A0A078BQE0_HUMAN Loading...

Rhesus blood group CE antigen

AlphaFold DB , UniProt , Accession A0A078BQE0, Species HUMAN (Homo sapiens, Human), Gene RHCE, Length 417 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
1M35.3Very low44.1Very low244 Ų244143.3 Ų143.3100%1.20268%0.679SS**  0114.70-82.5174.3158.900109.1S3M1-S3 PolarHBondContact O-N 3.27Å
2S27Very low45.6Very low116 Ų116137.2 Ų137.281%0.81166%0.661SS**  trans-58.8130.7176.7173.60000110.6K4S2-K4 PolarHBondContact O-N 3.33Å
3S36.2Very low47.4Very low76 Ų76129.9 Ų129.953%0.53163%0.628SS.*  trans-51.6104.8175.5166.10000110.5M1 Y5M1-S3 PolarHBondContact O-N 3.27Å; S3-Y5 PolarHBondContact O-N 3.2Å; S3-Y5 WeakPolarHBondContact OG-CB 3.45Å; S3-Y5 WeakPolarHBondContact OG-CD2 3.4Å
4K40.3Very low49.2Very low194 Ų194124.9 Ų124.984%0.84361%0.611SS**  trans-71.943.2168.7-68.1-175.7-179.4179.10111.1S2 K400S2-K4 PolarHBondContact O-N 3.33Å; K4-K400 PolarHBondContact O-NZ 3Å; K4-K400 VanDerWaalsContact O-NZ 3.11Å
5Y46.6Very low51.1Low65 Ų65124.3 Ų124.326%0.25561%0.611SS.*  trans-99.6115.9169.4-77.1-90.6000107.5S3 R7 Q405 L413S3-Y5 PolarHBondContact O-N 3.2Å; S3-Y5 WeakPolarHBondContact OG-CB 3.45Å; S3-Y5 WeakPolarHBondContact OG-CD2 3.4Å; Y5-R7 PolarHBondContact O-N 2.74Å; Y5-Q405 HydrophobicContact CE1-CB 4.21Å; Y5-Q405 WeakPolarHBondContact CE1-O 3.32Å; Y5-Q405 VanDerWaalsContact OH-CB 3.31Å; Y5-Q405 WeakPolarHBondContact OH-CB 3.21Å; Y5-Q405 PolarHBondContact OH-OE1 3.27Å; Y5-L413 HydrophobicContact CE2-CD2 4.1Å
6P46.1Very low53Low99 Ų99127.4 Ų127.464%0.64361%0.613SS**  trans-58.1130.3169.125.8-31.2000107.5S8P6-S8 PolarHBondContact O-N 3.23Å
7R48.7Very low54.8Low247 Ų247121.4 Ų121.493%0.93259%0.59SS**  trans-66.133.1179.7-74.2178.4169.6168.3-3.4112.9Y5 V9Y5-R7 PolarHBondContact O-N 2.74Å; R7-V9 PolarHBondContact O-N 3.29Å
8S50.9Low56.7Low40 Ų40121.6 Ų121.628%0.2859%0.594SS.*THydrogen-bonded Turntrans-83.7-5.9-146720000117P6P6-S8 PolarHBondContact O-N 3.23Å
9V52.5Low58.4Low43 Ų43119.3 Ų119.326%0.26159%0.587SS.*THydrogen-bonded Turntrans-114.1-14.9-171.9-162.70000113.7R7 R11 L13R7-V9 PolarHBondContact O-N 3.29Å; V9-R11 PolarHBondContact O-N 2.78Å; V9-L13 HydrophobicContact CG1-CB 3.46Å; V9-L13 VanDerWaalsContact CG1-CB 3.46Å; V9-L13 HydrophobicContact CG1-CD1 3.81Å; V9-L13 HydrophobicContact CG1-CD2 3.77Å; V9-L13 HydrophobicContact CG1-CG 3.89Å
10R50.5Low60.1Low234 Ų234115.4 Ų115.488%0.88357%0.569SS**THydrogen-bonded Turntrans-68.8-25.9-163-142.9-178-146.7-163.94.5116.5
11R51.3Low61.7Low218 Ų218113.2 Ų113.282%0.82356%0.557SS**THydrogen-bonded Turntrans-108.1-38.4179.7-87.9-172.7178.7174.6-0.6114V9 L15V9-R11 PolarHBondContact O-N 2.78Å; R11-L15 WeakPolarHBondContact O-CD1 3.3Å
12C61.9Low64.5Low70 Ų70103.9 Ų103.947%0.47352%0.519SS..Hα-helixtrans-76.6-54.5-172.6-137.60000111.4L15 W16C12-L15 PolarHBondContact O-N 3.41Å; C12-W16 PolarHBondContact O-N 2.78Å; C12-W16 PolarHBondContact SG-NE1 2.87Å
13L69.1Low67.7Low43 Ų43100.5 Ų100.523%0.22550%0.498CS..Hα-helixtrans-57.6-48.9-170.8-162.2105.1000114.9V9 L15 W16 A17 L136 A137V9-L13 HydrophobicContact CG1-CB 3.46Å; V9-L13 VanDerWaalsContact CG1-CB 3.46Å; V9-L13 HydrophobicContact CG1-CD1 3.81Å; V9-L13 HydrophobicContact CG1-CD2 3.77Å; V9-L13 HydrophobicContact CG1-CG 3.89Å; L13-L15 VanDerWaalsContact C-N 3.35Å; L13-L15 PolarHBondContact O-N 3.05Å; L13-W16 PolarHBondContact O-N 3.31Å; L13-A17 WeakPolarHBondContact O-CB 3.31Å; L13-A17 PolarHBondContact O-N 3.11Å; L13-L136 HydrophobicContact CD1-CB 3.89Å; L13-L136 HydrophobicContact CD2-CB 4.33Å; L13-L136 HydrophobicContact CD2-CD2 3.78Å; L13-L136 HydrophobicContact CG-CD2 4.48Å; L13-A137 HydrophobicContact CD1-CB 3.99Å
14P71.8Confident70.5Confident60 Ų6097.1 Ų97.139%0.3947%0.474SS..Hα-helixtrans-66.6-36178.824.7-33.1000112.4L18P14-L18 VanDerWaalsContact O-CB 3.32Å; P14-L18 WeakPolarHBondContact O-CB 3.33Å; P14-L18 WeakPolarHBondContact O-CG 3.22Å; P14-L18 PolarHBondContact O-N 3.44Å
15L78.4Confident73.1Confident116 Ų11692.8 Ų92.861%0.60746%0.459SS*.Hα-helixtrans-65.3-45.1175.9-96153.4000111.6R11 C12 L13 T19R11-L15 WeakPolarHBondContact O-CD1 3.3Å; C12-L15 PolarHBondContact O-N 3.41Å; L13-L15 VanDerWaalsContact C-N 3.35Å; L13-L15 PolarHBondContact O-N 3.05Å; L15-T19 WeakPolarHBondContact O-CB 3.35Å; L15-T19 WeakPolarHBondContact O-CG2 3.33Å; L15-T19 PolarHBondContact O-N 3.35Å; L15-T19 PolarHBondContact O-OG1 3.3Å
16W81.1Confident75.4Confident173 Ų17394.4 Ų94.466%0.65547%0.472SS*.Hα-helixtrans-64.1-42.8176.2-8099.2000112.5C12 L13 T19 L20C12-W16 PolarHBondContact O-N 2.78Å; C12-W16 PolarHBondContact SG-NE1 2.87Å; L13-W16 PolarHBondContact O-N 3.31Å; W16-T19 WeakPolarHBondContact CA-OG1 3.28Å; W16-T19 PolarHBondContact O-OG1 3.5Å; W16-L20 VanDerWaalsContact O-CB 3.32Å; W16-L20 WeakPolarHBondContact O-CB 3.42Å; W16-L20 PolarHBondContact O-N 3.23Å
17A84.6Confident77.6Confident26 Ų2692.2 Ų92.222%0.21545%0.454CS..Hα-helixtrans-64.9-45.617800000111.9L13 L20 E21 F82L13-A17 WeakPolarHBondContact O-CB 3.31Å; L13-A17 PolarHBondContact O-N 3.11Å; A17-L20 PolarHBondContact O-N 3.39Å; A17-E21 WeakPolarHBondContact O-CB 3.47Å; A17-E21 PolarHBondContact O-N 3.33Å; A17-F82 HydrophobicContact CB-CZ 4.35Å
18L88.3Confident79.7Confident125 Ų12582.4 Ų82.465%0.65442%0.418SS*.Hα-helixtrans-68.7-35.9179.5-69.8172.8000112.7P14 E21 A22P14-L18 VanDerWaalsContact O-CB 3.32Å; P14-L18 WeakPolarHBondContact O-CB 3.33Å; P14-L18 WeakPolarHBondContact O-CG 3.22Å; P14-L18 PolarHBondContact O-N 3.44Å; L18-E21 PolarHBondContact O-N 3.03Å; L18-A22 WeakPolarHBondContact O-CB 3.44Å; L18-A22 PolarHBondContact O-N 2.96Å
19T89.6Confident81.6Confident78 Ų7889.1 Ų89.148%0.47944%0.439SS..Hα-helixtrans-68.1-40.1175.347.40000111.8L15 W16 A22 A23L15-T19 WeakPolarHBondContact O-CB 3.35Å; L15-T19 WeakPolarHBondContact O-CG2 3.33Å; L15-T19 PolarHBondContact O-N 3.35Å; L15-T19 PolarHBondContact O-OG1 3.3Å; W16-T19 WeakPolarHBondContact CA-OG1 3.28Å; W16-T19 PolarHBondContact O-OG1 3.5Å; T19-A22 PolarHBondContact O-N 3.42Å; T19-A23 WeakPolarHBondContact O-CB 3.4Å; T19-A23 PolarHBondContact O-N 3.47Å
20L91.3Very high83.4Confident41 Ų4193 Ų9322%0.21545%0.452CS..Hα-helixtrans-63-45.4173.1-176.563.8000111.5W16 A17 A22 A23 L24 L86 V140 L144W16-L20 VanDerWaalsContact O-CB 3.32Å; W16-L20 WeakPolarHBondContact O-CB 3.42Å; W16-L20 PolarHBondContact O-N 3.23Å; A17-L20 PolarHBondContact O-N 3.39Å; L20-A22 PolarHBondContact O-N 3.46Å; L20-A23 WeakPolarHBondContact O-CB 3.31Å; L20-A23 PolarHBondContact O-N 3.2Å; L20-L24 HydrophobicContact CG-CD1 4.32Å; L20-L24 WeakPolarHBondContact O-CG 3.49Å; L20-L24 PolarHBondContact O-N 3.35Å; L20-L86 HydrophobicContact CD2-CD1 3.62Å; L20-L86 HydrophobicContact CD2-CD2 3.99Å; L20-L86 HydrophobicContact CD2-CG 4.47Å; L20-L86 HydrophobicContact CG-CD1 4.19Å; L20-V140 HydrophobicContact CD2-CG1 3.57Å; L20-L144 HydrophobicContact CD1-CD1 4.42Å; L20-L144 HydrophobicContact CD2-CD1 4.49Å
21E94.4Very high85.1Confident70 Ų7085.3 Ų85.333%0.32743%0.425SS..Hα-helixtrans-61.7-44.6177-168.366.1-157.400111.4A17 L18 A23 L24 I25 Q89A17-E21 WeakPolarHBondContact O-CB 3.47Å; A17-E21 PolarHBondContact O-N 3.33Å; L18-E21 PolarHBondContact O-N 3.03Å; E21-A23 VanDerWaalsContact C-N 3.3Å; E21-A23 PolarHBondContact O-N 2.93Å; E21-L24 PolarHBondContact O-N 3.42Å; E21-I25 HydrophobicContact CG-CD1 4.11Å; E21-I25 VanDerWaalsContact O-CG1 3.29Å; E21-I25 WeakPolarHBondContact O-CG1 3.34Å; E21-I25 PolarHBondContact O-N 3.25Å; E21-Q89 PolarHBondContact OE1-NE2 3.32Å; E21-Q89 PolarHBondContact OE2-OE1 2.72Å
22A94.7Very high86.9Confident48 Ų4876.1 Ų76.140%0.39739%0.393SS..Hα-helixtrans-60.4-40.417600000111.8L18 T19 L20 I25 L26L18-A22 WeakPolarHBondContact O-CB 3.44Å; L18-A22 PolarHBondContact O-N 2.96Å; T19-A22 PolarHBondContact O-N 3.42Å; L20-A22 PolarHBondContact O-N 3.46Å; A22-I25 PolarHBondContact O-N 2.93Å; A22-L26 WeakPolarHBondContact O-CG 3.4Å; A22-L26 PolarHBondContact O-N 2.8Å
23A94.3Very high88.2Confident45 Ų4576.5 Ų76.537%0.37239%0.388SS..Hα-helixtrans-64.2-43.2174.900000111.8T19 L20 E21 L26 L27T19-A23 WeakPolarHBondContact O-CB 3.4Å; T19-A23 PolarHBondContact O-N 3.47Å; L20-A23 WeakPolarHBondContact O-CB 3.31Å; L20-A23 PolarHBondContact O-N 3.2Å; E21-A23 VanDerWaalsContact C-N 3.3Å; E21-A23 PolarHBondContact O-N 2.93Å; A23-L26 PolarHBondContact O-N 3.5Å; A23-L27 VanDerWaalsContact O-CG 3.32Å; A23-L27 WeakPolarHBondContact O-CG 3.5Å; A23-L27 PolarHBondContact O-N 3.09Å
24L94.3Very high88.9Confident4 Ų483.2 Ų83.22%0.02141%0.412CS..Hα-helixtrans-62.4-45.4175.8-69.8170.6000111.1L20 E21 L26 L27 F28 L86 Q89 W90 L93L20-L24 HydrophobicContact CG-CD1 4.32Å; L20-L24 WeakPolarHBondContact O-CG 3.49Å; L20-L24 PolarHBondContact O-N 3.35Å; E21-L24 PolarHBondContact O-N 3.42Å; L24-L26 VanDerWaalsContact C-N 3.3Å; L24-L26 PolarHBondContact O-N 2.82Å; L24-L27 PolarHBondContact O-N 2.81Å; L24-L27 VanDerWaalsContact O-N 3.11Å; L24-F28 VanDerWaalsContact O-CD2 3.31Å; L24-F28 WeakPolarHBondContact O-CD2 3.48Å; L24-F28 PolarHBondContact O-N 3.27Å; L24-L86 HydrophobicContact CD1-CD1 3.59Å; L24-Q89 HydrophobicContact CD1-CB 4.3Å; L24-W90 HydrophobicContact CD2-CE3 4.09Å; L24-L93 HydrophobicContact CD2-CD1 3.6Å
25I95.1Very high89.2Confident103 Ų10383.7 Ų83.753%0.52841%0.411SS..Hα-helixtrans-56.4-45.5176.3-69.2165.7000111E21 A22 F28 Y29E21-I25 HydrophobicContact CG-CD1 4.11Å; E21-I25 VanDerWaalsContact O-CG1 3.29Å; E21-I25 WeakPolarHBondContact O-CG1 3.34Å; E21-I25 PolarHBondContact O-N 3.25Å; A22-I25 PolarHBondContact O-N 2.93Å; I25-F28 PolarHBondContact O-N 3.19Å; I25-Y29 WeakPolarHBondContact O-CB 3.44Å; I25-Y29 PolarHBondContact O-N 2.95Å
26L94.8Very high88.9Confident100 Ų10082.9 Ų82.952%0.52442%0.421SS..Hα-helixtrans-62.5-44176.7-71.1171.7000111.5A22 A23 L24 F28 Y29 F30A22-L26 WeakPolarHBondContact O-CG 3.4Å; A22-L26 PolarHBondContact O-N 2.8Å; A23-L26 PolarHBondContact O-N 3.5Å; L24-L26 VanDerWaalsContact C-N 3.3Å; L24-L26 PolarHBondContact O-N 2.82Å; L26-F28 PolarHBondContact O-N 3.12Å; L26-Y29 PolarHBondContact O-N 2.94Å; L26-F30 HydrophobicContact CD2-CE2 4.38Å; L26-F30 WeakPolarHBondContact O-CD2 3.33Å; L26-F30 PolarHBondContact O-N 3.49Å
27L92.4Very high88.3Confident53 Ų5377.8 Ų77.828%0.27741%0.412SS..Hα-helixtrans-61.8-43.4176.6-69.9173.1000111.8A23 L24 Y29 F30 F31 L93A23-L27 VanDerWaalsContact O-CG 3.32Å; A23-L27 WeakPolarHBondContact O-CG 3.5Å; A23-L27 PolarHBondContact O-N 3.09Å; L24-L27 PolarHBondContact O-N 2.81Å; L24-L27 VanDerWaalsContact O-N 3.11Å; L27-Y29 PolarHBondContact O-N 3.35Å; L27-F30 PolarHBondContact O-N 3.43Å; L27-F31 HydrophobicContact CB-CD2 4.46Å; L27-F31 HydrophobicContact CD2-CD2 3.89Å; L27-F31 HydrophobicContact CD2-CE2 3.75Å; L27-F31 WeakPolarHBondContact O-CB 3.26Å; L27-F31 WeakPolarHBondContact O-CD2 3.23Å; L27-F31 PolarHBondContact O-N 3.41Å; L27-L93 HydrophobicContact CB-CD1 3.8Å; L27-L93 HydrophobicContact CB-CD2 4.2Å; L27-L93 HydrophobicContact CD1-CD1 3.99Å
28F92.1Very high87.1Confident41 Ų4185.1 Ų85.118%0.1845%0.446CS..Hα-helixtrans-61.5-44.3175-90.4-98.1000111.5L24 I25 L26 F30 T32 Q89 I92 L93 I108L24-F28 VanDerWaalsContact O-CD2 3.31Å; L24-F28 WeakPolarHBondContact O-CD2 3.48Å; L24-F28 PolarHBondContact O-N 3.27Å; I25-F28 PolarHBondContact O-N 3.19Å; L26-F28 PolarHBondContact O-N 3.12Å; F28-F30 PolarHBondContact O-N 2.88Å; F28-T32 HydrophobicContact CB-CG2 4.46Å; F28-T32 HydrophobicContact CD1-CG2 3.72Å; F28-T32 WeakPolarHBondContact CD1-OG1 3.27Å; F28-T32 HydrophobicContact CE1-CG2 4.15Å; F28-T32 HydrophobicContact CG-CG2 4.14Å; F28-T32 WeakPolarHBondContact O-CB 3.26Å; F28-T32 PolarHBondContact O-N 2.78Å; F28-T32 PolarHBondContact O-OG1 3.49Å; F28-Q89 HydrophobicContact CE2-CB 4.07Å; F28-Q89 WeakPolarHBondContact CE2-O 3.46Å; F28-Q89 HydrophobicContact CZ-CB 4.35Å; F28-I92 HydrophobicContact CE1-CG2 4.03Å; F28-I92 HydrophobicContact CZ-CB 4.09Å; F28-I92 HydrophobicContact CZ-CD1 4.46Å; F28-I92 HydrophobicContact CZ-CG2 4.03Å; F28-L93 HydrophobicContact CD2-CD1 3.81Å; F28-L93 HydrophobicContact CD2-CD2 3.85Å; F28-L93 HydrophobicContact CD2-CG 3.91Å; F28-L93 HydrophobicContact CE2-CD1 3.62Å; F28-L93 HydrophobicContact CE2-CD2 3.89Å; F28-L93 HydrophobicContact CE2-CG 3.51Å; F28-L93 HydrophobicContact CG-CD2 4.32Å; F28-L93 HydrophobicContact CZ-CD2 4.37Å; F28-L93 HydrophobicContact CZ-CG 4.08Å; F28-I108 HydrophobicContact CD1-CD1 4.11Å; F28-I108 HydrophobicContact CE1-CD1 3.95Å
29Y91.5Very high85.9Confident181 Ų18183 Ų8371%0.7143%0.433SS*.Hα-helixtrans-58.6-43.9178.2175.9-100.5000112.8I25 L26 L27I25-Y29 WeakPolarHBondContact O-CB 3.44Å; I25-Y29 PolarHBondContact O-N 2.95Å; L26-Y29 PolarHBondContact O-N 2.94Å; L27-Y29 PolarHBondContact O-N 3.35Å
30F89.4Confident85.1Confident123 Ų12384.7 Ų84.754%0.53944%0.439SS..Hα-helixtrans-82.4-37.5-177-73.1-65.5000113.8L26 L27 F28L26-F30 HydrophobicContact CD2-CE2 4.38Å; L26-F30 WeakPolarHBondContact O-CD2 3.33Å; L26-F30 PolarHBondContact O-N 3.49Å; L27-F30 PolarHBondContact O-N 3.43Å; F28-F30 PolarHBondContact O-N 2.88Å
31F87.9Confident84.4Confident74 Ų7490 Ų9033%0.32546%0.463SS..Hα-helixtrans-109.5-6.4-166.4-63.2-74.3000114.6L27 F97 K105 V106L27-F31 HydrophobicContact CB-CD2 4.46Å; L27-F31 HydrophobicContact CD2-CD2 3.89Å; L27-F31 HydrophobicContact CD2-CE2 3.75Å; L27-F31 WeakPolarHBondContact O-CB 3.26Å; L27-F31 WeakPolarHBondContact O-CD2 3.23Å; L27-F31 PolarHBondContact O-N 3.41Å; F31-F97 HydrophobicContact CB-CE1 3.97Å; F31-F97 HydrophobicContact CB-CZ 4.21Å; F31-F97 AromaticContact CD1-CE1 3.96Å; F31-F97 HydrophobicContact CD1-CE1 3.96Å; F31-F97 HydrophobicContact CD2-CE1 4.25Å; F31-F97 HydrophobicContact CD2-CZ 4.02Å; F31-F97 AromaticContact CG-CE1 3.79Å; F31-F97 HydrophobicContact CG-CE1 3.79Å; F31-F97 HydrophobicContact CG-CZ 4Å; F31-K105 CarbonylContact O-C 3.6Å; F31-K105 WeakPolarHBondContact O-CA 3.22Å; F31-V106 WeakPolarHBondContact O-CB 3.46Å; F31-V106 WeakPolarHBondContact O-CG2 3.37Å; F31-V106 PolarHBondContact O-N 2.87Å
32T88.4Confident83.4Confident24 Ų2494.9 Ų94.915%0.14748%0.483CS..EExtended strand (participates in β ladder)trans-119.2151.7-176.573.60000113.1F28 L93 V106 I108F28-T32 HydrophobicContact CB-CG2 4.46Å; F28-T32 HydrophobicContact CD1-CG2 3.72Å; F28-T32 WeakPolarHBondContact CD1-OG1 3.27Å; F28-T32 HydrophobicContact CE1-CG2 4.15Å; F28-T32 HydrophobicContact CG-CG2 4.14Å; F28-T32 WeakPolarHBondContact O-CB 3.26Å; F28-T32 PolarHBondContact O-N 2.78Å; F28-T32 PolarHBondContact O-OG1 3.49Å; T32-L93 HydrophobicContact CG2-CD2 3.84Å; T32-V106 WeakPolarHBondContact CA-O 3.47Å; T32-V106 HydrophobicContact CG2-CB 4.2Å; T32-I108 HydrophobicContact CG2-CD1 4.22Å
33H88.3Confident82.4Confident78 Ų7894.1 Ų94.136%0.36148%0.48SS..EExtended strand (participates in β ladder)trans-148.3156.616866.5-63.3000110.2V106 V107 I108H33-V106 PolarHBondContact N-O 3.48Å; H33-V106 PolarHBondContact ND1-O 3.01Å; H33-V106 VanDerWaalsContact ND1-O 3.17Å; H33-V107 WeakPolarHBondContact CE1-CG2 3.27Å; H33-I108 PolarHBondContact O-N 3.38Å
34Y84.9Confident81.7Confident185 Ų18595.7 Ų95.773%0.72548%0.482SS*.EExtended strand (participates in β ladder)trans-78.6144.3174.9-66.2-65000110.9A36 I108Y34-A36 PolarHBondContact O-N 2.94Å; Y34-I108 HydrophobicContact CD1-CB 4.12Å; Y34-I108 HydrophobicContact CD1-CG2 4.24Å; Y34-I108 HydrophobicContact CE1-CB 4.41Å; Y34-I108 HydrophobicContact CE1-CD1 4.41Å; Y34-I108 HydrophobicContact CE1-CG2 4.21Å
