarHBondContact O-NH2 3.45Å; D231-R297 IonicContact OD1-CZ 2.66Å; D231-R297 VanDerWaalsContact OD1-CZ 3.31Å; D231-R297 IonicContact OD1-NH1 3.93Å; D231-R297 PolarHBondContact OD1-NH1 3.2Å; D231-R297 IonicContact OD1-NH2 2.89Å; D231-R297 PolarHBondContact OD1-NH2 2.89Å; D231-R297 IonicContact OD2-CZ 3.87Å; D231-R297 IonicContact OD2-NH1 2.82Å; D231-R297 PolarHBondContact OD2-NH1 3.49Å; Y232-R297 HydrophobicContact CE1-CG 4.34Å; D235-R297 IonicContact OD1-CZ 3.95Å; D235-R297 IonicContact OD1-NE 3.24Å; D235-R297 IonicContact OD1-NH2 2.74Å; D235-R297 PolarHBondContact OD1-NH2 3Å; D235-R297 IonicContact OD2-CZ 2.91Å; D235-R297 IonicContact OD2-NE 2.91Å; D235-R297 PolarHBondContact OD2-NE 3.39Å; D235-R297 IonicContact OD2-NH2 2.92Å; D235-R297 PolarHBondContact OD2-NH2 3.17Å; Y253-R297 HydrophobicContact CD2-CB 4.28Å; Y253-R297 HydrophobicContact CE1-CB 4.17Å; Y253-R297 HydrophobicContact CE2-CB 3.85Å; Y253-R297 PolarHBondContact OH-NE 3.41Å; Y253-R297 PolarHBondContact OH-NH2 3.41Å; T292-R297 HydrophobicContact CG2-CG 3.7Å; P293-R297 WeakPolarHBondContact O-CG 3.47Å; P293-R297 PolarHBondContact O-N 3.12Å; P293-R297 VanDerWaalsContact O-N 3.1Å; Y294-R297 PolarHBondContact O-N 3.18Å; R297-G300 PolarHBondContact O-N 2.88Å; R297-I301 PolarHBondContact O-N 3.2Å
298R97.3Very high85.9Confident69 Ų6960.5 Ų60.526%0.2631%0.305SS..Hα-helixtrans-59.5-47174.2-176.3-172.6172.5-103.711.8112.1V250 Y253 D254 Y294 T295 G300 I301 L302V250-R298 HydrophobicContact CG1-CG 4.33Å; Y253-R298 HydrophobicContact CD2-CB 4.36Å; Y253-R298 HydrophobicContact CG-CB 4.29Å; D254-R298 VanDerWaalsContact OD1-CD 3.29Å; D254-R298 WeakPolarHBondContact OD1-CD 3.5Å; D254-R298 IonicContact OD1-CZ 3.36Å; D254-R298 VanDerWaalsContact OD1-CZ 3.26Å; D254-R298 IonicContact OD1-NE 3.33Å; D254-R298 PolarHBondContact OD1-NE 3.41Å; D254-R298 IonicContact OD1-NH2 2.89Å; D254-R298 PolarHBondContact OD1-NH2 3.24Å; D254-R298 IonicContact OD2-CZ 2.98Å; D254-R298 IonicContact OD2-NE 3.31Å; D254-R298 PolarHBondContact OD2-NE 3.47Å; D254-R298 IonicContact OD2-NH2 3.26Å; D254-R298 PolarHBondContact OD2-NH2 3.47Å; Y294-R298 WeakPolarHBondContact O-CB 3.26Å; Y294-R298 PolarHBondContact O-N 3.01Å; T295-R298 WeakPolarHBondContact O-CB 3.47Å; T295-R298 PolarHBondContact O-N 3.23Å; R298-G300 VanDerWaalsContact C-N 3.31Å; R298-G300 PolarHBondContact O-N 3.15Å; R298-I301 PolarHBondContact O-N 3.33Å; R298-L302 HydrophobicContact CG-CD1 4.37Å; R298-L302 PolarHBondContact O-N 3.37Å
299E96.8Very high86.6Confident117 Ų11765.6 Ų65.655%0.54733%0.326SS..Hα-helixtrans-61.1-39.6177.8-75.1167.3-17400112T295 S296 I301 L302 A303T295-E299 WeakPolarHBondContact O-CG 3.4Å; T295-E299 PolarHBondContact O-N 2.95Å; S296-E299 PolarHBondContact O-N 3.06Å; E299-I301 VanDerWaalsContact C-N 3.32Å; E299-I301 PolarHBondContact O-N 2.84Å; E299-L302 PolarHBondContact O-N 3.28Å; E299-A303 PolarHBondContact O-N 2.85Å