35D78.8Confident81.1Confident70 Ų7098.9 Ų98.937%0.37450%0.501SS..  trans-63.3130.1166.8-168.53.5000109.7S37 V107 I108 T109D35-S37 VanDerWaalsContact C-N 3.33Å; D35-S37 VanDerWaalsContact CG-OG 3.22Å; D35-S37 WeakPolarHBondContact OD1-CB 3.28Å; D35-S37 PolarHBondContact OD1-N 3.27Å; D35-S37 PolarHBondContact OD1-OG 3.22Å; D35-S37 PolarHBondContact OD2-OG 2.79Å; D35-V107 HydrophobicContact CB-CG1 3.71Å; D35-I108 PolarHBondContact N-O 3.28Å; D35-T109 HydrophobicContact CB-CG2 4.2Å
36A70.8Confident80.4Confident99 Ų9996 Ų9682%0.81849%0.493SS*.  trans-910.3177.900000112.3Y34Y34-A36 PolarHBondContact O-N 2.94Å
37S69.8Low79.7Confident65 Ų6592.5 Ų92.546%0.45548%0.476SS..  trans-66.4134.6-179.176.70000112.1D35 E39D35-S37 VanDerWaalsContact C-N 3.33Å; D35-S37 VanDerWaalsContact CG-OG 3.22Å; D35-S37 WeakPolarHBondContact OD1-CB 3.28Å; D35-S37 PolarHBondContact OD1-N 3.27Å; D35-S37 PolarHBondContact OD1-OG 3.22Å; D35-S37 PolarHBondContact OD2-OG 2.79Å; S37-E39 PolarHBondContact O-N 3.38Å; S37-E39 VanDerWaalsContact O-N 3.08Å
38L58.8Low79.3Confident180 Ų18096.2 Ų96.294%0.94249%0.488SS*.  trans-74.892.7172-84.4157.9000108.6
39E63.3Low79.2Confident82 Ų8299.2 Ų99.238%0.38350%0.502SS..  trans-64.9140.4171.2-77.3-169.2171.400110.9S37 Q41 L44S37-E39 PolarHBondContact O-N 3.38Å; S37-E39 VanDerWaalsContact O-N 3.08Å; E39-Q41 PolarHBondContact O-N 3.42Å; E39-L44 HydrophobicContact CB-CB 4.49Å; E39-L44 HydrophobicContact CB-CD1 4.42Å; E39-L44 VanDerWaalsContact OE2-CD1 3.24Å; E39-L44 WeakPolarHBondContact OE2-CD1 3.35Å
40D72.6Confident78.9Confident112 Ų11291.4 Ų91.460%0.59947%0.473SS*.  trans-54.7129.9169.6171.538.5000110.2K42 G43 L44D40-K42 PolarHBondContact O-N 3.27Å; D40-K42 VanDerWaalsContact O-N 3.12Å; D40-G43 WeakPolarHBondContact O-CA 3.47Å; D40-G43 PolarHBondContact O-N 2.8Å; D40-L44 PolarHBondContact O-N 3.05Å
41Q75Confident78.9Confident154 Ų15486.2 Ų86.272%0.7246%0.455SS*.Hα-helixtrans-56.7-35.2-173.3-170.8-180-6.200112.3E39 V45E39-Q41 PolarHBondContact O-N 3.42Å; Q41-V45 VanDerWaalsContact O-CG2 3.32Å; Q41-V45 WeakPolarHBondContact O-CG2 3.47Å; Q41-V45 PolarHBondContact O-N 3.49Å; Q41-V45 VanDerWaalsContact O-N 3.12Å
42K74Confident79Confident172 Ų17286.7 Ų86.775%0.74846%0.458SS*.Hα-helixtrans-70.2-42176.4-68.4178.4179.9174.40111.9D40 L44 A46D40-K42 PolarHBondContact O-N 3.27Å; D40-K42 VanDerWaalsContact O-N 3.12Å; K42-L44 VanDerWaalsContact C-N 3.35Å; K42-A46 WeakPolarHBondContact O-CB 3.48Å; K42-A46 PolarHBondContact O-N 3.38Å; K42-A46 VanDerWaalsContact O-N 3.12Å
43G74.9Confident79.3Confident32 Ų3287.3 Ų87.333%0.3346%0.46SS..Hα-helixtrans-60-43.9174.100000112.2D40 S47D40-G43 WeakPolarHBondContact O-CA 3.47Å; D40-G43 PolarHBondContact O-N 2.8Å; G43-S47 WeakPolarHBondContact O-CB 3.39Å; G43-S47 PolarHBondContact O-N 2.86Å; G43-S47 PolarHBondContact O-OG 2.91Å
44L77.9Confident79.4Confident78 Ų7883.6 Ų83.641%0.40844%0.443SS..Hα-helixtrans-61.8-48.3178.1-173.376.7000112E39 D40 K42 S47 Y48 L110E39-L44 HydrophobicContact CB-CB 4.49Å; E39-L44 HydrophobicContact CB-CD1 4.42Å; E39-L44 VanDerWaalsContact OE2-CD1 3.24Å; E39-L44 WeakPolarHBondContact OE2-CD1 3.35Å; D40-L44 PolarHBondContact O-N 3.05Å; K42-L44 VanDerWaalsContact C-N 3.35Å; L44-S47 WeakPolarHBondContact O-CB 3.46Å; L44-S47 PolarHBondContact O-N 3.26Å; L44-Y48 WeakPolarHBondContact O-CB 3.2Å; L44-Y48 PolarHBondContact O-N 3.47Å; L44-L110 HydrophobicContact CD1-CD1 3.48Å; L44-L110 VanDerWaalsContact CD1-CD1 3.48Å; L44-L110 HydrophobicContact CD1-CG 4.47Å; L44-L110 HydrophobicContact CG-CD1 4.35Å
45V83.1Confident79.8Confident71 Ų7177.8 Ų77.843%0.4343%0.427SS..Hα-helixtrans-63-47.7179.7171.10000111.4Q41 S47 Y48 Q49Q41-V45 VanDerWaalsContact O-CG2 3.32Å; Q41-V45 WeakPolarHBondContact O-CG2 3.47Å; Q41-V45 PolarHBondContact O-N 3.49Å; Q41-V45 VanDerWaalsContact O-N 3.12Å; V45-S47 VanDerWaalsContact C-N 3.25Å; V45-S47 PolarHBondContact O-N 3.22Å; V45-Y48 PolarHBondContact O-N 2.9Å; V45-Q49 WeakPolarHBondContact O-CG 3.32Å; V45-Q49 PolarHBondContact O-N 2.98Å
46A80.1Confident80.5Confident42 Ų4276.5 Ų76.535%0.34742%0.422SS..Hα-helixtrans-61.4-39.9177.600000111.2K42 V50K42-A46 WeakPolarHBondContact O-CB 3.48Å; K42-A46 PolarHBondContact O-N 3.38Å; K42-A46 VanDerWaalsContact O-N 3.12Å; A46-V50 WeakPolarHBondContact O-CG2 3.46Å; A46-V50 PolarHBondContact O-N 2.92Å
47S79Confident81.5Confident26 Ų2672.2 Ų72.218%0.18239%0.385CS..Hα-helixtrans-63-42.6176.8-88.30000113.5G43 L44 V45 G51 R114G43-S47 WeakPolarHBondContact O-CB 3.39Å; G43-S47 PolarHBondContact O-N 2.86Å; G43-S47 PolarHBondContact O-OG 2.91Å; L44-S47 WeakPolarHBondContact O-CB 3.46Å; L44-S47 PolarHBondContact O-N 3.26Å; V45-S47 VanDerWaalsContact C-N 3.25Å; V45-S47 PolarHBondContact O-N 3.22Å; S47-G51 PolarHBondContact O-N 2.96Å; S47-R114 VanDerWaalsContact CA-CZ 3.44Å; S47-R114 PolarHBondContact O-NE 3.27Å; S47-R114 PolarHBondContact O-NH2 3.17Å; S47-R114 PolarHBondContact OG-NH2 3.49Å
48Y84.4Confident82.6Confident131 Ų13169.1 Ų69.151%0.51436%0.363SS..Hα-helixtrans-66.5-44.9177.9177-105000111.7L44 V45 V50 G51 Q52L44-Y48 WeakPolarHBondContact O-CB 3.2Å; L44-Y48 PolarHBondContact O-N 3.47Å; V45-Y48 PolarHBondContact O-N 2.9Å; Y48-V50 PolarHBondContact O-N 3.41Å; Y48-G51 CarbonylContact O-C 3.37Å; Y48-G51 WeakPolarHBondContact O-CA 3.41Å; Y48-G51 PolarHBondContact O-N 3.09Å; Y48-Q52 HydrophobicContact CD1-CG 4.17Å; Y48-Q52 HydrophobicContact CE1-CG 3.78Å; Y48-Q52 VanDerWaalsContact CE1-OE1 3.3Å; Y48-Q52 HydrophobicContact CE2-CG 4.24Å; Y48-Q52 VanDerWaalsContact CZ-NE2 3.34Å; Y48-Q52 WeakPolarHBondContact O-CG 3.32Å; Y48-Q52 PolarHBondContact O-N 3.49Å; Y48-Q52 PolarHBondContact OH-NE2 3.37Å
49Q89.4Confident84.2Confident104 Ų10461.5 Ų61.549%0.48633%0.326SS..Hα-helixtrans-56.1-48.1178-74.6173.2-1600112.2V45 G51 Q52 D53V45-Q49 WeakPolarHBondContact O-CG 3.32Å; V45-Q49 PolarHBondContact O-N 2.98Å; Q49-G51 VanDerWaalsContact C-N 3.27Å; Q49-G51 PolarHBondContact O-N 3.32Å; Q49-Q52 WeakPolarHBondContact O-CB 3.41Å; Q49-Q52 PolarHBondContact O-N 3.48Å; Q49-Q52 VanDerWaalsContact O-N 3.11Å; Q49-D53 PolarHBondContact O-N 3.28Å
50V87.2Confident85.6Confident17 Ų1760.3 Ų60.310%0.10332%0.322CS..Hα-helixtrans-61.4-38.1176.6177.40000111.2A46 Y48 D53 L54 A226A46-V50 WeakPolarHBondContact O-CG2 3.46Å; A46-V50 PolarHBondContact O-N 2.92Å; Y48-V50 PolarHBondContact O-N 3.41Å; V50-D53 PolarHBondContact O-N 3Å; V50-L54 WeakPolarHBondContact O-CG 3.32Å; V50-L54 PolarHBondContact O-N 2.96Å; V50-L54 VanDerWaalsContact O-N 3.12Å; V50-A226 HydrophobicContact CG1-CB 3.61Å
51G87.4Confident86.4Confident15 Ų1555 Ų5516%0.15529%0.293CS..Hα-helixtrans-63.8-39.417500000113.2S47 Y48 Q49 T55S47-G51 PolarHBondContact O-N 2.96Å; Y48-G51 CarbonylContact O-C 3.37Å; Y48-G51 WeakPolarHBondContact O-CA 3.41Å; Y48-G51 PolarHBondContact O-N 3.09Å; Q49-G51 VanDerWaalsContact C-N 3.27Å; Q49-G51 PolarHBondContact O-N 3.32Å; G51-T55 WeakPolarHBondContact O-CB 3.38Å; G51-T55 PolarHBondContact O-N 2.95Å; G51-T55 VanDerWaalsContact O-N 3.09Å; G51-T55 PolarHBondContact O-OG1 3.4Å
52Q91.6Very high87.1Confident83 Ų8348.2 Ų48.239%0.38826%0.262SS..Hα-helixtrans-63.7-47174.8-68.5-174.5-57.900111.4Y48 Q49 L54 T55 V56Y48-Q52 HydrophobicContact CD1-CG 4.17Å; Y48-Q52 HydrophobicContact CE1-CG 3.78Å; Y48-Q52 VanDerWaalsContact CE1-OE1 3.3Å; Y48-Q52 HydrophobicContact CE2-CG 4.24Å; Y48-Q52 VanDerWaalsContact CZ-NE2 3.34Å; Y48-Q52 WeakPolarHBondContact O-CG 3.32Å; Y48-Q52 PolarHBondContact O-N 3.49Å; Y48-Q52 PolarHBondContact OH-NE2 3.37Å; Q49-Q52 WeakPolarHBondContact O-CB 3.41Å; Q49-Q52 PolarHBondContact O-N 3.48Å; Q49-Q52 VanDerWaalsContact O-N 3.11Å; Q52-L54 VanDerWaalsContact C-N 3.33Å; Q52-L54 PolarHBondContact O-N 3.25Å; Q52-T55 PolarHBondContact O-N 3.26Å; Q52-T55 VanDerWaalsContact O-N 3.1Å; Q52-V56 WeakPolarHBondContact O-CB 3.26Å; Q52-V56 WeakPolarHBondContact O-CG2 3.48Å; Q52-V56 PolarHBondContact O-N 3.26Å
53D93.1Very high87.7Confident37 Ų3740 Ų4020%0.19823%0.227CC..Hα-helixtrans-56.6-47178.8-67.2-8.9000111.5Q49 V50 T55 V56 M57 F219 S222Q49-D53 PolarHBondContact O-N 3.28Å; V50-D53 PolarHBondContact O-N 3Å; D53-T55 VanDerWaalsContact C-N 3.33Å; D53-T55 PolarHBondContact O-N 2.82Å; D53-V56 PolarHBondContact O-N 2.97Å; D53-M57 VanDerWaalsContact O-CB 3.32Å; D53-M57 WeakPolarHBondContact O-CB 3.48Å; D53-M57 PolarHBondContact O-N 3.48Å; D53-F219 HydrophobicContact CB-CB 4.49Å; D53-F219 HydrophobicContact CB-CD1 3.65Å; D53-F219 HydrophobicContact CB-CE1 4.29Å; D53-F219 HydrophobicContact CB-CG 4.38Å; D53-F219 VanDerWaalsContact CG-CD1 3.48Å; D53-F219 WeakPolarHBondContact OD1-CD1 3.45Å; D53-F219 VanDerWaalsContact OD1-CE1 3.22Å; D53-F219 WeakPolarHBondContact OD1-CE1 3.47Å; D53-S222 WeakPolarHBondContact OD2-CB 3.39Å; D53-S222 PolarHBondContact OD2-OG 2.7Å
54L91.9Very high88.3Confident0 Ų041.3 Ų41.30%022%0.223CC..Hα-helixtrans-59.9-43.5176.3-69.4179.5000111.9V50 Q52 M57 A58 R114 T117 M118 M121 V223 A226V50-L54 WeakPolarHBondContact O-CG 3.32Å; V50-L54 PolarHBondContact O-N 2.96Å; V50-L54 VanDerWaalsContact O-N 3.12Å; Q52-L54 VanDerWaalsContact C-N 3.33Å; Q52-L54 PolarHBondContact O-N 3.25Å; L54-M57 PolarHBondContact O-N 3.17Å; L54-A58 VanDerWaalsContact O-CB 3.31Å; L54-A58 WeakPolarHBondContact O-CB 3.25Å; L54-A58 PolarHBondContact O-N 3.36Å; L54-R114 HydrophobicContact CD1-CB 3.89Å; L54-R114 HydrophobicContact CD1-CG 4.03Å; L54-T117 HydrophobicContact CB-CG2 3.89Å; L54-M118 HydrophobicContact CD1-CG 4.26Å; L54-M118 HydrophobicContact CD1-SD 4.36Å; L54-M118 HydrophobicContact CD2-SD 3.67Å; L54-M121 HydrophobicContact CD2-CE 3.93Å; L54-V223 HydrophobicContact CD2-CB 4.22Å; L54-V223 HydrophobicContact CD2-CG1 4.48Å; L54-V223 HydrophobicContact CD2-CG2 3.86Å; L54-A226 HydrophobicContact CD1-CB 3.94Å; L54-A226 HydrophobicContact CD2-CB 4.16Å; L54-A226 HydrophobicContact CG-CB 4.36Å
55T92.4Very high88.5Confident64 Ų6437.9 Ų37.939%0.39321%0.205SC..Hα-helixtrans-69-42.9-177.9-54.30000111.5G51 Q52 D53 M57 A58 A59G51-T55 WeakPolarHBondContact O-CB 3.38Å; G51-T55 PolarHBondContact O-N 2.95Å; G51-T55 VanDerWaalsContact O-N 3.09Å; G51-T55 PolarHBondContact O-OG1 3.4Å; Q52-T55 PolarHBondContact O-N 3.26Å; Q52-T55 VanDerWaalsContact O-N 3.1Å; D53-T55 VanDerWaalsContact C-N 3.33Å; D53-T55 PolarHBondContact O-N 2.82Å; T55-M57 VanDerWaalsContact C-N 3.32Å; T55-M57 PolarHBondContact O-N 3.37Å; T55-A58 PolarHBondContact O-N 3Å; T55-A59 VanDerWaalsContact O-CB 3.28Å; T55-A59 WeakPolarHBondContact O-CB 3.49Å; T55-A59 PolarHBondContact O-N 3.46Å
56V94.3Very high88Confident43 Ų4335.3 Ų35.326%0.26119%0.189SC..Hα-helixtrans-61.1-44.7175.5167.90000110Q52 D53 I60 G61 F215 F219Q52-V56 WeakPolarHBondContact O-CB 3.26Å; Q52-V56 WeakPolarHBondContact O-CG2 3.48Å; Q52-V56 PolarHBondContact O-N 3.26Å; D53-V56 PolarHBondContact O-N 2.97Å; V56-I60 HydrophobicContact CG1-CD1 4.37Å; V56-I60 WeakPolarHBondContact O-CA 3.38Å; V56-I60 WeakPolarHBondContact O-CB 3.13Å; V56-I60 PolarHBondContact O-N 2.91Å; V56-G61 PolarHBondContact O-N 3.08Å; V56-F215 HydrophobicContact CG1-CD1 3.52Å; V56-F215 HydrophobicContact CG1-CE1 3.86Å; V56-F219 HydrophobicContact CG1-CD2 3.92Å; V56-F219 HydrophobicContact CG1-CE2 3.68Å; V56-F219 HydrophobicContact CG1-CZ 4.33Å
57M92Very high87.6Confident8 Ų833.3 Ų33.34%0.03917%0.173CC..Iπ-helixtrans-65.1-41.6178.6-164.9-168.367.200112.3D53 L54 T55 G61 L62 M121 L216 F219 V223D53-M57 VanDerWaalsContact O-CB 3.32Å; D53-M57 WeakPolarHBondContact O-CB 3.48Å; D53-M57 PolarHBondContact O-N 3.48Å; L54-M57 PolarHBondContact O-N 3.17Å; T55-M57 VanDerWaalsContact C-N 3.32Å; T55-M57 PolarHBondContact O-N 3.37Å; M57-G61 CarbonylContact O-C 3.52Å; M57-G61 WeakPolarHBondContact O-CA 3.49Å; M57-G61 PolarHBondContact O-N 2.92Å; M57-L62 PolarHBondContact O-N 3.44Å; M57-M121 HydrophobicContact CE-CE 3.9Å; M57-M121 HydrophobicContact CE-SD 3.19Å; M57-M121 WeakPolarHBondContact CE-SD 3.23Å; M57-L216 HydrophobicContact CE-CD2 4.41Å; M57-L216 HydrophobicContact CG-CD2 3.4Å; M57-L216 VanDerWaalsContact CG-CD2 3.4Å; M57-L216 HydrophobicContact CG-CG 4.22Å; M57-L216 HydrophobicContact SD-CD2 3.66Å; M57-F219 HydrophobicContact CB-CB 4.2Å; M57-V223 HydrophobicContact CE-CB 4.26Å; M57-V223 HydrophobicContact CE-CG1 4.19Å; M57-V223 HydrophobicContact CE-CG2 3.1Å; M57-V223 HydrophobicContact SD-CB 4.49Å; M57-V223 HydrophobicContact SD-CG2 3.19Å; M57-V223 WeakPolarHBondContact SD-CG2 3.15Å
58A92.3Very high86.8Confident0 Ų034.7 Ų34.70%018%0.183CC..Iπ-helixtrans-67.5-49.8178.200000112L54 T55 L84 M121 L124L54-A58 VanDerWaalsContact O-CB 3.31Å; L54-A58 WeakPolarHBondContact O-CB 3.25Å; L54-A58 PolarHBondContact O-N 3.36Å; T55-A58 PolarHBondContact O-N 3Å; A58-L84 HydrophobicContact CB-CD1 3.7Å; A58-L84 HydrophobicContact CB-CD2 3.59Å; A58-L84 HydrophobicContact CB-CG 4.27Å; A58-M121 HydrophobicContact CB-CG 3.58Å; A58-M121 HydrophobicContact CB-SD 3.92Å; A58-L124 HydrophobicContact CB-CD1 3.89Å; A58-L124 WeakPolarHBondContact O-CD1 3.16Å
59A92.5Very high85.8Confident20 Ų2032.8 Ų32.817%0.16518%0.177CC..Iπ-helixtrans-75.7-50.1-174.100000112.7T55 L81 L84T55-A59 VanDerWaalsContact O-CB 3.28Å; T55-A59 WeakPolarHBondContact O-CB 3.49Å; T55-A59 PolarHBondContact O-N 3.46Å; A59-L81 HydrophobicContact CB-CD1 4.16Å; A59-L84 HydrophobicContact CB-CD2 3.91Å
60I92Very high84.6Confident58 Ų5833.3 Ų33.330%0.29718%0.175SC..Iπ-helixtrans-91-51.6-175.9-55.7-179000109.8V56 F64 F215V56-I60 HydrophobicContact CG1-CD1 4.37Å; V56-I60 WeakPolarHBondContact O-CA 3.38Å; V56-I60 WeakPolarHBondContact O-CB 3.13Å; V56-I60 PolarHBondContact O-N 2.91Å; I60-F64 HydrophobicContact CG2-CD2 3.85Å; I60-F64 HydrophobicContact CG2-CE2 4.24Å; I60-F64 VanDerWaalsContact O-CB 3.29Å; I60-F64 WeakPolarHBondContact O-CB 3.29Å; I60-F64 WeakPolarHBondContact O-CD2 3.27Å; I60-F64 PolarHBondContact O-N 2.99Å; I60-F215 HydrophobicContact CB-CG 4.44Å; I60-F215 HydrophobicContact CG2-CB 4.46Å; I60-F215 HydrophobicContact CG2-CD1 4.36Å; I60-F215 HydrophobicContact CG2-CD2 3.57Å; I60-F215 HydrophobicContact CG2-CE2 3.82Å; I60-F215 HydrophobicContact CG2-CG 3.87Å; I60-F215 HydrophobicContact CG2-CZ 4.33Å
61G90.8Very high83.6Confident0 Ų037.3 Ų37.30%019%0.188CC..Iπ-helixtrans-56.7-66.6-176.400000112.8V56 M57 L65 G212V56-G61 PolarHBondContact O-N 3.08Å; M57-G61 CarbonylContact O-C 3.52Å; M57-G61 WeakPolarHBondContact O-CA 3.49Å; M57-G61 PolarHBondContact O-N 2.92Å; G61-L65 VanDerWaalsContact O-CB 3.26Å; G61-L65 WeakPolarHBondContact O-CB 3.32Å; G61-L65 PolarHBondContact O-N 3.03Å; G61-G212 WeakPolarHBondContact CA-O 3.14Å; G61-G212 VanDerWaalsContact O-CA 3.27Å; G61-G212 WeakPolarHBondContact O-CA 3.4Å
62L88.6Confident82.9Confident12 Ų1236.7 Ų36.76%0.06318%0.181CC..Iπ-helixtrans-67.9-36.9-180-64.6175000112.4M57 F64 L65 T66 M121 L124 I125 L216M57-L62 PolarHBondContact O-N 3.44Å; L62-F64 PolarHBondContact O-N 3.26Å; L62-L65 HydrophobicContact CD2-CD2 4.47Å; L62-L65 PolarHBondContact O-N 3.26Å; L62-T66 PolarHBondContact O-N 2.61Å; L62-T66 PolarHBondContact O-OG1 2.72Å; L62-M121 HydrophobicContact CD1-CB 4.48Å; L62-M121 HydrophobicContact CD1-CG 4.46Å; L62-L124 HydrophobicContact CB-CB 4.29Å; L62-L124 HydrophobicContact CB-CD1 4.38Å; L62-L124 HydrophobicContact CD1-CB 3.6Å; L62-L124 HydrophobicContact CD1-CD1 3.98Å; L62-L124 HydrophobicContact CD1-CG 4.44Å; L62-I125 HydrophobicContact CD1-CG1 4.21Å; L62-I125 HydrophobicContact CD2-CG1 4.41Å; L62-L216 HydrophobicContact CD2-CD1 4.21Å; L62-L216 HydrophobicContact CD2-CD2 3.83Å; L62-L216 HydrophobicContact CG-CD2 4.07Å
63G86.6Confident82.2Confident0 Ų034.2 Ų34.20%017%0.173CC..Hα-helixtrans-59.3-44.1179.100000113.9S76G63-S76 PolarHBondContact O-OG 2.96Å
64F87.3Confident81.7Confident58 Ų5839.8 Ų39.825%0.25419%0.191SC..Hα-helixtrans-83.4-29.3177.1-82-87.7000112.9I60 L62 T66 S67 V77 S208 A209I60-F64 HydrophobicContact CG2-CD2 3.85Å; I60-F64 HydrophobicContact CG2-CE2 4.24Å; I60-F64 VanDerWaalsContact O-CB 3.29Å; I60-F64 WeakPolarHBondContact O-CB 3.29Å; I60-F64 WeakPolarHBondContact O-CD2 3.27Å; I60-F64 PolarHBondContact O-N 2.99Å; L62-F64 PolarHBondContact O-N 3.26Å; F64-T66 VanDerWaalsContact C-N 3.27Å; F64-T66 PolarHBondContact O-N 3.48Å; F64-S67 WeakPolarHBondContact O-CB 3.41Å; F64-S67 PolarHBondContact O-N 3.38Å; F64-S67 PolarHBondContact O-OG 3.1Å; F64-V77 HydrophobicContact CD1-CG2 4.15Å; F64-V77 HydrophobicContact CD2-CG2 4.19Å; F64-V77 HydrophobicContact CE1-CG2 4.11Å; F64-V77 HydrophobicContact CE2-CG1 4.18Å; F64-V77 HydrophobicContact CE2-CG2 4.15Å; F64-V77 HydrophobicContact CG-CG2 4.2Å; F64-V77 HydrophobicContact CZ-CG2 4.11Å; F64-S208 WeakPolarHBondContact CB-O 3.28Å; F64-A209 WeakPolarHBondContact O-CA 3.3Å
65L81.9Confident81.4Confident7 Ų739.8 Ų39.84%0.03719%0.191CC..Hα-helixtrans-57.7-41178-173.874.1000111.8G61 L62 S67 A213 L216 L275 M328G61-L65 VanDerWaalsContact O-CB 3.26Å; G61-L65 WeakPolarHBondContact O-CB 3.32Å; G61-L65 PolarHBondContact O-N 3.03Å; L62-L65 HydrophobicContact CD2-CD2 4.47Å; L62-L65 PolarHBondContact O-N 3.26Å; L65-S67 PolarHBondContact O-N 2.87Å; L65-A213 HydrophobicContact CD1-CB 4.06Å; L65-L216 HydrophobicContact CB-CD1 3.92Å; L65-L216 HydrophobicContact CD1-CD1 4.07Å; L65-L216 HydrophobicContact CD2-CD1 3.61Å; L65-L216 HydrophobicContact CG-CD1 4.07Å; L65-L275 HydrophobicContact CD1-CD1 4.17Å; L65-L275 HydrophobicContact CD2-CD1 4.43Å; L65-M328 HydrophobicContact CD1-SD 4.35Å; L65-M328 HydrophobicContact CD2-CE 3.35Å; L65-M328 HydrophobicContact CD2-SD 3.9Å; L65-M328 HydrophobicContact CG-CE 3.79Å; L65-M328 HydrophobicContact CG-SD 4Å
66T73.7Confident80.9Confident16 Ų1636.7 Ų36.710%0.09817%0.173CC..THydrogen-bonded Turntrans-80-0.3177.855.40000113.9L62 F64 S68 S76 N80 L131L62-T66 PolarHBondContact O-N 2.61Å; L62-T66 PolarHBondContact O-OG1 2.72Å; F64-T66 VanDerWaalsContact C-N 3.27Å; F64-T66 PolarHBondContact O-N 3.48Å; T66-S68 PolarHBondContact O-N 3.36Å; T66-S76 WeakPolarHBondContact CB-OG 3.33Å; T66-S76 PolarHBondContact O-OG 3.48Å; T66-S76 PolarHBondContact OG1-OG 2.95Å; T66-N80 PolarHBondContact OG1-ND2 2.8Å; T66-L131 HydrophobicContact CG2-CD1 3.96Å
67S71.6Confident80.6Confident1 Ų136.7 Ų36.71%0.00717%0.172CC..THydrogen-bonded Turntrans-82.311.3-178.779.20000114.5F64 L65 F69 S73 S76 S208F64-S67 WeakPolarHBondContact O-CB 3.41Å; F64-S67 PolarHBondContact O-N 3.38Å; F64-S67 PolarHBondContact O-OG 3.1Å; L65-S67 PolarHBondContact O-N 2.87Å; S67-F69 PolarHBondContact O-N 3.33Å; S67-S73 PolarHBondContact O-OG 2.74Å; S67-S76 PolarHBondContact N-OG 3.23Å; S67-S208 WeakPolarHBondContact OG-CB 3.29Å; S67-S208 PolarHBondContact OG-OG 3.41Å
68S62.7Low80.6Confident54 Ų5438 Ų3838%0.37818%0.184SC..  trans-66-4.7-177.458.90000115T66 P205T66-S68 PolarHBondContact O-N 3.36Å; S68-P205 WeakPolarHBondContact O-CB 3.2Å
69F63.5Low80.5Confident91 Ų9138.7 Ų38.740%0.39919%0.187SC..SBendtrans-98.1121175.6-64.3-74.4000111.1S67 R71 H72 S73 F402S67-F69 PolarHBondContact O-N 3.33Å; F69-R71 PolarHBondContact O-N 2.68Å; F69-H72 HydrophobicContact CB-CB 3.9Å; F69-H72 PolarHBondContact O-N 2.72Å; F69-S73 PolarHBondContact O-N 3.43Å; F69-S73 PolarHBondContact O-OG 3.16Å; F69-S73 VanDerWaalsContact O-OG 3.06Å; F69-F402 HydrophobicContact CD1-CD1 4.13Å; F69-F402 HydrophobicContact CD1-CG 4.44Å; F69-F402 AromaticContact CD2-CD1 3.8Å; F69-F402 HydrophobicContact CD2-CD1 3.8Å; F69-F402 HydrophobicContact CD2-CE1 4.14Å; F69-F402 HydrophobicContact CE1-CD1 4.17Å; F69-F402 HydrophobicContact CE1-CE1 4.24Å; F69-F402 AromaticContact CE2-CD1 3.84Å; F69-F402 HydrophobicContact CE2-CD1 3.84Å; F69-F402 AromaticContact CE2-CE1 3.69Å; F69-F402 HydrophobicContact CE2-CE1 3.69Å; F69-F402 AromaticContact CG-CD1 3.95Å; F69-F402 HydrophobicContact CG-CD1 3.95Å; F69-F402 HydrophobicContact CZ-CD1 4.03Å; F69-F402 AromaticContact CZ-CE1 3.75Å; F69-F402 HydrophobicContact CZ-CE1 3.75Å; F69-F402 HydrophobicContact CZ-CZ 4.36Å
70R62.4Low80.5Confident116 Ų11637.7 Ų37.744%0.43818%0.179SC..THydrogen-bonded Turntrans-52.5-34.6-174.6-167.3175173.4-153.6-6.8114.7P205 F417R70-P205 HydrophobicContact CB-CG 3.57Å; R70-P205 HydrophobicContact CG-CG 4.15Å; R70-F417 PolarHBondContact NH1-OXT 3.04Å; R70-F417 PolarHBondContact NH2-OXT 3.23Å; R70-F417 VanDerWaalsContact NH2-OXT 3.16Å
71R67.1Low80.6Confident100 Ų10039.6 Ų39.638%0.37719%0.19SC..THydrogen-bonded Turntrans-10611-178.3-64.6-172.3-178.6-175.13.3113.5F69 F402 D403 D404 F417F69-R71 PolarHBondContact O-N 2.68Å; R71-F402 CarbonylContact C-O 3.43Å; R71-F402 WeakPolarHBondContact CB-O 3.41Å; R71-D403 CarbonylContact O-C 3.55Å; R71-D403 WeakPolarHBondContact O-CA 3.29Å; R71-D404 WeakPolarHBondContact O-CA 3.37Å; R71-D404 WeakPolarHBondContact O-CB 3.37Å; R71-D404 PolarHBondContact O-N 3.36Å; R71-F417 PolarHBondContact NH2-O 3.43Å
72H73.1Confident80.8Confident3 Ų342.8 Ų42.81%0.01420%0.203CC..THydrogen-bonded Turntrans-130.211.5180-167.6-95.7000113.3F69 W74 S75 S76 G132 F402 D404F69-H72 HydrophobicContact CB-CB 3.9Å; F69-H72 PolarHBondContact O-N 2.72Å; H72-W74 VanDerWaalsContact C-N 3.32Å; H72-W74 PolarHBondContact O-N 3.46Å; H72-S75 WeakPolarHBondContact NE2-CB 3.33Å; H72-S76 VanDerWaalsContact O-CB 3.28Å; H72-S76 WeakPolarHBondContact O-CB 3.32Å; H72-S76 PolarHBondContact O-N 2.87Å; H72-G132 PolarHBondContact CE1-N 3.02Å; H72-G132 VanDerWaalsContact CE1-N 3.33Å; H72-G132 VanDerWaalsContact NE2-CA 3.33Å; H72-G132 WeakPolarHBondContact NE2-CA 3.2Å; H72-G132 PolarHBondContact NE2-N 2.89Å; H72-F402 HydrophobicContact CB-CB 4.31Å; H72-D404 VanDerWaalsContact CA-CG 3.43Å; H72-D404 WeakPolarHBondContact CA-OD1 3.41Å; H72-D404 WeakPolarHBondContact CA-OD2 3.36Å; H72-D404 IonicContact CD2-OD1 3.21Å; H72-D404 PolarHBondContact N-OD2 3.21Å
73S77.3Confident81.1Confident31 Ų3142.2 Ų42.222%0.21720%0.2CC..Hα-helixtrans-67-31.3-175.1-52.40000112.7S67 F69 V77 D404S67-S73 PolarHBondContact O-OG 2.74Å; F69-S73 PolarHBondContact O-N 3.43Å; F69-S73 PolarHBondContact O-OG 3.16Å; F69-S73 VanDerWaalsContact O-OG 3.06Å; S73-V77 PolarHBondContact O-N 3.34Å; S73-D404 PolarHBondContact N-OD2 3.3Å; S73-D404 VanDerWaalsContact N-OD2 3.14Å
74W82.2Confident81.5Confident153 Ų15342.7 Ų42.758%0.5820%0.203SC*.Hα-helixtrans-72.9-50.4-179.7-71.753.5000110.9H72 S76 V77 A78 D404 W408H72-W74 VanDerWaalsContact C-N 3.32Å; H72-W74 PolarHBondContact O-N 3.46Å; W74-S76 VanDerWaalsContact C-N 3.26Å; W74-S76 PolarHBondContact O-N 2.88Å; W74-V77 PolarHBondContact O-N 3.48Å; W74-A78 WeakPolarHBondContact O-CB 3.43Å; W74-A78 PolarHBondContact O-N 2.95Å; W74-D404 WeakPolarHBondContact CB-OD2 3.42Å; W74-D404 PolarHBondContact N-OD2 2.92Å; W74-W408 HydrophobicContact CB-CD2 4.15Å; W74-W408 HydrophobicContact CB-CG 4.27Å; W74-W408 HydrophobicContact CB-CZ2 4.45Å; W74-W408 HydrophobicContact CE3-CD2 4.08Å; W74-W408 AromaticContact CE3-CE3 3.74Å; W74-W408 HydrophobicContact CE3-CE3 3.74Å; W74-W408 HydrophobicContact CE3-CZ3 4.15Å; W74-W408 HydrophobicContact CZ3-CE3 4.32Å
75S84.3Confident81.9Confident0 Ų042.5 Ų42.50%021%0.212CC..Hα-helixtrans-61.9-36.5175.8-59.70000111.5H72 F79 D404 W408H72-S75 WeakPolarHBondContact NE2-CB 3.33Å; S75-F79 WeakPolarHBondContact O-CB 3.28Å; S75-F79 WeakPolarHBondContact O-CG 3.38Å; S75-F79 PolarHBondContact O-N 3.39Å; S75-D404 WeakPolarHBondContact CB-OD1 3.49Å; S75-D404 PolarHBondContact N-OD1 3.5Å; S75-D404 PolarHBondContact OG-OD1 2.95Å; S75-W408 PolarHBondContact OG-NE1 3.41Å
76S83.2Confident82.6Confident0 Ų042.4 Ų42.40%021%0.212CC..Hα-helixtrans-54-58.1174-178.90000111.6G63 T66 S67 H72 W74 N80G63-S76 PolarHBondContact O-OG 2.96Å; T66-S76 WeakPolarHBondContact CB-OG 3.33Å; T66-S76 PolarHBondContact O-OG 3.48Å; T66-S76 PolarHBondContact OG1-OG 2.95Å; S67-S76 PolarHBondContact N-OG 3.23Å; H72-S76 VanDerWaalsContact O-CB 3.28Å; H72-S76 WeakPolarHBondContact O-CB 3.32Å; H72-S76 PolarHBondContact O-N 2.87Å; W74-S76 VanDerWaalsContact C-N 3.26Å; W74-S76 PolarHBondContact O-N 2.88Å; S76-N80 VanDerWaalsContact O-CB 3.26Å; S76-N80 WeakPolarHBondContact O-CB 3.38Å; S76-N80 PolarHBondContact O-N 3.26Å; S76-N80 VanDerWaalsContact O-N 3.16Å; S76-N80 PolarHBondContact O-ND2 2.93Å
77V88.4Confident83.7Confident42 Ų4241.7 Ų41.726%0.25521%0.207SC..Hα-helixtrans-69.6-48.1-174178.50000111.3F64 S73 W74 N80 L81F64-V77 HydrophobicContact CD1-CG2 4.15Å; F64-V77 HydrophobicContact CD2-CG2 4.19Å; F64-V77 HydrophobicContact CE1-CG2 4.11Å; F64-V77 HydrophobicContact CE2-CG1 4.18Å; F64-V77 HydrophobicContact CE2-CG2 4.15Å; F64-V77 HydrophobicContact CG-CG2 4.2Å; F64-V77 HydrophobicContact CZ-CG2 4.11Å; S73-V77 PolarHBondContact O-N 3.34Å; W74-V77 PolarHBondContact O-N 3.48Å; V77-N80 PolarHBondContact O-N 3.12Å; V77-L81 PolarHBondContact O-N 2.69Å
78A90.7Very high84.9Confident35 Ų3542.9 Ų42.929%0.28922%0.215SC..Hα-helixtrans-70.2-39.7-175.800000113.3W74 L81 F82 W408W74-A78 WeakPolarHBondContact O-CB 3.43Å; W74-A78 PolarHBondContact O-N 2.95Å; A78-L81 PolarHBondContact O-N 3.02Å; A78-F82 WeakPolarHBondContact O-CB 3.32Å; A78-F82 PolarHBondContact O-N 3Å; A78-W408 HydrophobicContact CB-CH2 3.58Å; A78-W408 HydrophobicContact CB-CZ2 3.51Å
79F90.9Very high86.5Confident15 Ų1542.7 Ų42.77%0.06621%0.208CC..Hα-helixtrans-71.2-35.3177.4-60.9-10.5000111.4S75 F82 M83 L136 L139 F407S75-F79 WeakPolarHBondContact O-CB 3.28Å; S75-F79 WeakPolarHBondContact O-CG 3.38Å; S75-F79 PolarHBondContact O-N 3.39Å; F79-F82 PolarHBondContact O-N 2.79Å; F79-M83 WeakPolarHBondContact O-CB 3.38Å; F79-M83 VanDerWaalsContact O-CG 3.29Å; F79-M83 WeakPolarHBondContact O-CG 3.47Å; F79-M83 PolarHBondContact O-N 3.08Å; F79-L136 HydrophobicContact CB-CD1 4.16Å; F79-L136 HydrophobicContact CD1-CB 4.45Å; F79-L136 HydrophobicContact CD1-CD1 3.73Å; F79-L136 HydrophobicContact CD1-CG 4.46Å; F79-L136 HydrophobicContact CE1-CB 4.17Å; F79-L136 HydrophobicContact CE1-CD1 4.26Å; F79-L136 HydrophobicContact CE1-CD2 4.42Å; F79-L136 HydrophobicContact CG-CD1 3.92Å; F79-L136 HydrophobicContact CZ-CB 4.24Å; F79-L139 HydrophobicContact CB-CD1 3.76Å; F79-L139 HydrophobicContact CD2-CD1 3.74Å; F79-L139 HydrophobicContact CG-CD1 4.07Å; F79-F407 HydrophobicContact CE2-CD2 4.12Å; F79-F407 HydrophobicContact CE2-CE2 4.24Å; F79-F407 HydrophobicContact CZ-CB 4.23Å; F79-F407 HydrophobicContact CZ-CD1 4.42Å; F79-F407 AromaticContact CZ-CD2 3.99Å; F79-F407 HydrophobicContact CZ-CD2 3.99Å; F79-F407 HydrophobicContact CZ-CE2 4.49Å; F79-F407 AromaticContact CZ-CG 3.95Å; F79-F407 HydrophobicContact CZ-CG 3.95Å
80N92Very high88Confident0 Ų040.8 Ų40.80%020%0.198CC..Hα-helixtrans-60.7-46.2172.4-86.4-63.3000111.7T66 S76 V77 F82 M83 L84 L124T66-N80 PolarHBondContact OG1-ND2 2.8Å; S76-N80 VanDerWaalsContact O-CB 3.26Å; S76-N80 WeakPolarHBondContact O-CB 3.38Å; S76-N80 PolarHBondContact O-N 3.26Å; S76-N80 VanDerWaalsContact O-N 3.16Å; S76-N80 PolarHBondContact O-ND2 2.93Å; V77-N80 PolarHBondContact O-N 3.12Å; N80-F82 VanDerWaalsContact C-N 3.32Å; N80-F82 PolarHBondContact O-N 3.47Å; N80-M83 HydrophobicContact CB-CE 4.48Å; N80-M83 PolarHBondContact O-N 2.95Å; N80-L84 WeakPolarHBondContact O-CB 3.4Å; N80-L84 PolarHBondContact O-N 3.07Å; N80-L124 HydrophobicContact CB-CD2 4.29Å; N80-L124 WeakPolarHBondContact O-CD2 3.39Å; N80-L124 WeakPolarHBondContact OD1-CD2 3.05Å
81L94.1Very high89.5Confident98 Ų9835.2 Ų35.251%0.51318%0.177SC..Hα-helixtrans-61.8-41.4176.6-178.162.3000112A59 V77 A78 L84 A85A59-L81 HydrophobicContact CB-CD1 4.16Å; V77-L81 PolarHBondContact O-N 2.69Å; A78-L81 PolarHBondContact O-N 3.02Å; L81-L84 PolarHBondContact O-N 3.06Å; L81-A85 PolarHBondContact O-N 3.33Å
82F94.4Very high90.8Very high66 Ų6631.1 Ų31.129%0.28916%0.162SC..Hα-helixtrans-62.4-47.3176.6-177.7-83.8000112A17 A78 F79 N80 L84 A85 L86 L136 V140A17-F82 HydrophobicContact CB-CZ 4.35Å; A78-F82 WeakPolarHBondContact O-CB 3.32Å; A78-F82 PolarHBondContact O-N 3Å; F79-F82 PolarHBondContact O-N 2.79Å; N80-F82 VanDerWaalsContact C-N 3.32Å; N80-F82 PolarHBondContact O-N 3.47Å; F82-L84 VanDerWaalsContact C-N 3.3Å; F82-L84 PolarHBondContact O-N 3Å; F82-A85 PolarHBondContact O-N 3.48Å; F82-L86 HydrophobicContact CE1-CD2 4.17Å; F82-L86 WeakPolarHBondContact O-CB 3.23Å; F82-L86 PolarHBondContact O-N 3.27Å; F82-L136 HydrophobicContact CB-CD1 4.29Å; F82-L136 HydrophobicContact CD1-CD1 3.6Å; F82-L136 HydrophobicContact CD1-CD2 4.42Å; F82-L136 HydrophobicContact CD1-CG 4.26Å; F82-L136 HydrophobicContact CD2-CD2 4.41Å; F82-L136 HydrophobicContact CE1-CD1 4.14Å; F82-L136 HydrophobicContact CE1-CG 4.36Å; F82-L136 HydrophobicContact CE2-CD2 4.49Å; F82-L136 HydrophobicContact CG-CD1 3.97Å; F82-L136 HydrophobicContact CG-CD2 4.37Å; F82-V140 HydrophobicContact CE1-CG2 3.57Å; F82-V140 HydrophobicContact CZ-CG2 4.12Å
83M94.8Very high91.7Very high0 Ų031 Ų310%016%0.162CC..Hα-helixtrans-61.5-38.7176.8-73-175.3-65.300111.9F79 N80 G87 L124 A127 L139 V143F79-M83 WeakPolarHBondContact O-CB 3.38Å; F79-M83 VanDerWaalsContact O-CG 3.29Å; F79-M83 WeakPolarHBondContact O-CG 3.47Å; F79-M83 PolarHBondContact O-N 3.08Å; N80-M83 HydrophobicContact CB-CE 4.48Å; N80-M83 PolarHBondContact O-N 2.95Å; M83-G87 WeakPolarHBondContact O-CA 3.26Å; M83-G87 PolarHBondContact O-N 3.3Å; M83-L124 HydrophobicContact CB-CD2 3.73Å; M83-L124 HydrophobicContact CE-CD2 4Å; M83-A127 HydrophobicContact CE-CB 3.58Å; M83-A127 HydrophobicContact SD-CB 3.78Å; M83-L139 HydrophobicContact CE-CD1 4.31Å; M83-L139 HydrophobicContact CG-CB 4.14Å; M83-L139 HydrophobicContact SD-CB 3.86Å; M83-L139 HydrophobicContact SD-CD1 4Å; M83-L139 HydrophobicContact SD-CD2 3.7Å; M83-L139 HydrophobicContact SD-CG 4.05Å; M83-V143 HydrophobicContact CB-CG2 3.77Å; M83-V143 HydrophobicContact CG-CG2 3.65Å; M83-V143 HydrophobicContact SD-CG2 4.33Å
84L96.1Very high92.3Very high10 Ų1030.1 Ų30.15%0.05215%0.154CC..Hα-helixtrans-61.8-51.2175.817958.8000111.3A58 A59 N80 L81 F82 L86 G87 V88 T117 A120 L124A58-L84 HydrophobicContact CB-CD1 3.7Å; A58-L84 HydrophobicContact CB-CD2 3.59Å; A58-L84 HydrophobicContact CB-CG 4.27Å; A59-L84 HydrophobicContact CB-CD2 3.91Å; N80-L84 WeakPolarHBondContact O-CB 3.4Å; N80-L84 PolarHBondContact O-N 3.07Å; L81-L84 PolarHBondContact O-N 3.06Å; F82-L84 VanDerWaalsContact C-N 3.3Å; F82-L84 PolarHBondContact O-N 3Å; L84-L86 PolarHBondContact O-N 3.29Å; L84-G87 PolarHBondContact O-N 3.05Å; L84-V88 HydrophobicContact CD1-CG2 4.01Å; L84-V88 VanDerWaalsContact O-CG2 3.29Å; L84-V88 WeakPolarHBondContact O-CG2 3.31Å; L84-V88 PolarHBondContact O-N 3.41Å; L84-T117 HydrophobicContact CD1-CG2 4.41Å; L84-A120 HydrophobicContact CD1-CB 3.87Å; L84-L124 HydrophobicContact CB-CD1 4.24Å; L84-L124 HydrophobicContact CB-CD2 4.49Å; L84-L124 HydrophobicContact CD1-CD1 4.28Å