300G96.1Very high86.4Confident30 Ų3069 Ų6931%0.30937%0.365SS..Hα-helixtrans-58.2-42.617400000112.6S296 R297 R298 A303 L304S296-G300 PolarHBondContact O-N 3.28Å; R297-G300 PolarHBondContact O-N 2.88Å; R298-G300 VanDerWaalsContact C-N 3.31Å; R298-G300 PolarHBondContact O-N 3.15Å; G300-A303 PolarHBondContact O-N 2.96Å; G300-L304 WeakPolarHBondContact O-CG 3.31Å; G300-L304 PolarHBondContact O-N 3.33Å; G300-L304 VanDerWaalsContact O-N 3.16Å
301I97.1Very high87.7Confident2 Ų266 Ų661%0.0136%0.355CS..Hα-helixtrans-67.8-41.9176.1-62.1172.1000111.3F155 D235 A239 A246 V250 Y253 R297 R298 E299 A303 L304 M305F155-I301 HydrophobicContact CE1-CD1 4.26Å; F155-I301 HydrophobicContact CE2-CD1 3.75Å; F155-I301 HydrophobicContact CZ-CD1 3.42Å; F155-I301 VanDerWaalsContact CZ-CD1 3.42Å; D235-I301 HydrophobicContact CB-CD1 4.37Å; A239-I301 HydrophobicContact CB-CG1 4.19Å; A239-I301 HydrophobicContact CB-CG2 3.94Å; A246-I301 HydrophobicContact CB-CG2 4.35Å; A246-I301 WeakPolarHBondContact O-CG2 3.31Å; V250-I301 HydrophobicContact CG2-CB 4.4Å; V250-I301 HydrophobicContact CG2-CG2 3.83Å; Y253-I301 HydrophobicContact CD2-CD1 3.9Å; Y253-I301 HydrophobicContact CE2-CD1 3.71Å; R297-I301 PolarHBondContact O-N 3.2Å; R298-I301 PolarHBondContact O-N 3.33Å; E299-I301 VanDerWaalsContact C-N 3.32Å; E299-I301 PolarHBondContact O-N 2.84Å; I301-A303 VanDerWaalsContact C-N 3.27Å; I301-A303 PolarHBondContact O-N 3.4Å; I301-L304 WeakPolarHBondContact O-CB 3.33Å; I301-L304 PolarHBondContact O-N 3.06Å; I301-M305 WeakPolarHBondContact O-CG 3.35Å; I301-M305 PolarHBondContact O-N 3.33Å
302L95.9Very high88.7Confident52 Ų5264.8 Ų64.827%0.27235%0.353SS..Hα-helixtrans-61.1-35.7175.8-75.7170.7000112.6V250 R298 E299 K306V250-L302 HydrophobicContact CG1-CD2 4Å; V250-L302 HydrophobicContact CG1-CG 4.35Å; V250-L302 HydrophobicContact CG2-CD2 3.66Å; V250-L302 HydrophobicContact CG2-CG 3.88Å; R298-L302 HydrophobicContact CG-CD1 4.37Å; R298-L302 PolarHBondContact O-N 3.37Å; E299-L302 PolarHBondContact O-N 3.28Å; L302-K306 WeakPolarHBondContact O-CG 3.44Å; L302-K306 PolarHBondContact O-N 3.32Å
303A94.7Very high89Confident42 Ų4268.3 Ų68.335%0.34737%0.371SS..Hα-helixtrans-65.5-46.9174.900000111.3E299 G300 I301 M305 K306 E307E299-A303 PolarHBondContact O-N 2.85Å; G300-A303 PolarHBondContact O-N 2.96Å; I301-A303 VanDerWaalsContact C-N 3.27Å; I301-A303 PolarHBondContact O-N 3.4Å; A303-M305 VanDerWaalsContact C-N 3.28Å; A303-M305 PolarHBondContact O-N 2.99Å; A303-K306 WeakPolarHBondContact O-CB 3.39Å; A303-K306 PolarHBondContact O-N 3.49Å; A303-E307 PolarHBondContact O-N 3.45Å