85A95.9Very high92.5Very high54 Ų5423.3 Ų23.345%0.44613%0.13SC..Hα-helixtrans-59.5-49.6-17900000111.6L81 F82 Q89L81-A85 PolarHBondContact O-N 3.33Å; F82-A85 PolarHBondContact O-N 3.48Å; A85-Q89 WeakPolarHBondContact O-CG 3.3Å; A85-Q89 PolarHBondContact O-N 2.95Å
86L96.1Very high92.5Very high6 Ų623.5 Ų23.53%0.03113%0.131CC..Hα-helixtrans-63.8-44.8177.9178.965.1000111.8L20 L24 F82 L84 V88 Q89 W90 V140 V143L20-L86 HydrophobicContact CD2-CD1 3.62Å; L20-L86 HydrophobicContact CD2-CD2 3.99Å; L20-L86 HydrophobicContact CD2-CG 4.47Å; L20-L86 HydrophobicContact CG-CD1 4.19Å; L24-L86 HydrophobicContact CD1-CD1 3.59Å; F82-L86 HydrophobicContact CE1-CD2 4.17Å; F82-L86 WeakPolarHBondContact O-CB 3.23Å; F82-L86 PolarHBondContact O-N 3.27Å; L84-L86 PolarHBondContact O-N 3.29Å; L86-V88 PolarHBondContact O-N 3.41Å; L86-Q89 PolarHBondContact O-N 3.27Å; L86-W90 WeakPolarHBondContact O-CB 3.43Å; L86-W90 PolarHBondContact O-N 3.49Å; L86-V140 HydrophobicContact CD2-CB 4.3Å; L86-V140 HydrophobicContact CD2-CG1 3.93Å; L86-V140 HydrophobicContact CD2-CG2 4.29Å; L86-V143 HydrophobicContact CB-CG1 4.43Å; L86-V143 HydrophobicContact CD2-CB 4.18Å; L86-V143 HydrophobicContact CD2-CG1 4.04Å; L86-V143 HydrophobicContact CG-CG1 4.02Å
87G96.8Very high92.6Very high0 Ų025.7 Ų25.70%014%0.141CC..Hα-helixtrans-63.2-39.4-177.800000112.6M83 L84 A91M83-G87 WeakPolarHBondContact O-CA 3.26Å; M83-G87 PolarHBondContact O-N 3.3Å; L84-G87 PolarHBondContact O-N 3.05Å; G87-A91 WeakPolarHBondContact O-CB 3.48Å; G87-A91 PolarHBondContact O-N 3.33Å
88V96.1Very high92.4Very high27 Ų2725.8 Ų25.816%0.16414%0.14CC..Hα-helixtrans-64.8-49.2176.6170.20000110.8L84 L86 W90 A91 I92 A116 A120L84-V88 HydrophobicContact CD1-CG2 4.01Å; L84-V88 VanDerWaalsContact O-CG2 3.29Å; L84-V88 WeakPolarHBondContact O-CG2 3.31Å; L84-V88 PolarHBondContact O-N 3.41Å; L86-V88 PolarHBondContact O-N 3.41Å; V88-W90 VanDerWaalsContact C-N 3.33Å; V88-W90 PolarHBondContact O-N 3.06Å; V88-A91 PolarHBondContact O-N 3.11Å; V88-I92 HydrophobicContact CG1-CD1 4.08Å; V88-I92 WeakPolarHBondContact O-CG1 3.45Å; V88-I92 PolarHBondContact O-N 2.9Å; V88-A116 HydrophobicContact CG1-CB 4.18Å; V88-A120 HydrophobicContact CG2-CB 3.9Å
89Q96.2Very high91.5Very high49 Ų4926.1 Ų26.123%0.22914%0.14CC..Hα-helixtrans-58.7-46.6178.6-70177.4-9.200111.3E21 L24 F28 A85 L86 I92 L93E21-Q89 PolarHBondContact OE1-NE2 3.32Å; E21-Q89 PolarHBondContact OE2-OE1 2.72Å; L24-Q89 HydrophobicContact CD1-CB 4.3Å; F28-Q89 HydrophobicContact CE2-CB 4.07Å; F28-Q89 WeakPolarHBondContact CE2-O 3.46Å; F28-Q89 HydrophobicContact CZ-CB 4.35Å; A85-Q89 WeakPolarHBondContact O-CG 3.3Å; A85-Q89 PolarHBondContact O-N 2.95Å; L86-Q89 PolarHBondContact O-N 3.27Å; Q89-I92 PolarHBondContact O-N 3.36Å; Q89-L93 PolarHBondContact O-N 2.83Å
90W96.2Very high90.3Very high51 Ų5128.1 Ų28.119%0.19315%0.149CC..Hα-helixtrans-67-40.3179.9-175.9-128.9000112.6L24 L86 V88 I92 L93 L94 L144 T148L24-W90 HydrophobicContact CD2-CE3 4.09Å; L86-W90 WeakPolarHBondContact O-CB 3.43Å; L86-W90 PolarHBondContact O-N 3.49Å; V88-W90 VanDerWaalsContact C-N 3.33Å; V88-W90 PolarHBondContact O-N 3.06Å; W90-I92 PolarHBondContact O-N 3.45Å; W90-L93 HydrophobicContact CE3-CD1 4.48Å; W90-L93 PolarHBondContact O-N 2.85Å; W90-L94 HydrophobicContact CD2-CD1 4.03Å; W90-L94 HydrophobicContact CD2-CG 4.02Å; W90-L94 VanDerWaalsContact CE2-CD1 3.43Å; W90-L94 HydrophobicContact CG-CD1 4.1Å; W90-L94 HydrophobicContact CG-CG 4.48Å; W90-L94 HydrophobicContact CH2-CD2 4.12Å; W90-L94 HydrophobicContact CH2-CG 4.28Å; W90-L94 HydrophobicContact CZ2-CD1 3.92Å; W90-L94 HydrophobicContact CZ2-CD2 3.68Å; W90-L94 HydrophobicContact CZ2-CG 3.76Å; W90-L94 WeakPolarHBondContact O-CB 3.11Å; W90-L94 WeakPolarHBondContact O-CG 3.41Å; W90-L94 PolarHBondContact O-N 3.18Å; W90-L144 HydrophobicContact CB-CD2 4.38Å; W90-L144 HydrophobicContact CD2-CD2 3.84Å; W90-L144 HydrophobicContact CE3-CD2 4.49Å; W90-L144 HydrophobicContact CG-CD2 3.74Å; W90-L144 PolarHBondContact NE1-O 3.34Å; W90-L144 VanDerWaalsContact NE1-O 3.13Å; W90-T148 PolarHBondContact NE1-OG1 3.45Å
91A94.1Very high88.7Confident0 Ų034.7 Ų34.70%018%0.178CC..Hα-helixtrans-64.9-38.1178.200000112.8G87 V88 L94 D95 A116 V147G87-A91 WeakPolarHBondContact O-CB 3.48Å; G87-A91 PolarHBondContact O-N 3.33Å; V88-A91 PolarHBondContact O-N 3.11Å; A91-L94 PolarHBondContact O-N 3.39Å; A91-D95 WeakPolarHBondContact O-CB 3.47Å; A91-D95 PolarHBondContact O-N 2.89Å; A91-A116 HydrophobicContact CB-CB 3.78Å; A91-V147 HydrophobicContact CB-CG1 3.64Å
92I92.9Very high87Confident14 Ų1436.2 Ų36.27%0.07219%0.194CC..Hα-helixtrans-60.9-48.3175.6-69.2171000110.6F28 V88 Q89 W90 G96 I108 I113 A116F28-I92 HydrophobicContact CE1-CG2 4.03Å; F28-I92 HydrophobicContact CZ-CB 4.09Å; F28-I92 HydrophobicContact CZ-CD1 4.46Å; F28-I92 HydrophobicContact CZ-CG2 4.03Å; V88-I92 HydrophobicContact CG1-CD1 4.08Å; V88-I92 WeakPolarHBondContact O-CG1 3.45Å; V88-I92 PolarHBondContact O-N 2.9Å; Q89-I92 PolarHBondContact O-N 3.36Å; W90-I92 PolarHBondContact O-N 3.45Å; I92-G96 PolarHBondContact O-N 2.86Å; I92-I108 HydrophobicContact CG2-CG1 4.29Å; I92-I113 HydrophobicContact CD1-CG1 4.42Å; I92-A116 HydrophobicContact CD1-CB 4.3Å; I92-A116 HydrophobicContact CG1-CB 3.47Å; I92-A116 VanDerWaalsContact CG1-CB 3.47Å
93L92.1Very high85.3Confident0 Ų036.8 Ų36.80%021%0.206CC..Hα-helixtrans-64-47.5179.3-69.6174000111.3L24 L27 F28 T32 Q89 W90 G96 F97L24-L93 HydrophobicContact CD2-CD1 3.6Å; L27-L93 HydrophobicContact CB-CD1 3.8Å; L27-L93 HydrophobicContact CB-CD2 4.2Å; L27-L93 HydrophobicContact CD1-CD1 3.99Å; F28-L93 HydrophobicContact CD2-CD1 3.81Å; F28-L93 HydrophobicContact CD2-CD2 3.85Å; F28-L93 HydrophobicContact CD2-CG 3.91Å; F28-L93 HydrophobicContact CE2-CD1 3.62Å; F28-L93 HydrophobicContact CE2-CD2 3.89Å; F28-L93 HydrophobicContact CE2-CG 3.51Å; F28-L93 HydrophobicContact CG-CD2 4.32Å; F28-L93 HydrophobicContact CZ-CD2 4.37Å; F28-L93 HydrophobicContact CZ-CG 4.08Å; T32-L93 HydrophobicContact CG2-CD2 3.84Å; Q89-L93 PolarHBondContact O-N 2.83Å; W90-L93 HydrophobicContact CE3-CD1 4.48Å; W90-L93 PolarHBondContact O-N 2.85Å; L93-G96 PolarHBondContact O-N 3.24Å; L93-F97 HydrophobicContact CB-CD2 4.42Å; L93-F97 HydrophobicContact CB-CE2 4.01Å; L93-F97 WeakPolarHBondContact O-CD2 3.32Å; L93-F97 VanDerWaalsContact O-CG 3.24Å; L93-F97 WeakPolarHBondContact O-CG 3.35Å; L93-F97 PolarHBondContact O-N 2.96Å
94L90.8Very high83.9Confident12 Ų1239.3 Ų39.36%0.06323%0.232CC..Hα-helixtrans-60.1-46.7177.7-82.4175.3000112.2W90 A91 G96 F97 L98 V147 T148W90-L94 HydrophobicContact CD2-CD1 4.03Å; W90-L94 HydrophobicContact CD2-CG 4.02Å; W90-L94 VanDerWaalsContact CE2-CD1 3.43Å; W90-L94 HydrophobicContact CG-CD1 4.1Å; W90-L94 HydrophobicContact CG-CG 4.48Å; W90-L94 HydrophobicContact CH2-CD2 4.12Å; W90-L94 HydrophobicContact CH2-CG 4.28Å; W90-L94 HydrophobicContact CZ2-CD1 3.92Å; W90-L94 HydrophobicContact CZ2-CD2 3.68Å; W90-L94 HydrophobicContact CZ2-CG 3.76Å; W90-L94 WeakPolarHBondContact O-CB 3.11Å; W90-L94 WeakPolarHBondContact O-CG 3.41Å; W90-L94 PolarHBondContact O-N 3.18Å; A91-L94 PolarHBondContact O-N 3.39Å; L94-G96 VanDerWaalsContact C-N 3.28Å; L94-G96 PolarHBondContact O-N 3.4Å; L94-F97 PolarHBondContact O-N 2.88Å; L94-F97 VanDerWaalsContact O-N 3.14Å; L94-L98 WeakPolarHBondContact O-CB 3.33Å; L94-L98 VanDerWaalsContact O-CG 3.22Å; L94-L98 WeakPolarHBondContact O-CG 3.31Å; L94-L98 PolarHBondContact O-N 3.33Å; L94-V147 HydrophobicContact CD1-CB 4.28Å; L94-V147 HydrophobicContact CD1-CG1 3.7Å; L94-T148 HydrophobicContact CD2-CG2 4.36Å
95D86.8Confident82.8Confident11 Ų1144.2 Ų44.26%0.05925%0.253CS..Hα-helixtrans-61.3-42.3178.1-85-17.2000111.3A91 F97 L98 S99 L115 R154 Y165A91-D95 WeakPolarHBondContact O-CB 3.47Å; A91-D95 PolarHBondContact O-N 2.89Å; D95-F97 VanDerWaalsContact C-N 3.34Å; D95-F97 PolarHBondContact O-N 2.87Å; D95-L98 PolarHBondContact O-N 3.47Å; D95-S99 WeakPolarHBondContact O-CB 3.13Å; D95-S99 PolarHBondContact O-N 3.44Å; D95-S99 PolarHBondContact O-OG 3.27Å; D95-L115 VanDerWaalsContact OD2-CD2 3.24Å; D95-L115 WeakPolarHBondContact OD2-CD2 3.33Å; D95-R154 VanDerWaalsContact CG-NH2 3.3Å; D95-R154 IonicContact OD1-CZ 2.63Å; D95-R154 IonicContact OD1-NH1 3.6Å; D95-R154 PolarHBondContact OD1-NH1 2.61Å; D95-R154 IonicContact OD1-NH2 3.87Å; D95-R154 PolarHBondContact OD1-NH2 3.13Å; D95-R154 IonicContact OD2-CZ 3.61Å; D95-R154 IonicContact OD2-NH1 3.35Å; D95-R154 PolarHBondContact OD2-NH1 3.46Å; D95-R154 IonicContact OD2-NH2 3.63Å; D95-R154 PolarHBondContact OD2-NH2 3.29Å; D95-Y165 HydrophobicContact CB-CE1 4.48Å; D95-Y165 WeakPolarHBondContact OD1-CE1 3.29Å; D95-Y165 PolarHBondContact OD1-OH 2.95Å
96G83.9Confident82.2Confident3 Ų342 Ų423%0.03123%0.234CC..Hα-helixtrans-58-45.1172.500000113.3I92 L93 L94 Q100 F101 V106I92-G96 PolarHBondContact O-N 2.86Å; L93-G96 PolarHBondContact O-N 3.24Å; L94-G96 VanDerWaalsContact C-N 3.28Å; L94-G96 PolarHBondContact O-N 3.4Å; G96-Q100 CarbonylContact O-C 3.47Å; G96-Q100 WeakPolarHBondContact O-CA 3.25Å; G96-Q100 WeakPolarHBondContact O-CB 3.43Å; G96-Q100 PolarHBondContact O-N 2.86Å; G96-F101 PolarHBondContact O-N 3.22Å; G96-V106 VanDerWaalsContact CA-CG1 3.48Å; G96-V106 VanDerWaalsContact CA-CG2 3.41Å
97F85.8Confident81.6Confident46 Ų4643.6 Ų43.620%0.20224%0.244CC..Hα-helixtrans-72-39-179.6-63.4-38000113.1F31 L93 L94 D95 F101F31-F97 HydrophobicContact CB-CE1 3.97Å; F31-F97 HydrophobicContact CB-CZ 4.21Å; F31-F97 AromaticContact CD1-CE1 3.96Å; F31-F97 HydrophobicContact CD1-CE1 3.96Å; F31-F97 HydrophobicContact CD2-CE1 4.25Å; F31-F97 HydrophobicContact CD2-CZ 4.02Å; F31-F97 AromaticContact CG-CE1 3.79Å; F31-F97 HydrophobicContact CG-CE1 3.79Å; F31-F97 HydrophobicContact CG-CZ 4Å; L93-F97 HydrophobicContact CB-CD2 4.42Å; L93-F97 HydrophobicContact CB-CE2 4.01Å; L93-F97 WeakPolarHBondContact O-CD2 3.32Å; L93-F97 VanDerWaalsContact O-CG 3.24Å; L93-F97 WeakPolarHBondContact O-CG 3.35Å; L93-F97 PolarHBondContact O-N 2.96Å; L94-F97 PolarHBondContact O-N 2.88Å; L94-F97 VanDerWaalsContact O-N 3.14Å; D95-F97 VanDerWaalsContact C-N 3.34Å; D95-F97 PolarHBondContact O-N 2.87Å; F97-F101 HydrophobicContact CB-CD2 3.82Å; F97-F101 HydrophobicContact CB-CE2 3.93Å; F97-F101 AromaticContact CD1-CD2 3.83Å; F97-F101 HydrophobicContact CD1-CD2 3.83Å; F97-F101 AromaticContact CD1-CE2 3.44Å; F97-F101 HydrophobicContact CD1-CE2 3.44Å; F97-F101 VanDerWaalsContact CD1-CE2 3.44Å; F97-F101 HydrophobicContact CD1-CZ 4.49Å; F97-F101 HydrophobicContact CE1-CE2 4.22Å; F97-F101 HydrophobicContact CG-CD2 4.22Å; F97-F101 AromaticContact CG-CE2 3.91Å; F97-F101 HydrophobicContact CG-CE2 3.91Å; F97-F101 WeakPolarHBondContact O-CB 3.42Å; F97-F101 VanDerWaalsContact O-CD2 3.25Å; F97-F101 WeakPolarHBondContact O-CD2 3.15Å
98L83.1Confident81.1Confident44 Ų4444.5 Ų44.523%0.2325%0.249CC..Hα-helixtrans-80.8-26.8-175.9-62.1178.6000112.6L94 D95 M155L94-L98 WeakPolarHBondContact O-CB 3.33Å; L94-L98 VanDerWaalsContact O-CG 3.22Å; L94-L98 WeakPolarHBondContact O-CG 3.31Å; L94-L98 PolarHBondContact O-N 3.33Å; D95-L98 PolarHBondContact O-N 3.47Å; L98-M155 HydrophobicContact CB-CE 3.55Å; L98-M155 HydrophobicContact CD1-CE 4.44Å; L98-M155 HydrophobicContact CD2-CE 3.23Å; L98-M155 HydrophobicContact CG-CE 3.84Å
99S72.8Confident80.6Confident42 Ų4244.9 Ų44.929%0.29425%0.251SS..Hα-helixtrans-109.8-26.7-176.670.10000115.3D95D95-S99 WeakPolarHBondContact O-CB 3.13Å; D95-S99 PolarHBondContact O-N 3.44Å; D95-S99 PolarHBondContact O-OG 3.27Å
100Q64.5Low80.1Confident57 Ų5744.7 Ų44.727%0.26625%0.251SS..Hα-helixtrans-125.814.2-170.5-64.9179.53.400114.1G96 P102 S103G96-Q100 CarbonylContact O-C 3.47Å; G96-Q100 WeakPolarHBondContact O-CA 3.25Å; G96-Q100 WeakPolarHBondContact O-CB 3.43Å; G96-Q100 PolarHBondContact O-N 2.86Å; Q100-P102 WeakPolarHBondContact O-CD 3.24Å; Q100-S103 PolarHBondContact O-N 3.4Å; Q100-S103 PolarHBondContact O-OG 2.89Å
101F59.2Low79.6Confident139 Ų13944.7 Ų44.761%0.6125%0.253SS*.G310 helixtrans-50.9-29.7180-134.3-87.9000115.9G96 F97 S103 G104G96-F101 PolarHBondContact O-N 3.22Å; F97-F101 HydrophobicContact CB-CD2 3.82Å; F97-F101 HydrophobicContact CB-CE2 3.93Å; F97-F101 AromaticContact CD1-CD2 3.83Å; F97-F101 HydrophobicContact CD1-CD2 3.83Å; F97-F101 AromaticContact CD1-CE2 3.44Å; F97-F101 HydrophobicContact CD1-CE2 3.44Å; F97-F101 VanDerWaalsContact CD1-CE2 3.44Å; F97-F101 HydrophobicContact CD1-CZ 4.49Å; F97-F101 HydrophobicContact CE1-CE2 4.22Å; F97-F101 HydrophobicContact CG-CD2 4.22Å; F97-F101 AromaticContact CG-CE2 3.91Å; F97-F101 HydrophobicContact CG-CE2 3.91Å; F97-F101 WeakPolarHBondContact O-CB 3.42Å; F97-F101 VanDerWaalsContact O-CD2 3.25Å; F97-F101 WeakPolarHBondContact O-CD2 3.15Å; F101-S103 PolarHBondContact O-N 3.29Å; F101-G104 PolarHBondContact O-N 2.85Å
102P57.9Low79.3Confident130 Ų13045.8 Ų45.884%0.84426%0.261SS*.G310 helixtrans-62.2-24.4177.5-22.533.1000115.1Q100Q100-P102 WeakPolarHBondContact O-CD 3.24Å
103S59.1Low79.1Confident78 Ų7848.2 Ų48.255%0.54527%0.273SS..G310 helixtrans-88.1-6.7-176.860.20000114.2Q100 F101 K105Q100-S103 PolarHBondContact O-N 3.4Å; Q100-S103 PolarHBondContact O-OG 2.89Å; F101-S103 PolarHBondContact O-N 3.29Å; S103-K105 PolarHBondContact O-N 3.32Å; S103-K105 PolarHBondContact OG-O 3.1Å
104G65.2Low79Confident53 Ų5349.2 Ų49.255%0.54628%0.277SS..SBendtrans70-12.8-179.800000115.8F101F101-G104 PolarHBondContact O-N 2.85Å
105K74.3Confident78.9Confident112 Ų11248.7 Ų48.749%0.48727%0.274SS..SBendtrans-143141.7174.4-67-170.8177.5-175.40112.1F31 S103F31-K105 CarbonylContact O-C 3.6Å; F31-K105 WeakPolarHBondContact O-CA 3.22Å; S103-K105 PolarHBondContact O-N 3.32Å; S103-K105 PolarHBondContact OG-O 3.1Å
106V82.3Confident79.2Confident9 Ų948.2 Ų48.26%0.05527%0.271CS..EExtended strand (participates in β ladder)trans-85.4126177.5-175.10000109.7F31 T32 H33 G96F31-V106 WeakPolarHBondContact O-CB 3.46Å; F31-V106 WeakPolarHBondContact O-CG2 3.37Å; F31-V106 PolarHBondContact O-N 2.87Å; T32-V106 WeakPolarHBondContact CA-O 3.47Å; T32-V106 HydrophobicContact CG2-CB 4.2Å; H33-V106 PolarHBondContact N-O 3.48Å; H33-V106 PolarHBondContact ND1-O 3.01Å; H33-V106 VanDerWaalsContact ND1-O 3.17Å; G96-V106 VanDerWaalsContact CA-CG1 3.48Å; G96-V106 VanDerWaalsContact CA-CG2 3.41Å
107V84.6Confident79.7Confident39 Ų3948.3 Ų48.324%0.23627%0.271CS..EExtended strand (participates in β ladder)trans-87121.7175.1-174.40000109.7H33 D35 T109 S112H33-V107 WeakPolarHBondContact CE1-CG2 3.27Å; D35-V107 HydrophobicContact CB-CG1 3.71Å; V107-T109 HydrophobicContact CG1-CG2 4.03Å; V107-S112 PolarHBondContact O-OG 2.9Å
108I86.1Confident80Confident19 Ų1946.3 Ų46.310%0.09726%0.263CS..EExtended strand (participates in β ladder)trans-88.6113.3175.1-59.4177000109.1F28 T32 H33 Y34 D35 I92 I113F28-I108 HydrophobicContact CD1-CD1 4.11Å; F28-I108 HydrophobicContact CE1-CD1 3.95Å; T32-I108 HydrophobicContact CG2-CD1 4.22Å; H33-I108 PolarHBondContact O-N 3.38Å; Y34-I108 HydrophobicContact CD1-CB 4.12Å; Y34-I108 HydrophobicContact CD1-CG2 4.24Å; Y34-I108 HydrophobicContact CE1-CB 4.41Å; Y34-I108 HydrophobicContact CE1-CD1 4.41Å; Y34-I108 HydrophobicContact CE1-CG2 4.21Å; D35-I108 PolarHBondContact N-O 3.28Å; I92-I108 HydrophobicContact CG2-CG1 4.29Å; I108-I113 HydrophobicContact CG2-CG1 4.47Å
109T85.8Confident80.5Confident35 Ų3544.2 Ų44.222%0.21525%0.252CS..  trans-116.1165.1172.668.20000110.6D35 V107 F111 S112 I113D35-T109 HydrophobicContact CB-CG2 4.2Å; V107-T109 HydrophobicContact CG1-CG2 4.03Å; T109-F111 PolarHBondContact O-N 3.14Å; T109-F111 PolarHBondContact OG1-N 2.88Å; T109-S112 PolarHBondContact N-OG 2.98Å; T109-S112 WeakPolarHBondContact O-CB 3.46Å; T109-S112 PolarHBondContact O-N 3.48Å; T109-S112 VanDerWaalsContact O-N 3.1Å; T109-S112 PolarHBondContact OG1-N 2.53Å; T109-S112 PolarHBondContact OG1-OG 2.92Å; T109-I113 PolarHBondContact O-N 3.38Å
110L85Confident81.5Confident45 Ų4542.2 Ų42.224%0.23624%0.238CC..Hα-helixtrans-59.2-32.8171.4-74.2-177.6000112.2L44 I113 R114L44-L110 HydrophobicContact CD1-CD1 3.48Å; L44-L110 VanDerWaalsContact CD1-CD1 3.48Å; L44-L110 HydrophobicContact CD1-CG 4.47Å; L44-L110 HydrophobicContact CG-CD1 4.35Å; L110-I113 PolarHBondContact O-N 2.53Å; L110-R114 PolarHBondContact O-N 2.93Å; L110-R114 VanDerWaalsContact O-N 3.15Å
111F85.1Confident82.9Confident51 Ų5139.6 Ų39.622%0.22423%0.225CC..Hα-helixtrans-67-41.2175-179.9-92.5000111.6T109 I113 R114 L115 H166 M167 L227T109-F111 PolarHBondContact O-N 3.14Å; T109-F111 PolarHBondContact OG1-N 2.88Å; F111-I113 VanDerWaalsContact C-N 3.27Å; F111-I113 PolarHBondContact O-N 3.46Å; F111-R114 PolarHBondContact O-N 3.15Å; F111-R114 VanDerWaalsContact O-N 3.17Å; F111-L115 HydrophobicContact CE1-CD2 4.24Å; F111-L115 WeakPolarHBondContact O-CB 3.25Å; F111-L115 PolarHBondContact O-N 3.18Å; F111-H166 HydrophobicContact CE1-CB 3.67Å; F111-H166 AromaticContact CE1-CG 3.91Å; F111-H166 HydrophobicContact CZ-CB 3.91Å; F111-M167 HydrophobicContact CE2-CE 3.94Å; F111-M167 HydrophobicContact CZ-CE 3.52Å; F111-L227 HydrophobicContact CE2-CD2 4.13Å; F111-L227 HydrophobicContact CZ-CD2 4.27Å
112S87.3Confident84.5Confident23 Ų2333 Ų3316%0.16120%0.196CC..Hα-helixtrans-57.2-41.1174.5-50.60000111.5V107 T109 L115 A116V107-S112 PolarHBondContact O-OG 2.9Å; T109-S112 PolarHBondContact N-OG 2.98Å; T109-S112 WeakPolarHBondContact O-CB 3.46Å; T109-S112 PolarHBondContact O-N 3.48Å; T109-S112 VanDerWaalsContact O-N 3.1Å; T109-S112 PolarHBondContact OG1-N 2.53Å; T109-S112 PolarHBondContact OG1-OG 2.92Å; S112-L115 PolarHBondContact O-N 2.98Å; S112-A116 VanDerWaalsContact O-CB 3.29Å; S112-A116 WeakPolarHBondContact O-CB 3.33Å; S112-A116 PolarHBondContact O-N 3.06Å
113I89.1Confident86.3Confident65 Ų6526.8 Ų26.833%0.33316%0.156SC..Hα-helixtrans-64.5-46.2176.4-63.6173.5000111I92 I108 T109 L110 F111 L115 A116 T117I92-I113 HydrophobicContact CD1-CG1 4.42Å; I108-I113 HydrophobicContact CG2-CG1 4.47Å; T109-I113 PolarHBondContact O-N 3.38Å; L110-I113 PolarHBondContact O-N 2.53Å; F111-I113 VanDerWaalsContact C-N 3.27Å; F111-I113 PolarHBondContact O-N 3.46Å; I113-L115 VanDerWaalsContact C-N 3.32Å; I113-L115 PolarHBondContact O-N 2.74Å; I113-A116 PolarHBondContact O-N 2.98Å; I113-T117 WeakPolarHBondContact O-CB 3.38Å; I113-T117 PolarHBondContact O-N 2.93Å; I113-T117 PolarHBondContact O-OG1 3.44Å
114R89.8Confident87.9Confident21 Ų2123.1 Ų23.18%0.07913%0.131CC..Hα-helixtrans-59.5-44.3177.2-67.8-172.1-159.3125.452.2112.1S47 L54 L110 F111 A116 T117 M118S47-R114 VanDerWaalsContact CA-CZ 3.44Å; S47-R114 PolarHBondContact O-NE 3.27Å; S47-R114 PolarHBondContact O-NH2 3.17Å; S47-R114 PolarHBondContact OG-NH2 3.49Å; L54-R114 HydrophobicContact CD1-CB 3.89Å; L54-R114 HydrophobicContact CD1-CG 4.03Å; L110-R114 PolarHBondContact O-N 2.93Å; L110-R114 VanDerWaalsContact O-N 3.15Å; F111-R114 PolarHBondContact O-N 3.15Å; F111-R114 VanDerWaalsContact O-N 3.17Å; R114-A116 VanDerWaalsContact C-N 3.35Å; R114-T117 PolarHBondContact O-N 3.28Å; R114-M118 VanDerWaalsContact O-CG 3.31Å; R114-M118 WeakPolarHBondContact O-CG 3.44Å; R114-M118 PolarHBondContact O-N 2.78Å
115L89.9Confident89.1Confident1 Ų121.4 Ų21.41%0.00511%0.109CC..Hα-helixtrans-62.8-42.8179.3-171.267.9000111.6D95 F111 S112 I113 M118 S119 H166 L169 L227D95-L115 VanDerWaalsContact OD2-CD2 3.24Å; D95-L115 WeakPolarHBondContact OD2-CD2 3.33Å; F111-L115 HydrophobicContact CE1-CD2 4.24Å; F111-L115 WeakPolarHBondContact O-CB 3.25Å; F111-L115 PolarHBondContact O-N 3.18Å; S112-L115 PolarHBondContact O-N 2.98Å; I113-L115 VanDerWaalsContact C-N 3.32Å; I113-L115 PolarHBondContact O-N 2.74Å; L115-M118 PolarHBondContact O-N 2.8Å; L115-S119 PolarHBondContact O-N 2.96Å; L115-S119 PolarHBondContact O-OG 2.9Å; L115-S119 VanDerWaalsContact O-OG 3.07Å; L115-H166 WeakPolarHBondContact CD1-O 3.48Å; L115-H166 HydrophobicContact CD2-CB 4.28Å; L115-H166 WeakPolarHBondContact CD2-ND1 3.41Å; L115-L169 HydrophobicContact CD1-CD1 3.24Å; L115-L169 HydrophobicContact CG-CD1 4.33Å; L115-L227 HydrophobicContact CD1-CD1 4.27Å; L115-L227 HydrophobicContact CD1-CD2 3.95Å
116A92.6Very high90Very high0 Ų016 Ų160%09%0.085CC..Hα-helixtrans-64.8-42.5175.300000112.3V88 A91 I92 S112 I113 R114 M118 S119 A120V88-A116 HydrophobicContact CG1-CB 4.18Å; A91-A116 HydrophobicContact CB-CB 3.78Å; I92-A116 HydrophobicContact CD1-CB 4.3Å; I92-A116 HydrophobicContact CG1-CB 3.47Å; I92-A116 VanDerWaalsContact CG1-CB 3.47Å; S112-A116 VanDerWaalsContact O-CB 3.29Å; S112-A116 WeakPolarHBondContact O-CB 3.33Å; S112-A116 PolarHBondContact O-N 3.06Å; I113-A116 PolarHBondContact O-N 2.98Å; R114-A116 VanDerWaalsContact C-N 3.35Å; A116-M118 PolarHBondContact O-N 3.5Å; A116-S119 WeakPolarHBondContact O-CB 3.5Å; A116-S119 PolarHBondContact O-N 2.91Å; A116-A120 PolarHBondContact O-N 3.49Å
117T93.7Very high90.3Very high5 Ų515.6 Ų15.63%0.0318%0.083CC..Hα-helixtrans-61.4-43174.5-58.30000111.5L54 L84 I113 R114 S119 A120 M121L54-T117 HydrophobicContact CB-CG2 3.89Å; L84-T117 HydrophobicContact CD1-CG2 4.41Å; I113-T117 WeakPolarHBondContact O-CB 3.38Å; I113-T117 PolarHBondContact O-N 2.93Å; I113-T117 PolarHBondContact O-OG1 3.44Å; R114-T117 PolarHBondContact O-N 3.28Å; T117-S119 VanDerWaalsContact C-N 3.31Å; T117-S119 PolarHBondContact O-N 3.29Å; T117-A120 PolarHBondContact O-N 3.11Å; T117-M121 VanDerWaalsContact O-CG 3.29Å; T117-M121 WeakPolarHBondContact O-CG 3.4Å; T117-M121 PolarHBondContact O-N 3.48Å
118M91.9Very high90.3Very high4 Ų414.3 Ų14.32%0.028%0.077CC..Hα-helixtrans-60.1-40.6174.1-69.1-71.5-63.800112.2L54 R114 L115 A116 M121 S122 L169 F172 V223 L227L54-M118 HydrophobicContact CD1-CG 4.26Å; L54-M118 HydrophobicContact CD1-SD 4.36Å; L54-M118 HydrophobicContact CD2-SD 3.67Å; R114-M118 VanDerWaalsContact O-CG 3.31Å; R114-M118 WeakPolarHBondContact O-CG 3.44Å; R114-M118 PolarHBondContact O-N 2.78Å; L115-M118 PolarHBondContact O-N 2.8Å; A116-M118 PolarHBondContact O-N 3.5Å; M118-M121 HydrophobicContact CB-CE 4.41Å; M118-M121 HydrophobicContact CE-CE 4.23Å; M118-M121 HydrophobicContact CG-CE 4.14Å; M118-M121 PolarHBondContact O-N 3.02Å; M118-M121 HydrophobicContact SD-CE 3.14Å; M118-M121 WeakPolarHBondContact SD-CE 3.18Å; M118-S122 PolarHBondContact O-N 2.89Å; M118-L169 HydrophobicContact CB-CD2 4.03Å; M118-F172 HydrophobicContact CE-CD1 4.41Å; M118-F172 HydrophobicContact CE-CE1 3.84Å; M118-F172 HydrophobicContact CE-CE2 4.37Å; M118-F172 HydrophobicContact CE-CZ 3.79Å; M118-V223 HydrophobicContact CE-CG1 3.84Å; M118-V223 HydrophobicContact SD-CG1 3.88Å; M118-L227 HydrophobicContact CE-CD1 4.38Å; M118-L227 HydrophobicContact CG-CD1 4.26Å; M118-L227 HydrophobicContact CG-CD2 4.41Å; M118-L227 HydrophobicContact CG-CG 4.41Å
119S93.6Very high90.2Very high0 Ų013.6 Ų13.60%07%0.074CC..Hα-helixtrans-65.7-43175.7-58.80000111.7L115 A116 T117 M121 S122 R154L115-S119 PolarHBondContact O-N 2.96Å; L115-S119 PolarHBondContact O-OG 2.9Å; L115-S119 VanDerWaalsContact O-OG 3.07Å; A116-S119 WeakPolarHBondContact O-CB 3.5Å; A116-S119 PolarHBondContact O-N 2.91Å; T117-S119 VanDerWaalsContact C-N 3.31Å; T117-S119 PolarHBondContact O-N 3.29Å; S119-M121 VanDerWaalsContact C-N 3.34Å; S119-M121 PolarHBondContact O-N 3.35Å; S119-S122 WeakPolarHBondContact O-CB 3.47Å; S119-S122 PolarHBondContact O-N 3.13Å; S119-S122 PolarHBondContact O-OG 3.49Å; S119-R154 PolarHBondContact OG-NH2 3.06Å
120A95.3Very high90.1Very high0 Ų012 Ų120%06%0.064CC..Hα-helixtrans-65-36.2175.500000112.5L84 V88 A116 T117 S122 V123 L124L84-A120 HydrophobicContact CD1-CB 3.87Å; V88-A120 HydrophobicContact CG2-CB 3.9Å; A116-A120 PolarHBondContact O-N 3.49Å; T117-A120 PolarHBondContact O-N 3.11Å; A120-S122 VanDerWaalsContact C-N 3.26Å; A120-S122 PolarHBondContact O-N 3.35Å; A120-V123 WeakPolarHBondContact O-CB 3.08Å; A120-V123 PolarHBondContact O-N 2.9Å; A120-V123 VanDerWaalsContact O-N 3.11Å; A120-L124 PolarHBondContact O-N 2.94Å
121M92.9Very high89.9Confident2 Ų210.4 Ų10.41%0.016%0.056CC..Hα-helixtrans-62.3-31.5175-75.6-166.6-52.700113.1L54 M57 A58 L62 T117 M118 S119 V123 L124 I125 V223L54-M121 HydrophobicContact CD2-CE 3.93Å; M57-M121 HydrophobicContact CE-CE 3.9Å; M57-M121 HydrophobicContact CE-SD 3.19Å; M57-M121 WeakPolarHBondContact CE-SD 3.23Å; A58-M121 HydrophobicContact CB-CG 3.58Å; A58-M121 HydrophobicContact CB-SD 3.92Å; L62-M121 HydrophobicContact CD1-CB 4.48Å; L62-M121 HydrophobicContact CD1-CG 4.46Å; T117-M121 VanDerWaalsContact O-CG 3.29Å; T117-M121 WeakPolarHBondContact O-CG 3.4Å; T117-M121 PolarHBondContact O-N 3.48Å; M118-M121 HydrophobicContact CB-CE 4.41Å; M118-M121 HydrophobicContact CE-CE 4.23Å; M118-M121 HydrophobicContact CG-CE 4.14Å; M118-M121 PolarHBondContact O-N 3.02Å; M118-M121 HydrophobicContact SD-CE 3.14Å; M118-M121 WeakPolarHBondContact SD-CE 3.18Å; S119-M121 VanDerWaalsContact C-N 3.34Å; S119-M121 PolarHBondContact O-N 3.35Å; M121-V123 VanDerWaalsContact C-N 3.25Å; M121-V123 PolarHBondContact O-N 2.94Å; M121-L124 PolarHBondContact O-N 3.36Å; M121-I125 WeakPolarHBondContact O-CG1 3.39Å; M121-I125 PolarHBondContact O-N 3Å; M121-V223 HydrophobicContact CE-CG1 4.18Å
122S93.4Very high89.4Confident0 Ų08.2 Ų8.20%05%0.048CC..Hα-helixtrans-56.4-44.5172.776.60000110.9M118 S119 A120 L124 I125 S126 E146 L150 A176M118-S122 PolarHBondContact O-N 2.89Å; S119-S122 WeakPolarHBondContact O-CB 3.47Å; S119-S122 PolarHBondContact O-N 3.13Å; S119-S122 PolarHBondContact O-OG 3.49Å; A120-S122 VanDerWaalsContact C-N 3.26Å; A120-S122 PolarHBondContact O-N 3.35Å; S122-L124 PolarHBondContact O-N 3.07Å; S122-I125 WeakPolarHBondContact O-CB 3.29Å; S122-I125 PolarHBondContact O-N 2.75Å; S122-S126 PolarHBondContact O-N 3.16Å; S122-S126 PolarHBondContact O-OG 3.05Å; S122-E146 VanDerWaalsContact C-OE1 3.3Å; S122-L150 WeakPolarHBondContact OG-CD2 3.49Å; S122-A176 WeakPolarHBondContact O-CB 3.46Å
123V94.6Very high89.1Confident0 Ų07.7 Ų7.70%04%0.043CC..Hα-helixtrans-63.4-40.6176.6-170.70000112A120 M121 I125 S126 A127 V143 E146 V147A120-V123 WeakPolarHBondContact O-CB 3.08Å; A120-V123 PolarHBondContact O-N 2.9Å; A120-V123 VanDerWaalsContact O-N 3.11Å; M121-V123 VanDerWaalsContact C-N 3.25Å; M121-V123 PolarHBondContact O-N 2.94Å; V123-I125 VanDerWaalsContact C-N 3.31Å; V123-I125 PolarHBondContact O-N 3.37Å; V123-S126 PolarHBondContact O-N 2.82Å; V123-A127 WeakPolarHBondContact O-CB 3.21Å; V123-A127 PolarHBondContact O-N 2.74Å; V123-V143 HydrophobicContact CG1-CB 4.3Å; V123-V143 HydrophobicContact CG1-CG2 3.69Å; V123-E146 WeakPolarHBondContact CA-OE1 3.29Å; V123-E146 WeakPolarHBondContact CA-OE2 3.2Å; V123-E146 HydrophobicContact CG2-CB 4.07Å; V123-E146 HydrophobicContact CG2-CG 4.13Å; V123-E146 PolarHBondContact N-OE1 3.34Å; V123-V147 HydrophobicContact CG2-CG2 3.55Å
124L93Very high88.9Confident2 Ų24.7 Ų4.71%0.013%0.027CC..Hα-helixtrans-63.6-39.1177.4-58-176.2000111.5A58 L62 N80 M83 L84 A120 M121 S122 G128A58-L124 HydrophobicContact CB-CD1 3.89Å; A58-L124 WeakPolarHBondContact O-CD1 3.16Å; L62-L124 HydrophobicContact CB-CB 4.29Å; L62-L124 HydrophobicContact CB-CD1 4.38Å; L62-L124 HydrophobicContact CD1-CB 3.6Å; L62-L124 HydrophobicContact CD1-CD1 3.98Å; L62-L124 HydrophobicContact CD1-CG 4.44Å; N80-L124 HydrophobicContact CB-CD2 4.29Å; N80-L124 WeakPolarHBondContact O-CD2 3.39Å; N80-L124 WeakPolarHBondContact OD1-CD2 3.05Å; M83-L124 HydrophobicContact CB-CD2 3.73Å; M83-L124 HydrophobicContact CE-CD2 4Å; L84-L124 HydrophobicContact CB-CD1 4.24Å; L84-L124 HydrophobicContact CB-CD2 4.49Å; L84-L124 HydrophobicContact CD1-CD1 4.28Å; A120-L124 PolarHBondContact O-N 2.94Å; M121-L124 PolarHBondContact O-N 3.36Å; S122-L124 PolarHBondContact O-N 3.07Å; L124-G128 PolarHBondContact O-N 2.83Å
125I90.9Very high88.8Confident16 Ų164.2 Ų4.28%0.0823%0.026CC..Hα-helixtrans-62.6-50.6174.5-66.9165.1000109.7L62 M121 S122 V123 G128 F172 Y173 A176 H329 F332L62-I125 HydrophobicContact CD1-CG1 4.21Å; L62-I125 HydrophobicContact CD2-CG1 4.41Å; M121-I125 WeakPolarHBondContact O-CG1 3.39Å; M121-I125 PolarHBondContact O-N 3Å; S122-I125 WeakPolarHBondContact O-CB 3.29Å; S122-I125 PolarHBondContact O-N 2.75Å; V123-I125 VanDerWaalsContact C-N 3.31Å; V123-I125 PolarHBondContact O-N 3.37Å; I125-G128 PolarHBondContact O-N 3.25Å; I125-G128 VanDerWaalsContact O-N 3.17Å; I125-F172 HydrophobicContact CD1-CE2 3.98Å; I125-Y173 HydrophobicContact CD1-CD1 4.13Å; I125-Y173 HydrophobicContact CD1-CE1 4.19Å; I125-A176 HydrophobicContact CB-CB 4.05Å; I125-A176 HydrophobicContact CG2-CB 3.92Å; I125-H329 PolarHBondContact O-CE1 2.86Å; I125-H329 PolarHBondContact O-ND1 3.46Å; I125-F332 HydrophobicContact CG2-CD1 4.4Å
126S92.4Very high88.6Confident0 Ų05.1 Ų5.10%03%0.031CC..Hα-helixtrans-60.3-43.1177.9-63.20000113.1S122 V123 G128 A129 E146 A176S122-S126 PolarHBondContact O-N 3.16Å; S122-S126 PolarHBondContact O-OG 3.05Å; V123-S126 PolarHBondContact O-N 2.82Å; S126-G128 PolarHBondContact O-N 3.13Å; S126-A129 WeakPolarHBondContact O-CB 3.2Å; S126-A129 PolarHBondContact O-N 3.36Å; S126-E146 WeakPolarHBondContact CB-OE1 3.29Å; S126-E146 WeakPolarHBondContact CB-OE2 3.28Å; S126-E146 VanDerWaalsContact OG-CD 3.26Å; S126-E146 PolarHBondContact OG-OE1 2.95Å; S126-E146 PolarHBondContact OG-OE2 3.48Å; S126-A176 VanDerWaalsContact OG-C 3.31Å; S126-A176 VanDerWaalsContact OG-CA 3.26Å; S126-A176 WeakPolarHBondContact OG-CA 3.42Å; S126-A176 PolarHBondContact OG-O 3.28Å
127A89.8Confident88.4Confident0 Ų06.3 Ų6.30%04%0.041CC..Hα-helixtrans-59.9-28.8178.100000111.3M83 V123 A129 V130 L131 L139 M142M83-A127 HydrophobicContact CE-CB 3.58Å; M83-A127 HydrophobicContact SD-CB 3.78Å; V123-A127 WeakPolarHBondContact O-CB 3.21Å; V123-A127 PolarHBondContact O-N 2.74Å; A127-A129 PolarHBondContact O-N 3.05Å; A127-V130 WeakPolarHBondContact O-CG2 3.12Å; A127-V130 PolarHBondContact O-N 3.15Å; A127-L131 HydrophobicContact CB-CD1 4.05Å; A127-L131 HydrophobicContact CB-CG 4.4Å; A127-L131 WeakPolarHBondContact O-CB 3.23Å; A127-L131 WeakPolarHBondContact O-CD1 3.39Å; A127-L131 WeakPolarHBondContact O-CG 3.49Å; A127-L131 PolarHBondContact O-N 2.98Å; A127-L139 HydrophobicContact CB-CD2 4.49Å; A127-M142 HydrophobicContact CB-CE 4.42Å