304L92.3Very high88.8Confident32 Ų3269.5 Ų69.517%0.16838%0.375CS..Hα-helixtrans-55.6-43.2175.4-66.5168.9000111.8K236 A239 G300 I301 K306 E307 E308K236-L304 HydrophobicContact CB-CD1 4.07Å; K236-L304 HydrophobicContact CD-CD1 4.46Å; K236-L304 HydrophobicContact CD-CD2 4.16Å; K236-L304 HydrophobicContact CG-CD1 3.8Å; K236-L304 HydrophobicContact CG-CD2 4.21Å; A239-L304 HydrophobicContact CB-CD1 4.48Å; G300-L304 WeakPolarHBondContact O-CG 3.31Å; G300-L304 PolarHBondContact O-N 3.33Å; G300-L304 VanDerWaalsContact O-N 3.16Å; I301-L304 WeakPolarHBondContact O-CB 3.33Å; I301-L304 PolarHBondContact O-N 3.06Å; L304-K306 PolarHBondContact O-N 2.9Å; L304-E307 PolarHBondContact O-N 3.49Å; L304-E308 PolarHBondContact O-N 3.32Å
305M91.4Very high88.4Confident30 Ų3071.7 Ų71.715%0.14839%0.39CS..Hα-helixtrans-66.1-22.4177.5-69.5179.970.400114.5A246 R247 V250 I301 A303A246-M305 HydrophobicContact CB-CG 3.55Å; A246-M305 HydrophobicContact CB-SD 3.94Å; R247-M305 HydrophobicContact CG-CE 3.66Å; V250-M305 HydrophobicContact CG2-SD 3.82Å; I301-M305 WeakPolarHBondContact O-CG 3.35Å; I301-M305 PolarHBondContact O-N 3.33Å; A303-M305 VanDerWaalsContact C-N 3.28Å; A303-M305 PolarHBondContact O-N 2.99Å
306K90.2Very high88Confident153 Ų15373.7 Ų73.767%0.66540%0.399SS*.Hα-helixtrans-83.8-39.4176-72.8175.2-178.4-179.50110.9L302 A303 L304 E308 K309L302-K306 WeakPolarHBondContact O-CG 3.44Å; L302-K306 PolarHBondContact O-N 3.32Å; A303-K306 WeakPolarHBondContact O-CB 3.39Å; A303-K306 PolarHBondContact O-N 3.49Å; L304-K306 PolarHBondContact O-N 2.9Å; K306-E308 VanDerWaalsContact C-N 3.34Å; K306-E308 PolarHBondContact O-N 3.04Å; K306-K309 PolarHBondContact O-N 3.06Å; K306-K309 VanDerWaalsContact O-N 3.15Å
307E84Confident87.5Confident131 Ų13176.4 Ų76.461%0.61241%0.409SS*.Hα-helixtrans-61.7-39.5176.9-70.6174.3-175.900111.8A303 L304 K309 A310A303-E307 PolarHBondContact O-N 3.45Å; L304-E307 PolarHBondContact O-N 3.49Å; E307-K309 PolarHBondContact O-N 2.92Å; E307-K309 VanDerWaalsContact O-N 3.17Å; E307-A310 PolarHBondContact O-N 3.29Å
308E74.8Confident86.7Confident114 Ų11481.8 Ų81.853%0.53344%0.439SS..THydrogen-bonded Turntrans-66.1-13.9175.7-73.6-177.8170.700114.7L304 K306L304-E308 PolarHBondContact O-N 3.32Å; K306-E308 VanDerWaalsContact C-N 3.34Å; K306-E308 PolarHBondContact O-N 3.04Å
309K64.1Low85.9Confident146 Ų14682.8 Ų82.864%0.63545%0.454SS*.THydrogen-bonded Turntrans-96.9-12.9179.2-69-179.6-177.4179.70113.5K306 E307K306-K309 PolarHBondContact O-N 3.06Å; K306-K309 VanDerWaalsContact O-N 3.15Å; E307-K309 PolarHBondContact O-N 2.92Å; E307-K309 VanDerWaalsContact O-N 3.17Å
310A53Low84.9Confident145 Ų14579.7 Ų79.7100%1.19845%0.445SS*.  trans-92.80-179.400000110.4E307E307-A310 PolarHBondContact O-N 3.29Å

Retrieved 310 of 310 residues in 169.6 ms (Link to these results)