128G84.3Confident88.3Confident12 Ų126.2 Ų6.212%0.1244%0.04CC..THydrogen-bonded Turntrans-55.1-21.2173.100000114.9L124 I125 S126 S326L124-G128 PolarHBondContact O-N 2.83Å; I125-G128 PolarHBondContact O-N 3.25Å; I125-G128 VanDerWaalsContact O-N 3.17Å; S126-G128 PolarHBondContact O-N 3.13Å; G128-S326 VanDerWaalsContact O-CB 3.29Å; G128-S326 WeakPolarHBondContact O-CB 3.41Å
129A83.6Confident88.3Confident4 Ų46 Ų63%0.0334%0.04CC..THydrogen-bonded Turntrans-84-24.5175.200000114S126 A127 G180 A184 H329S126-A129 WeakPolarHBondContact O-CB 3.2Å; S126-A129 PolarHBondContact O-N 3.36Å; A127-A129 PolarHBondContact O-N 3.05Å; A129-G180 WeakPolarHBondContact CB-O 3.4Å; A129-A184 HydrophobicContact CB-CB 3.95Å; A129-H329 HydrophobicContact CB-CB 4.29Å
130V84.1Confident88.3Confident0 Ų07.2 Ų7.20%05%0.047CC..THydrogen-bonded Turntrans-116.9-18.4-170.1-60.70000114A127 G132 K133 V134 L139 M142 V183 A184 L187A127-V130 WeakPolarHBondContact O-CG2 3.12Å; A127-V130 PolarHBondContact O-N 3.15Å; V130-G132 PolarHBondContact O-N 3.47Å; V130-K133 WeakPolarHBondContact O-CB 3.37Å; V130-K133 PolarHBondContact O-N 2.99Å; V130-V134 HydrophobicContact CB-CG1 4.18Å; V130-V134 HydrophobicContact CB-CG2 4.22Å; V130-V134 HydrophobicContact CG2-CG2 3.99Å; V130-L139 HydrophobicContact CG2-CD2 4.39Å; V130-M142 HydrophobicContact CG2-CE 4.24Å; V130-M142 HydrophobicContact CG2-SD 3.78Å; V130-V183 HydrophobicContact CG1-CB 4.22Å; V130-V183 HydrophobicContact CG1-CG1 3.83Å; V130-A184 HydrophobicContact CG1-CB 3.85Å; V130-L187 HydrophobicContact CB-CD1 4.04Å; V130-L187 HydrophobicContact CG1-CD1 3.79Å
131L79.6Confident88.2Confident12 Ų128.2 Ų8.26%0.0635%0.053CC..THydrogen-bonded Turntrans-49.2130.9176-92.5154.2000110.6T66 A127 F402T66-L131 HydrophobicContact CG2-CD1 3.96Å; A127-L131 HydrophobicContact CB-CD1 4.05Å; A127-L131 HydrophobicContact CB-CG 4.4Å; A127-L131 WeakPolarHBondContact O-CB 3.23Å; A127-L131 WeakPolarHBondContact O-CD1 3.39Å; A127-L131 WeakPolarHBondContact O-CG 3.49Å; A127-L131 PolarHBondContact O-N 2.98Å; L131-F402 VanDerWaalsContact O-CE1 3.23Å; L131-F402 WeakPolarHBondContact O-CE1 3.14Å
132G76.5Confident88.3Confident5 Ų58.1 Ų8.15%0.0525%0.052CC..THydrogen-bonded Turntrans91.5-14.6-174.300000115.4H72 V130 Y401 F402H72-G132 PolarHBondContact CE1-N 3.02Å; H72-G132 VanDerWaalsContact CE1-N 3.33Å; H72-G132 VanDerWaalsContact NE2-CA 3.33Å; H72-G132 WeakPolarHBondContact NE2-CA 3.2Å; H72-G132 PolarHBondContact NE2-N 2.89Å; V130-G132 PolarHBondContact O-N 3.47Å; G132-Y401 CarbonylContact O-C 3.58Å; G132-Y401 WeakPolarHBondContact O-CA 3.47Å; G132-F402 PolarHBondContact O-N 2.63Å
133K79.6Confident88.5Confident13 Ų138.1 Ų8.16%0.0575%0.052CC..THydrogen-bonded Turntrans-107.9-19.3175.5-54.8177.4-173.7160.60113.3V130 L187 H324 P396 Y401 F402V130-K133 WeakPolarHBondContact O-CB 3.37Å; V130-K133 PolarHBondContact O-N 2.99Å; K133-L187 HydrophobicContact CB-CD1 4.41Å; K133-H324 PolarHBondContact NZ-O 3.11Å; K133-P396 VanDerWaalsContact O-CG 3.26Å; K133-P396 WeakPolarHBondContact O-CG 3.26Å; K133-Y401 HydrophobicContact CB-CD1 4.48Å; K133-Y401 HydrophobicContact CB-CD2 4.28Å; K133-Y401 HydrophobicContact CB-CE1 4.25Å; K133-Y401 HydrophobicContact CB-CE2 4.04Å; K133-Y401 HydrophobicContact CB-CG 4.48Å; K133-Y401 HydrophobicContact CD-CD2 4.46Å; K133-Y401 HydrophobicContact CD-CE2 4.23Å; K133-Y401 HydrophobicContact CG-CD2 3.78Å; K133-Y401 HydrophobicContact CG-CE2 3.84Å; K133-Y401 HydrophobicContact CG-CG 4.23Å; K133-F402 HydrophobicContact CG-CZ 4.22Å
134V85.4Confident88.5Confident2 Ų210.2 Ų10.21%0.0126%0.063CC..SBendtrans-115.8152.6-175.6-61.90000111.3V130 Q138 L139 L187V130-V134 HydrophobicContact CB-CG1 4.18Å; V130-V134 HydrophobicContact CB-CG2 4.22Å; V130-V134 HydrophobicContact CG2-CG2 3.99Å; V134-Q138 VanDerWaalsContact CA-OE1 3.23Å; V134-Q138 HydrophobicContact CB-CB 3.98Å; V134-Q138 HydrophobicContact CG1-CB 4.46Å; V134-L139 HydrophobicContact CG2-CD1 4.43Å; V134-L139 HydrophobicContact CG2-CD2 3.43Å; V134-L139 VanDerWaalsContact CG2-CD2 3.43Å; V134-L139 HydrophobicContact CG2-CG 3.79Å; V134-L187 HydrophobicContact CG1-CD1 3.57Å; V134-L187 HydrophobicContact CG1-CD2 4.29Å
135N86.9Confident88.7Confident10 Ų1012 Ų125%0.0537%0.074CC..  trans-92.5172.2173.567.630.8000112A137 Q138 L139 W393 K394 F407N135-A137 VanDerWaalsContact C-N 3.29Å; N135-A137 PolarHBondContact O-N 3.05Å; N135-A137 PolarHBondContact OD1-N 3.37Å; N135-Q138 WeakPolarHBondContact O-CB 3.15Å; N135-Q138 PolarHBondContact O-N 2.94Å; N135-Q138 WeakPolarHBondContact OD1-CG 3.42Å; N135-Q138 PolarHBondContact OD1-N 2.86Å; N135-L139 PolarHBondContact O-N 3.46Å; N135-L139 VanDerWaalsContact O-N 3.08Å; N135-W393 PolarHBondContact ND2-O 3.4Å; N135-K394 PolarHBondContact ND2-O 3.12Å; N135-F407 HydrophobicContact CB-CE1 3.71Å; N135-F407 HydrophobicContact CB-CZ 3.81Å
136L87.1Confident89Confident20 Ų2011.2 Ų11.211%0.1057%0.07CC..Hα-helixtrans-61.9-32.6-177.4-172.265.5000113.5L13 F79 F82 L139 V140L13-L136 HydrophobicContact CD1-CB 3.89Å; L13-L136 HydrophobicContact CD2-CB 4.33Å; L13-L136 HydrophobicContact CD2-CD2 3.78Å; L13-L136 HydrophobicContact CG-CD2 4.48Å; F79-L136 HydrophobicContact CB-CD1 4.16Å; F79-L136 HydrophobicContact CD1-CB 4.45Å; F79-L136 HydrophobicContact CD1-CD1 3.73Å; F79-L136 HydrophobicContact CD1-CG 4.46Å; F79-L136 HydrophobicContact CE1-CB 4.17Å; F79-L136 HydrophobicContact CE1-CD1 4.26Å; F79-L136 HydrophobicContact CE1-CD2 4.42Å; F79-L136 HydrophobicContact CG-CD1 3.92Å; F79-L136 HydrophobicContact CZ-CB 4.24Å; F82-L136 HydrophobicContact CB-CD1 4.29Å; F82-L136 HydrophobicContact CD1-CD1 3.6Å; F82-L136 HydrophobicContact CD1-CD2 4.42Å; F82-L136 HydrophobicContact CD1-CG 4.26Å; F82-L136 HydrophobicContact CD2-CD2 4.41Å; F82-L136 HydrophobicContact CE1-CD1 4.14Å; F82-L136 HydrophobicContact CE1-CG 4.36Å; F82-L136 HydrophobicContact CE2-CD2 4.49Å; F82-L136 HydrophobicContact CG-CD1 3.97Å; F82-L136 HydrophobicContact CG-CD2 4.37Å; L136-L139 HydrophobicContact CD1-CD1 4.44Å; L136-L139 PolarHBondContact O-N 3.5Å; L136-V140 VanDerWaalsContact O-CG2 3.26Å; L136-V140 WeakPolarHBondContact O-CG2 3.28Å; L136-V140 PolarHBondContact O-N 3.23Å
137A87.9Confident89.2Confident26 Ų2611.2 Ų11.222%0.2157%0.07CC..Hα-helixtrans-66.8-39.917700000112L13 N135 L139 V140 V141 W393L13-A137 HydrophobicContact CD1-CB 3.99Å; N135-A137 VanDerWaalsContact C-N 3.29Å; N135-A137 PolarHBondContact O-N 3.05Å; N135-A137 PolarHBondContact OD1-N 3.37Å; A137-L139 VanDerWaalsContact C-N 3.31Å; A137-V140 WeakPolarHBondContact O-CB 3.36Å; A137-V140 PolarHBondContact O-N 2.74Å; A137-V141 PolarHBondContact O-N 3.43Å; A137-W393 HydrophobicContact CB-CE3 4.27Å
138Q90.9Very high89.5Confident2 Ų213.4 Ų13.41%0.0098%0.083CC..Hα-helixtrans-63.9-38.7173.1-71.7170.9-52.700111.3V134 N135 V141 M142 L388 W393V134-Q138 VanDerWaalsContact CA-OE1 3.23Å; V134-Q138 HydrophobicContact CB-CB 3.98Å; V134-Q138 HydrophobicContact CG1-CB 4.46Å; N135-Q138 WeakPolarHBondContact O-CB 3.15Å; N135-Q138 PolarHBondContact O-N 2.94Å; N135-Q138 WeakPolarHBondContact OD1-CG 3.42Å; N135-Q138 PolarHBondContact OD1-N 2.86Å; Q138-V141 PolarHBondContact O-N 3.49Å; Q138-M142 WeakPolarHBondContact O-CB 3.44Å; Q138-M142 PolarHBondContact O-N 3.37Å; Q138-L388 HydrophobicContact CB-CD1 4.39Å; Q138-L388 HydrophobicContact CB-CD2 3.83Å; Q138-L388 HydrophobicContact CG-CD2 4.16Å; Q138-L388 PolarHBondContact NE2-O 2.95Å; Q138-L388 VanDerWaalsContact O-CD2 3.28Å; Q138-L388 WeakPolarHBondContact O-CD2 3.43Å; Q138-W393 HydrophobicContact CG-CB 3.7Å; Q138-W393 HydrophobicContact CG-CG 3.92Å
139L92.4Very high90Very high1 Ų113.2 Ų13.21%0.0058%0.081CC..Hα-helixtrans-65.6-38.6175.7-67.7176.4000112.6F79 M83 A127 V130 V134 N135 L136 A137 V141 M142 V143F79-L139 HydrophobicContact CB-CD1 3.76Å; F79-L139 HydrophobicContact CD2-CD1 3.74Å; F79-L139 HydrophobicContact CG-CD1 4.07Å; M83-L139 HydrophobicContact CE-CD1 4.31Å; M83-L139 HydrophobicContact CG-CB 4.14Å; M83-L139 HydrophobicContact SD-CB 3.86Å; M83-L139 HydrophobicContact SD-CD1 4Å; M83-L139 HydrophobicContact SD-CD2 3.7Å; M83-L139 HydrophobicContact SD-CG 4.05Å; A127-L139 HydrophobicContact CB-CD2 4.49Å; V130-L139 HydrophobicContact CG2-CD2 4.39Å; V134-L139 HydrophobicContact CG2-CD1 4.43Å; V134-L139 HydrophobicContact CG2-CD2 3.43Å; V134-L139 VanDerWaalsContact CG2-CD2 3.43Å; V134-L139 HydrophobicContact CG2-CG 3.79Å; N135-L139 PolarHBondContact O-N 3.46Å; N135-L139 VanDerWaalsContact O-N 3.08Å; L136-L139 HydrophobicContact CD1-CD1 4.44Å; L136-L139 PolarHBondContact O-N 3.5Å; A137-L139 VanDerWaalsContact C-N 3.31Å; L139-V141 VanDerWaalsContact C-N 3.33Å; L139-V141 PolarHBondContact O-N 2.91Å; L139-M142 HydrophobicContact CD2-SD 4.44Å; L139-M142 WeakPolarHBondContact O-CB 3.41Å; L139-M142 PolarHBondContact O-N 3.5Å; L139-V143 VanDerWaalsContact O-CG2 3.25Å; L139-V143 WeakPolarHBondContact O-CG2 3.33Å; L139-V143 PolarHBondContact O-N 3.14Å
140V93.1Very high90.5Very high25 Ų2513.1 Ų13.115%0.1528%0.079CC..Hα-helixtrans-56.3-48.8173.2170.70000110.6L20 F82 L86 L136 A137 M142 V143 L144L20-V140 HydrophobicContact CD2-CG1 3.57Å; F82-V140 HydrophobicContact CE1-CG2 3.57Å; F82-V140 HydrophobicContact CZ-CG2 4.12Å; L86-V140 HydrophobicContact CD2-CB 4.3Å; L86-V140 HydrophobicContact CD2-CG1 3.93Å; L86-V140 HydrophobicContact CD2-CG2 4.29Å; L136-V140 VanDerWaalsContact O-CG2 3.26Å; L136-V140 WeakPolarHBondContact O-CG2 3.28Å; L136-V140 PolarHBondContact O-N 3.23Å; A137-V140 WeakPolarHBondContact O-CB 3.36Å; A137-V140 PolarHBondContact O-N 2.74Å; V140-M142 VanDerWaalsContact C-N 3.34Å; V140-M142 PolarHBondContact O-N 3.28Å; V140-V143 PolarHBondContact O-N 3.4Å; V140-L144 HydrophobicContact CG1-CD1 4.31Å; V140-L144 WeakPolarHBondContact O-CG 3.21Å; V140-L144 PolarHBondContact O-N 3.02Å; V140-L144 VanDerWaalsContact O-N 3.09Å
141V93.6Very high90.9Very high20 Ų2013.1 Ų13.112%0.1218%0.079CC..Hα-helixtrans-63.1-43.1179.1174.40000111A137 Q138 L139 V143 L144 V145 L387 L388 W393A137-V141 PolarHBondContact O-N 3.43Å; Q138-V141 PolarHBondContact O-N 3.49Å; L139-V141 VanDerWaalsContact C-N 3.33Å; L139-V141 PolarHBondContact O-N 2.91Å; V141-V143 PolarHBondContact O-N 3.35Å; V141-L144 PolarHBondContact O-N 3.49Å; V141-V145 HydrophobicContact CG1-CG2 4.35Å; V141-V145 WeakPolarHBondContact O-CG2 3.4Å; V141-V145 PolarHBondContact O-N 3.42Å; V141-L387 HydrophobicContact CG1-CD2 3.37Å; V141-L387 HydrophobicContact CG1-CG 4.17Å; V141-L388 HydrophobicContact CB-CD2 3.97Å; V141-L388 HydrophobicContact CG1-CD2 3.97Å; V141-W393 HydrophobicContact CG2-CH2 3.51Å; V141-W393 HydrophobicContact CG2-CZ2 3.88Å; V141-W393 HydrophobicContact CG2-CZ3 3.93Å
142M95.4Very high91.4Very high0 Ų014.9 Ų14.90%09%0.091CC..Hα-helixtrans-58.4-46.2176.2-175.4175167.800111.8A127 V130 Q138 L139 V140 L144 V145 E146 F179 T384 L388A127-M142 HydrophobicContact CB-CE 4.42Å; V130-M142 HydrophobicContact CG2-CE 4.24Å; V130-M142 HydrophobicContact CG2-SD 3.78Å; Q138-M142 WeakPolarHBondContact O-CB 3.44Å; Q138-M142 PolarHBondContact O-N 3.37Å; L139-M142 HydrophobicContact CD2-SD 4.44Å; L139-M142 WeakPolarHBondContact O-CB 3.41Å; L139-M142 PolarHBondContact O-N 3.5Å; V140-M142 VanDerWaalsContact C-N 3.34Å; V140-M142 PolarHBondContact O-N 3.28Å; M142-L144 PolarHBondContact O-N 3.05Å; M142-V145 PolarHBondContact O-N 2.97Å; M142-E146 WeakPolarHBondContact CE-OE2 3.3Å; M142-E146 WeakPolarHBondContact O-CB 3.23Å; M142-E146 PolarHBondContact O-N 3.3Å; M142-F179 HydrophobicContact CE-CD1 4.23Å; M142-F179 HydrophobicContact CE-CE1 3.94Å; M142-F179 HydrophobicContact CG-CE1 4.04Å; M142-T384 HydrophobicContact CB-CG2 4.37Å; M142-T384 HydrophobicContact CG-CG2 4.32Å; M142-L388 HydrophobicContact CB-CD1 4.36Å
143V96.8Very high92.1Very high0 Ų014.8 Ų14.80%09%0.089CC..Hα-helixtrans-56.5-50.2175.7172.70000110.9M83 L86 V123 L139 V140 V141 V145 V147M83-V143 HydrophobicContact CB-CG2 3.77Å; M83-V143 HydrophobicContact CG-CG2 3.65Å; M83-V143 HydrophobicContact SD-CG2 4.33Å; L86-V143 HydrophobicContact CB-CG1 4.43Å; L86-V143 HydrophobicContact CD2-CB 4.18Å; L86-V143 HydrophobicContact CD2-CG1 4.04Å; L86-V143 HydrophobicContact CG-CG1 4.02Å; V123-V143 HydrophobicContact CG1-CB 4.3Å; V123-V143 HydrophobicContact CG1-CG2 3.69Å; L139-V143 VanDerWaalsContact O-CG2 3.25Å; L139-V143 WeakPolarHBondContact O-CG2 3.33Å; L139-V143 PolarHBondContact O-N 3.14Å; V140-V143 PolarHBondContact O-N 3.4Å; V141-V143 PolarHBondContact O-N 3.35Å; V143-V145 PolarHBondContact O-N 3.39Å; V143-V147 HydrophobicContact CG1-CG2 4.33Å; V143-V147 WeakPolarHBondContact O-CB 3.4Å; V143-V147 VanDerWaalsContact O-CG2 3.23Å; V143-V147 WeakPolarHBondContact O-CG2 3.41Å; V143-V147 PolarHBondContact O-N 2.79Å; V143-V147 VanDerWaalsContact O-N 3.1Å
144L95.9Very high92.6Very high44 Ų4414.2 Ų14.223%0.239%0.087CC..Hα-helixtrans-62.6-44.6-177.1-66.6175.5000111.7L20 W90 V140 V141 M142 T148L20-L144 HydrophobicContact CD1-CD1 4.42Å; L20-L144 HydrophobicContact CD2-CD1 4.49Å; W90-L144 HydrophobicContact CB-CD2 4.38Å; W90-L144 HydrophobicContact CD2-CD2 3.84Å; W90-L144 HydrophobicContact CE3-CD2 4.49Å; W90-L144 HydrophobicContact CG-CD2 3.74Å; W90-L144 PolarHBondContact NE1-O 3.34Å; W90-L144 VanDerWaalsContact NE1-O 3.13Å; V140-L144 HydrophobicContact CG1-CD1 4.31Å; V140-L144 WeakPolarHBondContact O-CG 3.21Å; V140-L144 PolarHBondContact O-N 3.02Å; V140-L144 VanDerWaalsContact O-N 3.09Å; V141-L144 PolarHBondContact O-N 3.49Å; M142-L144 PolarHBondContact O-N 3.05Å; L144-T148 WeakPolarHBondContact O-CB 3.37Å; L144-T148 PolarHBondContact O-N 3.05Å; L144-T148 PolarHBondContact O-OG1 2.95Å
145V96.9Very high92.7Very high39 Ų3916.5 Ų16.524%0.23610%0.098CC..Hα-helixtrans-71.5-46.7-178.6179.10000111.5V141 M142 V143 T148 A149 T384V141-V145 HydrophobicContact CG1-CG2 4.35Å; V141-V145 WeakPolarHBondContact O-CG2 3.4Å; V141-V145 PolarHBondContact O-N 3.42Å; M142-V145 PolarHBondContact O-N 2.97Å; V143-V145 PolarHBondContact O-N 3.39Å; V145-T148 PolarHBondContact O-N 2.64Å; V145-A149 WeakPolarHBondContact O-CB 3.38Å; V145-A149 PolarHBondContact O-N 3.35Å; V145-T384 WeakPolarHBondContact CG1-OG1 3.42Å
146E96.8Very high92.8Very high0 Ų018.3 Ų18.30%011%0.109CC..Hα-helixtrans-66.4-44.8-174.9-171.8175164.700112.3S122 V123 S126 M142 T148 A149 L150 F175 F179S122-E146 VanDerWaalsContact C-OE1 3.3Å; V123-E146 WeakPolarHBondContact CA-OE1 3.29Å; V123-E146 WeakPolarHBondContact CA-OE2 3.2Å; V123-E146 HydrophobicContact CG2-CB 4.07Å; V123-E146 HydrophobicContact CG2-CG 4.13Å; V123-E146 PolarHBondContact N-OE1 3.34Å; S126-E146 WeakPolarHBondContact CB-OE1 3.29Å; S126-E146 WeakPolarHBondContact CB-OE2 3.28Å; S126-E146 VanDerWaalsContact OG-CD 3.26Å; S126-E146 PolarHBondContact OG-OE1 2.95Å; S126-E146 PolarHBondContact OG-OE2 3.48Å; M142-E146 WeakPolarHBondContact CE-OE2 3.3Å; M142-E146 WeakPolarHBondContact O-CB 3.23Å; M142-E146 PolarHBondContact O-N 3.3Å; E146-T148 VanDerWaalsContact C-N 3.28Å; E146-T148 PolarHBondContact O-N 2.58Å; E146-A149 PolarHBondContact O-N 2.81Å; E146-L150 WeakPolarHBondContact O-CB 3.23Å; E146-L150 PolarHBondContact O-N 3.49Å; E146-F175 HydrophobicContact CG-CE1 4Å; E146-F179 HydrophobicContact CB-CD1 4.25Å; E146-F179 HydrophobicContact CB-CE1 3.63Å; E146-F179 HydrophobicContact CB-CE2 4.19Å; E146-F179 HydrophobicContact CB-CZ 3.59Å; E146-F179 HydrophobicContact CG-CD1 3.73Å; E146-F179 HydrophobicContact CG-CD2 4.32Å; E146-F179 HydrophobicContact CG-CE1 3.66Å; E146-F179 HydrophobicContact CG-CE2 4.23Å; E146-F179 HydrophobicContact CG-CG 4.08Å; E146-F179 HydrophobicContact CG-CZ 3.92Å; E146-F179 VanDerWaalsContact OE2-CD1 3.23Å; E146-F179 WeakPolarHBondContact OE2-CD1 3.26Å; E146-F179 WeakPolarHBondContact OE2-CE1 3.29Å
147V96.4Very high92.8Very high1 Ų117.3 Ų17.31%0.00610%0.104CC..Hα-helixtrans-64.2-36.9176.8178.80000110.7A91 L94 V123 V143 L150 G151A91-V147 HydrophobicContact CB-CG1 3.64Å; L94-V147 HydrophobicContact CD1-CB 4.28Å; L94-V147 HydrophobicContact CD1-CG1 3.7Å; V123-V147 HydrophobicContact CG2-CG2 3.55Å; V143-V147 HydrophobicContact CG1-CG2 4.33Å; V143-V147 WeakPolarHBondContact O-CB 3.4Å; V143-V147 VanDerWaalsContact O-CG2 3.23Å; V143-V147 WeakPolarHBondContact O-CG2 3.41Å; V143-V147 PolarHBondContact O-N 2.79Å; V143-V147 VanDerWaalsContact O-N 3.1Å; V147-L150 PolarHBondContact O-N 3.03Å; V147-G151 PolarHBondContact O-N 2.65Å
148T95.8Very high92.7Very high45 Ų4517.1 Ų17.128%0.27610%0.101SC..Hα-helixtrans-65.3-44.2174.4-52.80000111.3W90 L94 L144 V145 E146 L150 G151 T152W90-T148 PolarHBondContact NE1-OG1 3.45Å; L94-T148 HydrophobicContact CD2-CG2 4.36Å; L144-T148 WeakPolarHBondContact O-CB 3.37Å; L144-T148 PolarHBondContact O-N 3.05Å; L144-T148 PolarHBondContact O-OG1 2.95Å; V145-T148 PolarHBondContact O-N 2.64Å; E146-T148 VanDerWaalsContact C-N 3.28Å; E146-T148 PolarHBondContact O-N 2.58Å; T148-L150 VanDerWaalsContact C-N 3.33Å; T148-L150 PolarHBondContact O-N 2.85Å; T148-G151 PolarHBondContact O-N 2.84Å; T148-T152 HydrophobicContact CG2-CG2 4.46Å; T148-T152 WeakPolarHBondContact O-CB 3.43Å; T148-T152 WeakPolarHBondContact O-CG2 3.47Å; T148-T152 PolarHBondContact O-N 3.43Å; T148-T152 PolarHBondContact O-OG1 2.88Å
149A95.8Very high92.5Very high8 Ų822.2 Ų22.27%0.06613%0.128CC..Hα-helixtrans-63.2-39.2177.100000111.8V145 E146 T152 L153 F175 I376V145-A149 WeakPolarHBondContact O-CB 3.38Å; V145-A149 PolarHBondContact O-N 3.35Å; E146-A149 PolarHBondContact O-N 2.81Å; A149-T152 WeakPolarHBondContact CA-OG1 3.48Å; A149-T152 PolarHBondContact O-OG1 3Å; A149-L153 WeakPolarHBondContact O-CB 3.22Å; A149-L153 PolarHBondContact O-N 3.43Å; A149-F175 HydrophobicContact CB-CE2 4.48Å; A149-F175 HydrophobicContact CB-CZ 3.8Å; A149-I376 HydrophobicContact CB-CG2 4.43Å
150L93.6Very high92.1Very high2 Ų227.1 Ų27.11%0.0115%0.153CC..Hα-helixtrans-70.2-39.2175.4-175.859.6000112.5S122 E146 V147 T148 L153 R154 L169 F175S122-L150 WeakPolarHBondContact OG-CD2 3.49Å; E146-L150 WeakPolarHBondContact O-CB 3.23Å; E146-L150 PolarHBondContact O-N 3.49Å; V147-L150 PolarHBondContact O-N 3.03Å; T148-L150 VanDerWaalsContact C-N 3.33Å; T148-L150 PolarHBondContact O-N 2.85Å; L150-L153 HydrophobicContact CD1-CD2 4.24Å; L150-R154 WeakPolarHBondContact O-CG 3.41Å; L150-R154 PolarHBondContact O-N 3.35Å; L150-R154 VanDerWaalsContact O-N 3.08Å; L150-L169 HydrophobicContact CD2-CD2 4.23Å; L150-F175 HydrophobicContact CB-CD1 4.37Å; L150-F175 HydrophobicContact CB-CE1 3.86Å; L150-F175 HydrophobicContact CB-CZ 4.22Å; L150-F175 HydrophobicContact CD1-CD1 3.89Å; L150-F175 HydrophobicContact CD1-CE1 4.23Å; L150-F175 HydrophobicContact CD1-CG 4.13Å
151G91.9Very high91.5Very high0 Ų028 Ų280%016%0.155CC..Hα-helixtrans-62.6-45173.500000112.3V147 T148 R154 M155V147-G151 PolarHBondContact O-N 2.65Å; T148-G151 PolarHBondContact O-N 2.84Å; G151-R154 PolarHBondContact O-N 3Å; G151-M155 PolarHBondContact O-N 3.41Å
152T90.7Very high90.7Very high50 Ų5034.3 Ų34.331%0.30719%0.188SC..Hα-helixtrans-65.8-40.6176.352.20000112.2T148 A149 R154 M155 V156T148-T152 HydrophobicContact CG2-CG2 4.46Å; T148-T152 WeakPolarHBondContact O-CB 3.43Å; T148-T152 WeakPolarHBondContact O-CG2 3.47Å; T148-T152 PolarHBondContact O-N 3.43Å; T148-T152 PolarHBondContact O-OG1 2.88Å; A149-T152 WeakPolarHBondContact CA-OG1 3.48Å; A149-T152 PolarHBondContact O-OG1 3Å; T152-R154 VanDerWaalsContact C-N 3.32Å; T152-R154 PolarHBondContact O-N 2.91Å; T152-M155 PolarHBondContact O-N 3.36Å; T152-V156 WeakPolarHBondContact O-CB 3.39Å; T152-V156 VanDerWaalsContact O-CG2 3.25Å; T152-V156 WeakPolarHBondContact O-CG2 3.49Å; T152-V156 PolarHBondContact O-N 3.34Å
153L91.6Very high89.6Confident2 Ų236.1 Ų36.11%0.0120%0.199CC..Hα-helixtrans-54.6-48.2171.3173.364.6000111.2A149 L150 M155 V156 I157 F175 L372 A373 I376A149-L153 WeakPolarHBondContact O-CB 3.22Å; A149-L153 PolarHBondContact O-N 3.43Å; L150-L153 HydrophobicContact CD1-CD2 4.24Å; L153-M155 PolarHBondContact O-N 3.39Å; L153-V156 PolarHBondContact O-N 3.22Å; L153-I157 HydrophobicContact CD1-CD1 3.66Å; L153-I157 HydrophobicContact CD1-CG1 4.08Å; L153-I157 HydrophobicContact CG-CD1 3.93Å; L153-I157 WeakPolarHBondContact O-CB 3.4Å; L153-I157 WeakPolarHBondContact O-CG1 3.34Å; L153-I157 PolarHBondContact O-N 3.48Å; L153-F175 HydrophobicContact CD2-CB 4.49Å; L153-F175 HydrophobicContact CD2-CD2 3.65Å; L153-F175 HydrophobicContact CD2-CE2 4.21Å; L153-F175 HydrophobicContact CD2-CG 4.24Å; L153-L372 HydrophobicContact CD1-CD2 4.23Å; L153-L372 HydrophobicContact CD1-CG 4.03Å; L153-A373 HydrophobicContact CD1-CB 4.11Å; L153-A373 HydrophobicContact CD2-CB 3.81Å; L153-I376 HydrophobicContact CB-CD1 4.2Å; L153-I376 HydrophobicContact CD1-CD1 3.81Å
154R89.9Confident88.2Confident1 Ų140.3 Ų40.30%0.00422%0.222CC..Hα-helixtrans-62.2-42178.3-75.6-173.2-72.6153.4-1.2112.7D95 S119 L150 G151 T152 S158 Y165 N168D95-R154 VanDerWaalsContact CG-NH2 3.3Å; D95-R154 IonicContact OD1-CZ 2.63Å; D95-R154 IonicContact OD1-NH1 3.6Å; D95-R154 PolarHBondContact OD1-NH1 2.61Å; D95-R154 IonicContact OD1-NH2 3.87Å; D95-R154 PolarHBondContact OD1-NH2 3.13Å; D95-R154 IonicContact OD2-CZ 3.61Å; D95-R154 IonicContact OD2-NH1 3.35Å; D95-R154 PolarHBondContact OD2-NH1 3.46Å; D95-R154 IonicContact OD2-NH2 3.63Å; D95-R154 PolarHBondContact OD2-NH2 3.29Å; S119-R154 PolarHBondContact OG-NH2 3.06Å; L150-R154 WeakPolarHBondContact O-CG 3.41Å; L150-R154 PolarHBondContact O-N 3.35Å; L150-R154 VanDerWaalsContact O-N 3.08Å; G151-R154 PolarHBondContact O-N 3Å; T152-R154 VanDerWaalsContact C-N 3.32Å; T152-R154 PolarHBondContact O-N 2.91Å; R154-S158 VanDerWaalsContact O-CB 3.31Å; R154-S158 WeakPolarHBondContact O-CB 3.34Å; R154-S158 PolarHBondContact O-N 3.33Å; R154-Y165 HydrophobicContact CB-CD2 4.18Å; R154-Y165 HydrophobicContact CB-CE2 3.84Å; R154-N168 HydrophobicContact CB-CB 4.25Å; R154-N168 HydrophobicContact CG-CB 3.93Å; R154-N168 WeakPolarHBondContact CG-O 3.35Å; R154-N168 PolarHBondContact O-ND2 3.45Å
155M88.2Confident86.6Confident50 Ų5039.1 Ų39.125%0.24622%0.215CC..Hα-helixtrans-62-49.7176.3-174.8-152.9-78.700111L98 G151 T152 L153 I157 S158 N159 Y165L98-M155 HydrophobicContact CB-CE 3.55Å; L98-M155 HydrophobicContact CD1-CE 4.44Å; L98-M155 HydrophobicContact CD2-CE 3.23Å; L98-M155 HydrophobicContact CG-CE 3.84Å; G151-M155 PolarHBondContact O-N 3.41Å; T152-M155 PolarHBondContact O-N 3.36Å; L153-M155 PolarHBondContact O-N 3.39Å; M155-I157 PolarHBondContact O-N 2.89Å; M155-S158 PolarHBondContact O-N 3.38Å; M155-N159 WeakPolarHBondContact O-CB 3.47Å; M155-N159 VanDerWaalsContact O-CG 3.28Å; M155-N159 PolarHBondContact O-N 2.94Å; M155-Y165 HydrophobicContact CB-CD2 4.45Å; M155-Y165 HydrophobicContact CB-CE2 3.96Å
156V89.1Confident84.7Confident48 Ų4839.4 Ų39.429%0.29121%0.213SC..Hα-helixtrans-62.6-44.2-178.5174.80000110.4T152 L153 S158 N159 I160 L372T152-V156 WeakPolarHBondContact O-CB 3.39Å; T152-V156 VanDerWaalsContact O-CG2 3.25Å; T152-V156 WeakPolarHBondContact O-CG2 3.49Å; T152-V156 PolarHBondContact O-N 3.34Å; L153-V156 PolarHBondContact O-N 3.22Å; V156-S158 PolarHBondContact O-N 3.46Å; V156-N159 PolarHBondContact O-N 3.36Å; V156-I160 HydrophobicContact CG1-CD1 3.49Å; V156-I160 VanDerWaalsContact CG1-CD1 3.49Å; V156-I160 HydrophobicContact CG1-CG1 4.23Å; V156-I160 WeakPolarHBondContact O-CB 3.32Å; V156-I160 VanDerWaalsContact O-CG1 3.29Å; V156-I160 WeakPolarHBondContact O-CG1 3.39Å; V156-I160 PolarHBondContact O-N 3.08Å; V156-L372 HydrophobicContact CB-CD2 4.41Å; V156-L372 HydrophobicContact CG1-CD2 3.68Å
157I87.2Confident82.9Confident0 Ų041.8 Ų41.80%023%0.225CC..Hα-helixtrans-60.6-46.9175.7-70.1173.8000110.5L153 M155 N159 I160 F161 N168 E369 L372L153-I157 HydrophobicContact CD1-CD1 3.66Å; L153-I157 HydrophobicContact CD1-CG1 4.08Å; L153-I157 HydrophobicContact CG-CD1 3.93Å; L153-I157 WeakPolarHBondContact O-CB 3.4Å; L153-I157 WeakPolarHBondContact O-CG1 3.34Å; L153-I157 PolarHBondContact O-N 3.48Å; M155-I157 PolarHBondContact O-N 2.89Å; I157-N159 VanDerWaalsContact C-N 3.34Å; I157-N159 PolarHBondContact O-N 3.26Å; I157-I160 PolarHBondContact O-N 3.11Å; I157-F161 HydrophobicContact CB-CD2 4.43Å; I157-F161 HydrophobicContact CG2-CD2 4.06Å; I157-F161 WeakPolarHBondContact O-CB 3.48Å; I157-F161 WeakPolarHBondContact O-CD2 3.35Å; I157-F161 PolarHBondContact O-N 3.35Å; I157-N168 HydrophobicContact CG2-CB 4.38Å; I157-E369 HydrophobicContact CD1-CB 4.49Å; I157-E369 HydrophobicContact CG2-CG 4.18Å; I157-L372 HydrophobicContact CG1-CD2 3.92Å
158S85.9Confident81.3Confident22 Ų2242 Ų4215%0.15423%0.226CC..Hα-helixtrans-60.4-43.9179.9-170.80000112R154 M155 V156 N162 T163 Y165 N168R154-S158 VanDerWaalsContact O-CB 3.31Å; R154-S158 WeakPolarHBondContact O-CB 3.34Å; R154-S158 PolarHBondContact O-N 3.33Å; M155-S158 PolarHBondContact O-N 3.38Å; V156-S158 PolarHBondContact O-N 3.46Å; S158-N162 WeakPolarHBondContact O-CA 3.32Å; S158-N162 PolarHBondContact O-N 3.2Å; S158-T163 WeakPolarHBondContact CB-O 3.12Å; S158-T163 PolarHBondContact O-N 3.26Å; S158-T163 PolarHBondContact OG-O 2.59Å; S158-Y165 PolarHBondContact OG-N 3.48Å; S158-N168 PolarHBondContact N-ND2 2.97Å
159N85.4Confident80.1Confident108 Ų10840.2 Ų40.258%0.57822%0.215SC*.Hα-helixtrans-71.5-37.2-178.5-70.6-11.7000113.4M155 V156 I157M155-N159 WeakPolarHBondContact O-CB 3.47Å; M155-N159 VanDerWaalsContact O-CG 3.28Å; M155-N159 PolarHBondContact O-N 2.94Å; V156-N159 PolarHBondContact O-N 3.36Å; I157-N159 VanDerWaalsContact C-N 3.34Å; I157-N159 PolarHBondContact O-N 3.26Å
160I85.1Confident79.1Confident104 Ų10442.2 Ų42.253%0.53322%0.221SC..Hα-helixtrans-80-43-178.5-66.4176.7000111.1V156 I157V156-I160 HydrophobicContact CG1-CD1 3.49Å; V156-I160 VanDerWaalsContact CG1-CD1 3.49Å; V156-I160 HydrophobicContact CG1-CG1 4.23Å; V156-I160 WeakPolarHBondContact O-CB 3.32Å; V156-I160 VanDerWaalsContact O-CG1 3.29Å; V156-I160 WeakPolarHBondContact O-CG1 3.39Å; V156-I160 PolarHBondContact O-N 3.08Å; I157-I160 PolarHBondContact O-N 3.11Å
161F80.1Confident78.7Confident44 Ų4442.4 Ų42.419%0.19322%0.221CC..Hα-helixtrans-102.10.7-170.3-60.5-83.2000113.5I157 T163 L365 E369I157-F161 HydrophobicContact CB-CD2 4.43Å; I157-F161 HydrophobicContact CG2-CD2 4.06Å; I157-F161 WeakPolarHBondContact O-CB 3.48Å; I157-F161 WeakPolarHBondContact O-CD2 3.35Å; I157-F161 PolarHBondContact O-N 3.35Å; F161-T163 HydrophobicContact CB-CG2 3.94Å; F161-T163 PolarHBondContact O-N 3.46Å; F161-L365 HydrophobicContact CD1-CB 4.05Å; F161-L365 HydrophobicContact CD1-CD1 4.31Å; F161-L365 HydrophobicContact CD1-CD2 3.69Å; F161-L365 HydrophobicContact CD1-CG 4.19Å; F161-L365 HydrophobicContact CE1-CB 4Å; F161-L365 HydrophobicContact CE1-CD2 3.56Å; F161-L365 HydrophobicContact CE1-CG 4.27Å; F161-E369 HydrophobicContact CD1-CG 4.27Å; F161-E369 HydrophobicContact CD2-CG 3.72Å; F161-E369 HydrophobicContact CE1-CG 4.16Å; F161-E369 HydrophobicContact CE2-CG 3.6Å; F161-E369 HydrophobicContact CG-CG 4.08Å; F161-E369 HydrophobicContact CZ-CG 3.83Å
162N76.8Confident78.4Confident152 Ų15243 Ų4381%0.81322%0.224SC*.  trans52.137.6-176.1-68.1-45.6000112.9S158S158-N162 WeakPolarHBondContact O-CA 3.32Å; S158-N162 PolarHBondContact O-N 3.2Å
163T72.4Confident78.3Confident38 Ų3840.9 Ų40.923%0.23321%0.211CC..  trans-97157.1179.153.50000111.3S158 F161 Y165 N168S158-T163 WeakPolarHBondContact CB-O 3.12Å; S158-T163 PolarHBondContact O-N 3.26Å; S158-T163 PolarHBondContact OG-O 2.59Å; F161-T163 HydrophobicContact CB-CG2 3.94Å; F161-T163 PolarHBondContact O-N 3.46Å; T163-Y165 PolarHBondContact O-N 3.24Å; T163-Y165 VanDerWaalsContact O-N 3.08Å; T163-N168 PolarHBondContact OG1-ND2 3.49Å; T163-N168 PolarHBondContact OG1-OD1 3.42Å
164D67.9Low78.3Confident89 Ų8940.8 Ų40.848%0.47621%0.21SC..  trans-59.7110.9177.1-89-27.4000111.3H166 M167 N168 R229D164-H166 PolarHBondContact O-N 3.45Å; D164-H166 VanDerWaalsContact O-N 3.09Å; D164-M167 HydrophobicContact CB-CB 3.88Å; D164-M167 HydrophobicContact CB-CG 3.56Å; D164-M167 PolarHBondContact O-N 3.47Å; D164-N168 PolarHBondContact O-N 3.16Å; D164-N168 PolarHBondContact O-ND2 3.04Å; D164-N168 PolarHBondContact O-OD1 3.34Å; D164-R229 IonicContact OD1-NH1 3.93Å; D164-R229 IonicContact OD2-CZ 2.93Å; D164-R229 IonicContact OD2-NH1 3.94Å; D164-R229 PolarHBondContact OD2-NH1 3.27Å
165Y62.3Low78.4Confident19 Ų1940.8 Ų40.88%0.07521%0.21CC..G310 helixtrans-45.8-45178.3175.2-93000113.1D95 R154 M155 S158 T163 M167 N168D95-Y165 HydrophobicContact CB-CE1 4.48Å; D95-Y165 WeakPolarHBondContact OD1-CE1 3.29Å; D95-Y165 PolarHBondContact OD1-OH 2.95Å; R154-Y165 HydrophobicContact CB-CD2 4.18Å; R154-Y165 HydrophobicContact CB-CE2 3.84Å; M155-Y165 HydrophobicContact CB-CD2 4.45Å; M155-Y165 HydrophobicContact CB-CE2 3.96Å; S158-Y165 PolarHBondContact OG-N 3.48Å; T163-Y165 PolarHBondContact O-N 3.24Å; T163-Y165 VanDerWaalsContact O-N 3.08Å; Y165-M167 VanDerWaalsContact C-N 3.27Å; Y165-M167 PolarHBondContact O-N 2.72Å; Y165-N168 PolarHBondContact O-N 3.4Å
166H56.6Low78.6Confident45 Ų4538.4 Ų38.421%0.20820%0.198CC..G310 helixtrans-73-14.5-177.2-64.8-62.7000114.4F111 L115 D164F111-H166 HydrophobicContact CE1-CB 3.67Å; F111-H166 AromaticContact CE1-CG 3.91Å; F111-H166 HydrophobicContact CZ-CB 3.91Å; L115-H166 WeakPolarHBondContact CD1-O 3.48Å; L115-H166 HydrophobicContact CD2-CB 4.28Å; L115-H166 WeakPolarHBondContact CD2-ND1 3.41Å; D164-H166 PolarHBondContact O-N 3.45Å; D164-H166 VanDerWaalsContact O-N 3.09Å
167M57.8Low78.7Confident50 Ų5036.1 Ų36.125%0.24618%0.184CC..G310 helixtrans-98.3-7.9179.5-59.1-69.397.600112.5F111 D164 Y165 L169 L227 R229F111-M167 HydrophobicContact CE2-CE 3.94Å; F111-M167 HydrophobicContact CZ-CE 3.52Å; D164-M167 HydrophobicContact CB-CB 3.88Å; D164-M167 HydrophobicContact CB-CG 3.56Å; D164-M167 PolarHBondContact O-N 3.47Å; Y165-M167 VanDerWaalsContact C-N 3.27Å; Y165-M167 PolarHBondContact O-N 2.72Å; M167-L169 PolarHBondContact O-N 2.93Å; M167-L227 HydrophobicContact CE-CB 4.38Å; M167-L227 WeakPolarHBondContact CE-O 3.29Å; M167-R229 HydrophobicContact CE-CG 4.36Å; M167-R229 HydrophobicContact SD-CG 4.23Å
168N62.4Low78.9Confident6 Ų638.5 Ų38.53%0.03219%0.194CC..THydrogen-bonded Turntrans-78.829-171.7-69.8-18.4000114.7R154 I157 S158 T163 D164 Y165 R170R154-N168 HydrophobicContact CB-CB 4.25Å; R154-N168 HydrophobicContact CG-CB 3.93Å; R154-N168 WeakPolarHBondContact CG-O 3.35Å; R154-N168 PolarHBondContact O-ND2 3.45Å; I157-N168 HydrophobicContact CG2-CB 4.38Å; S158-N168 PolarHBondContact N-ND2 2.97Å; T163-N168 PolarHBondContact OG1-ND2 3.49Å; T163-N168 PolarHBondContact OG1-OD1 3.42Å; D164-N168 PolarHBondContact O-N 3.16Å; D164-N168 PolarHBondContact O-ND2 3.04Å; D164-N168 PolarHBondContact O-OD1 3.34Å; Y165-N168 PolarHBondContact O-N 3.4Å; N168-R170 VanDerWaalsContact C-N 3.29Å
169L70.9Confident79.3Confident7 Ų737.4 Ų37.44%0.03719%0.186CC..THydrogen-bonded Turntrans-8911.4169.1-88.7123.3000113L115 M118 L150 M167 H171 F172 L227L115-L169 HydrophobicContact CD1-CD1 3.24Å; L115-L169 HydrophobicContact CG-CD1 4.33Å; M118-L169 HydrophobicContact CB-CD2 4.03Å; L150-L169 HydrophobicContact CD2-CD2 4.23Å; M167-L169 PolarHBondContact O-N 2.93Å; L169-H171 PolarHBondContact O-N 3.4Å; L169-H171 VanDerWaalsContact O-N 3.17Å; L169-F172 HydrophobicContact CB-CB 4.4Å; L169-F172 HydrophobicContact CD2-CB 3.74Å; L169-F172 HydrophobicContact CD2-CG 4.23Å; L169-F172 WeakPolarHBondContact O-CB 3.42Å; L169-F172 WeakPolarHBondContact O-CD1 3.47Å; L169-F172 PolarHBondContact O-N 2.95Å; L169-F172 VanDerWaalsContact O-N 3.1Å; L169-L227 HydrophobicContact CB-CD1 3.75Å; L169-L227 HydrophobicContact CD1-CD1 3.64Å; L169-L227 HydrophobicContact CG-CD1 4.26Å
170R75.9Confident79.6Confident50 Ų5032.3 Ų32.319%0.18916%0.159CC..THydrogen-bonded Turntrans-48.7-46.7176.5-168.2-173.3-52.6106.5-8.4111.5N168 F172 T283 E369N168-R170 VanDerWaalsContact C-N 3.29Å; R170-F172 VanDerWaalsContact C-N 3.29Å; R170-F172 PolarHBondContact O-N 3.45Å; R170-T283 HydrophobicContact CG-CG2 4.15Å; R170-T283 WeakPolarHBondContact O-CG2 3.4Å; R170-E369 IonicContact CZ-OE2 2.72Å; R170-E369 IonicContact NH1-OE2 3.23Å; R170-E369 PolarHBondContact NH1-OE2 2.77Å; R170-E369 IonicContact NH2-OE2 3.61Å
171H84.1Confident79.8Confident5 Ų529.2 Ų29.22%0.02314%0.143CC..THydrogen-bonded Turntrans-86.311.7-173.5-52.3-57.4000114.9L169 Y173 V174 F175 E340 E369 A373L169-H171 PolarHBondContact O-N 3.4Å; L169-H171 VanDerWaalsContact O-N 3.17Å; H171-Y173 PolarHBondContact O-N 3.17Å; H171-V174 PolarHBondContact O-N 2.99Å; H171-F175 VanDerWaalsContact O-CB 3.29Å; H171-F175 WeakPolarHBondContact O-CB 3.48Å; H171-F175 PolarHBondContact O-N 2.84Å; H171-E340 VanDerWaalsContact CA-OE1 3.32Å; H171-E340 WeakPolarHBondContact CA-OE1 3.48Å; H171-E340 IonicContact CE1-OE1 3.12Å; H171-E340 IonicContact CE1-OE2 3.9Å; H171-E340 PolarHBondContact CE1-OE2 3.32Å; H171-E340 IonicContact CG-OE1 3.54Å; H171-E340 IonicContact ND1-OE1 2.64Å; H171-E340 PolarHBondContact ND1-OE1 3.17Å; H171-E340 IonicContact ND1-OE2 3.05Å; H171-E340 PolarHBondContact ND1-OE2 3.41Å; H171-E369 WeakPolarHBondContact NE2-CB 3.36Å; H171-E369 IonicContact NE2-OE2 3.02Å; H171-A373 HydrophobicContact CB-CB 3.62Å
172F86.4Confident80.3Confident12 Ų1227.8 Ų27.85%0.05314%0.138CC..Hα-helixtrans-66.3-37.8-168.191.3-84.7000113.9M118 I125 L169 R170 F175 A176 V223M118-F172 HydrophobicContact CE-CD1 4.41Å; M118-F172 HydrophobicContact CE-CE1 3.84Å; M118-F172 HydrophobicContact CE-CE2 4.37Å; M118-F172 HydrophobicContact CE-CZ 3.79Å; I125-F172 HydrophobicContact CD1-CE2 3.98Å; L169-F172 HydrophobicContact CB-CB 4.4Å; L169-F172 HydrophobicContact CD2-CB 3.74Å; L169-F172 HydrophobicContact CD2-CG 4.23Å; L169-F172 WeakPolarHBondContact O-CB 3.42Å; L169-F172 WeakPolarHBondContact O-CD1 3.47Å; L169-F172 PolarHBondContact O-N 2.95Å; L169-F172 VanDerWaalsContact O-N 3.1Å; R170-F172 VanDerWaalsContact C-N 3.29Å; R170-F172 PolarHBondContact O-N 3.45Å; F172-F175 PolarHBondContact O-N 3.37Å; F172-A176 VanDerWaalsContact O-CB 3.3Å; F172-A176 WeakPolarHBondContact O-CB 3.31Å; F172-A176 PolarHBondContact O-N 2.98Å; F172-V223 HydrophobicContact CZ-CG1 4.31Å
173Y88.7Confident81Confident7 Ų720.5 Ų20.53%0.02710%0.099CC..Hα-helixtrans-63.6-45.6177.8-74.5-64.4000111.6I125 H171 A177 W220 N224 V279I125-Y173 HydrophobicContact CD1-CD1 4.13Å; I125-Y173 HydrophobicContact CD1-CE1 4.19Å; H171-Y173 PolarHBondContact O-N 3.17Å; Y173-A177 WeakPolarHBondContact O-CB 3.37Å; Y173-A177 PolarHBondContact O-N 3.38Å; Y173-W220 AromaticContact CE1-CZ2 3.92Å; Y173-W220 HydrophobicContact CE1-CZ2 3.92Å; Y173-W220 AromaticContact CZ-NE1 3.88Å; Y173-W220 PolarHBondContact OH-NE1 3.34Å; Y173-N224 PolarHBondContact OH-OD1 3.34Å; Y173-V279 HydrophobicContact CD1-CG1 4.07Å; Y173-V279 HydrophobicContact CG-CG1 4.09Å
174V90.9Very high81.7Confident0 Ų019 Ų190%09%0.09CC..Hα-helixtrans-65-49.4177.6174.50000109.7H171 A176 A177 Y178 G336 L337 E340 L370 I374H171-V174 PolarHBondContact O-N 2.99Å; V174-A176 PolarHBondContact O-N 3.34Å; V174-A177 PolarHBondContact O-N 2.67Å; V174-Y178 HydrophobicContact CG1-CD2 3.6Å; V174-Y178 HydrophobicContact CG1-CE2 3.81Å; V174-Y178 VanDerWaalsContact O-CD2 3.28Å; V174-Y178 WeakPolarHBondContact O-CD2 3.38Å; V174-Y178 PolarHBondContact O-N 3.17Å; V174-G336 VanDerWaalsContact CG2-C 3.41Å; V174-L337 HydrophobicContact CG1-CD2 4.23Å; V174-L337 HydrophobicContact CG2-CD2 4.33Å; V174-E340 HydrophobicContact CG2-CG 3.82Å; V174-L370 HydrophobicContact CG1-CD1 4.09Å; V174-L370 HydrophobicContact CG2-CD1 4.47Å; V174-I374 HydrophobicContact CG1-CD1 4.29Å; V174-I374 HydrophobicContact CG1-CG1 3.74Å
175F93.2Very high82.5Confident0 Ų022.1 Ų22.10%010%0.096CC..Hα-helixtrans-53.6-54.7178.7177.6-90.1000112E146 A149 L150 L153 H171 F172 A177 Y178 F179 I376 A377E146-F175 HydrophobicContact CG-CE1 4Å; A149-F175 HydrophobicContact CB-CE2 4.48Å; A149-F175 HydrophobicContact CB-CZ 3.8Å; L150-F175 HydrophobicContact CB-CD1 4.37Å; L150-F175 HydrophobicContact CB-CE1 3.86Å; L150-F175 HydrophobicContact CB-CZ 4.22Å; L150-F175 HydrophobicContact CD1-CD1 3.89Å; L150-F175 HydrophobicContact CD1-CE1 4.23Å; L150-F175 HydrophobicContact CD1-CG 4.13Å; L153-F175 HydrophobicContact CD2-CB 4.49Å; L153-F175 HydrophobicContact CD2-CD2 3.65Å; L153-F175 HydrophobicContact CD2-CE2 4.21Å; L153-F175 HydrophobicContact CD2-CG 4.24Å; H171-F175 VanDerWaalsContact O-CB 3.29Å; H171-F175 WeakPolarHBondContact O-CB 3.48Å; H171-F175 PolarHBondContact O-N 2.84Å; F172-F175 PolarHBondContact O-N 3.37Å; F175-A177 PolarHBondContact O-N 2.95Å; F175-Y178 PolarHBondContact O-N 3.36Å; F175-F179 HydrophobicContact CZ-CD2 4.47Å; F175-F179 WeakPolarHBondContact O-CB 3.35Å; F175-F179 PolarHBondContact O-N 3.01Å; F175-I376 HydrophobicContact CE2-CB 4.47Å; F175-I376 HydrophobicContact CE2-CG2 4Å; F175-A377 HydrophobicContact CD2-CB 3.64Å; F175-A377 HydrophobicContact CE2-CB 3.96Å; F175-A377 HydrophobicContact CG-CB 4.22Å; F175-A377 WeakPolarHBondContact O-CB 3.46Å
176A92.6Very high83.7Confident0 Ų022.3 Ų22.30%010%0.099CC..Hα-helixtrans-59.9-46.4-179.800000111.6S122 I125 S126 F172 V174 Y178 F179 G180S122-A176 WeakPolarHBondContact O-CB 3.46Å; I125-A176 HydrophobicContact CB-CB 4.05Å; I125-A176 HydrophobicContact CG2-CB 3.92Å; S126-A176 VanDerWaalsContact OG-C 3.31Å; S126-A176 VanDerWaalsContact OG-CA 3.26Å; S126-A176 WeakPolarHBondContact OG-CA 3.42Å; S126-A176 PolarHBondContact OG-O 3.28Å; F172-A176 VanDerWaalsContact O-CB 3.3Å; F172-A176 WeakPolarHBondContact O-CB 3.31Å; F172-A176 PolarHBondContact O-N 2.98Å; V174-A176 PolarHBondContact O-N 3.34Å; A176-Y178 PolarHBondContact O-N 3.29Å; A176-F179 PolarHBondContact O-N 3.36Å; A176-G180 PolarHBondContact O-N 3.48Å
177A90.6Very high85Confident0 Ų020.8 Ų20.80%09%0.092CC..Hα-helixtrans-65-40.8-176.200000112.7Y173 V174 F175 L181 H329 S333Y173-A177 WeakPolarHBondContact O-CB 3.37Å; Y173-A177 PolarHBondContact O-N 3.38Å; V174-A177 PolarHBondContact O-N 2.67Å; F175-A177 PolarHBondContact O-N 2.95Å; A177-L181 WeakPolarHBondContact O-CB 3.32Å; A177-L181 PolarHBondContact O-N 3.27Å; A177-L181 VanDerWaalsContact O-N 3.13Å; A177-H329 WeakPolarHBondContact CA-NE2 3.32Å; A177-H329 PolarHBondContact O-CD2 3.06Å; A177-H329 PolarHBondContact O-NE2 3.38Å; A177-S333 VanDerWaalsContact CB-OG 3.26Å; A177-S333 WeakPolarHBondContact CB-OG 3.5Å
178Y91.6Very high85.9Confident50 Ų5021 Ų2120%0.19610%0.098CC..Hα-helixtrans-73.9-37.2176.3-82.2-80.8000112.7V174 F175 A176 T182 L337 L378V174-Y178 HydrophobicContact CG1-CD2 3.6Å; V174-Y178 HydrophobicContact CG1-CE2 3.81Å; V174-Y178 VanDerWaalsContact O-CD2 3.28Å; V174-Y178 WeakPolarHBondContact O-CD2 3.38Å; V174-Y178 PolarHBondContact O-N 3.17Å; F175-Y178 PolarHBondContact O-N 3.36Å; A176-Y178 PolarHBondContact O-N 3.29Å; Y178-T182 WeakPolarHBondContact O-CB 3.48Å; Y178-T182 PolarHBondContact O-N 2.87Å; Y178-T182 PolarHBondContact O-OG1 2.94Å; Y178-L337 HydrophobicContact CE2-CD1 4.33Å; Y178-L337 HydrophobicContact CE2-CD2 4.34Å; Y178-L337 HydrophobicContact CE2-CG 4.21Å; Y178-L337 WeakPolarHBondContact OH-CD1 3.5Å; Y178-L378 HydrophobicContact CD1-CD2 4.04Å
179F94.3Very high86.3Confident0 Ų026.5 Ų26.50%012%0.121CC..Hα-helixtrans-60.7-56.1175.3-178.9-87.3000110.7M142 E146 F175 A176 L181 T182 V183 A377 S380 G381 T384M142-F179 HydrophobicContact CE-CD1 4.23Å; M142-F179 HydrophobicContact CE-CE1 3.94Å; M142-F179 HydrophobicContact CG-CE1 4.04Å; E146-F179 HydrophobicContact CB-CD1 4.25Å; E146-F179 HydrophobicContact CB-CE1 3.63Å; E146-F179 HydrophobicContact CB-CE2 4.19Å; E146-F179 HydrophobicContact CB-CZ 3.59Å; E146-F179 HydrophobicContact CG-CD1 3.73Å; E146-F179 HydrophobicContact CG-CD2 4.32Å; E146-F179 HydrophobicContact CG-CE1 3.66Å; E146-F179 HydrophobicContact CG-CE2 4.23Å; E146-F179 HydrophobicContact CG-CG 4.08Å; E146-F179 HydrophobicContact CG-CZ 3.92Å; E146-F179 VanDerWaalsContact OE2-CD1 3.23Å; E146-F179 WeakPolarHBondContact OE2-CD1 3.26Å; E146-F179 WeakPolarHBondContact OE2-CE1 3.29Å; F175-F179 HydrophobicContact CZ-CD2 4.47Å; F175-F179 WeakPolarHBondContact O-CB 3.35Å; F175-F179 PolarHBondContact O-N 3.01Å; A176-F179 PolarHBondContact O-N 3.36Å; F179-L181 VanDerWaalsContact C-N 3.33Å; F179-L181 PolarHBondContact O-N 3.44Å; F179-T182 PolarHBondContact O-N 3.37Å; F179-T182 VanDerWaalsContact O-N 3.11Å; F179-V183 HydrophobicContact CD1-CG2 4.03Å; F179-V183 HydrophobicContact CE1-CG2 3.71Å; F179-V183 HydrophobicContact CZ-CG2 4.09Å; F179-V183 WeakPolarHBondContact O-CG2 3.42Å; F179-V183 PolarHBondContact O-N 3.03Å; F179-A377 HydrophobicContact CB-CB 4.36Å; F179-S380 VanDerWaalsContact CD2-OG 3.29Å; F179-S380 WeakPolarHBondContact CD2-OG 3.36Å; F179-S380 VanDerWaalsContact CE2-C 3.46Å; F179-S380 WeakPolarHBondContact CE2-OG 3.44Å; F179-G381 VanDerWaalsContact CD2-CA 3.49Å; F179-T384 HydrophobicContact CE1-CG2 4.44Å; F179-T384 HydrophobicContact CZ-CG2 3.94Å; F179-T384 WeakPolarHBondContact CZ-OG1 3.03Å
180G91.4Very high86Confident0 Ų027.8 Ų27.80%013%0.13CC..Hα-helixtrans-59.2-4118000000113.1A129 A176 T182 V183 A184A129-G180 WeakPolarHBondContact CB-O 3.4Å; A176-G180 PolarHBondContact O-N 3.48Å; G180-T182 PolarHBondContact O-N 2.93Å; G180-V183 PolarHBondContact O-N 3.42Å; G180-A184 VanDerWaalsContact O-CB 3.31Å; G180-A184 WeakPolarHBondContact O-CB 3.43Å; G180-A184 PolarHBondContact O-N 3.26Å
181L88.3Confident85.2Confident39 Ų3931.1 Ų31.120%0.20415%0.151CC..Hα-helixtrans-61.6-42.3175.3-174.162.9000112.4A177 F179 A184 W185 I325 H329A177-L181 WeakPolarHBondContact O-CB 3.32Å; A177-L181 PolarHBondContact O-N 3.27Å; A177-L181 VanDerWaalsContact O-N 3.13Å; F179-L181 VanDerWaalsContact C-N 3.33Å; F179-L181 PolarHBondContact O-N 3.44Å; L181-A184 PolarHBondContact O-N 3.05Å; L181-W185 PolarHBondContact O-N 3.49Å; L181-I325 HydrophobicContact CD1-CB 4.29Å; L181-I325 HydrophobicContact CD1-CD1 3.56Å; L181-I325 HydrophobicContact CD1-CG1 3.74Å; L181-I325 HydrophobicContact CD1-CG2 3.49Å; L181-I325 VanDerWaalsContact CD1-CG2 3.49Å; L181-H329 PolarHBondContact N-NE2 3.43Å
182T91.1Very high83.8Confident14 Ų1436.3 Ų36.39%0.08619%0.185CC..Hα-helixtrans-69.4-41.7-179.5-52.30000111.6Y178 F179 G180 A184 W185 C186 L378 L382Y178-T182 WeakPolarHBondContact O-CB 3.48Å; Y178-T182 PolarHBondContact O-N 2.87Å; Y178-T182 PolarHBondContact O-OG1 2.94Å; F179-T182 PolarHBondContact O-N 3.37Å; F179-T182 VanDerWaalsContact O-N 3.11Å; G180-T182 PolarHBondContact O-N 2.93Å; T182-A184 VanDerWaalsContact C-N 3.34Å; T182-A184 PolarHBondContact O-N 2.97Å; T182-W185 WeakPolarHBondContact O-CB 3.39Å; T182-W185 PolarHBondContact O-N 3.27Å; T182-C186 PolarHBondContact O-N 3.42Å; T182-C186 PolarHBondContact O-SG 2.9Å; T182-L378 VanDerWaalsContact OG1-CD2 3.23Å; T182-L378 WeakPolarHBondContact OG1-CD2 3.3Å; T182-L382 HydrophobicContact CG2-CB 3.94Å
183V91.8Very high81.8Confident0 Ų043 Ų430%021%0.214CC..Hα-helixtrans-59.5-47.8173179.30000110V130 F179 G180 W185 C186 G381 T384 L388V130-V183 HydrophobicContact CG1-CB 4.22Å; V130-V183 HydrophobicContact CG1-CG1 3.83Å; F179-V183 HydrophobicContact CD1-CG2 4.03Å; F179-V183 HydrophobicContact CE1-CG2 3.71Å; F179-V183 HydrophobicContact CZ-CG2 4.09Å; F179-V183 WeakPolarHBondContact O-CG2 3.42Å; F179-V183 PolarHBondContact O-N 3.03Å; G180-V183 PolarHBondContact O-N 3.42Å; V183-W185 PolarHBondContact O-N 2.99Å; V183-C186 PolarHBondContact O-N 3.03Å; V183-C186 VanDerWaalsContact O-N 3.12Å; V183-G381 VanDerWaalsContact CG2-O 3.32Å; V183-G381 WeakPolarHBondContact CG2-O 3.37Å; V183-T384 HydrophobicContact CG2-CG2 3.96Å; V183-L388 HydrophobicContact CG1-CD1 3.8Å
184A87.2Confident79.3Confident5 Ų545.8 Ų45.84%0.04125%0.245CC..Hα-helixtrans-61.4-31179.700000113.1A129 V130 G180 L181 T182 C186A129-A184 HydrophobicContact CB-CB 3.95Å; V130-A184 HydrophobicContact CG1-CB 3.85Å; G180-A184 VanDerWaalsContact O-CB 3.31Å; G180-A184 WeakPolarHBondContact O-CB 3.43Å; G180-A184 PolarHBondContact O-N 3.26Å; L181-A184 PolarHBondContact O-N 3.05Å; T182-A184 VanDerWaalsContact C-N 3.34Å; T182-A184 PolarHBondContact O-N 2.97Å; A184-C186 VanDerWaalsContact C-N 3.34Å
185W85.1Confident76.7Confident156 Ų15652.5 Ų52.559%0.59129%0.286SS*.Hα-helixtrans-69.3-30.6177.2-174.650.1000113.1L181 T182 V183 I322L181-W185 PolarHBondContact O-N 3.49Å; T182-W185 WeakPolarHBondContact O-CB 3.39Å; T182-W185 PolarHBondContact O-N 3.27Å; V183-W185 PolarHBondContact O-N 2.99Å; W185-I322 VanDerWaalsContact CD1-CD1 3.48Å; W185-I322 HydrophobicContact CG-CD1 4.43Å
186C87.2Confident74.1Confident22 Ų2261.3 Ų61.315%0.14933%0.327CS..Hα-helixtrans-78.8-17.8179.4-60.40000113.8T182 V183 A184 N389T182-C186 PolarHBondContact O-N 3.42Å; T182-C186 PolarHBondContact O-SG 2.9Å; V183-C186 PolarHBondContact O-N 3.03Å; V183-C186 VanDerWaalsContact O-N 3.12Å; A184-C186 VanDerWaalsContact C-N 3.34Å; C186-N389 PolarHBondContact O-ND2 3.08Å
187L83.6Confident71.3Confident13 Ų1366.5 Ų66.57%0.06836%0.355CS..SBendtrans-79.9151.9-174.9-68175.3000112.7V130 K133 V134 K189 L388V130-L187 HydrophobicContact CB-CD1 4.04Å; V130-L187 HydrophobicContact CG1-CD1 3.79Å; K133-L187 HydrophobicContact CB-CD1 4.41Å; V134-L187 HydrophobicContact CG1-CD1 3.57Å; V134-L187 HydrophobicContact CG1-CD2 4.29Å; L187-K189 PolarHBondContact O-N 3.5Å; L187-L388 HydrophobicContact CD2-CB 4.28Å
188P77.8Confident68.5Low55 Ų5574.5 Ų74.536%0.35740%0.398SS..PPolyproline II helixtrans-58.2135.1179-23.533.2000112.7V398 Y401P188-V398 HydrophobicContact CB-CG2 4.18Å; P188-Y401 PolarHBondContact O-OH 3.48Å
189K70.8Confident65.9Low122 Ų12277.9 Ų77.953%0.5342%0.419SS..PPolyproline II helixtrans-69.7143.4-179.3-63-177.5-177-173.70111.1L187 G321 V398L187-K189 PolarHBondContact O-N 3.5Å; K189-G321 WeakPolarHBondContact CD-O 3.29Å; K189-G321 VanDerWaalsContact CE-O 3.28Å; K189-G321 WeakPolarHBondContact CE-O 3.36Å; K189-G321 PolarHBondContact NZ-O 2.71Å; K189-V398 VanDerWaalsContact O-CG1 3.27Å; K189-V398 WeakPolarHBondContact O-CG1 3.46Å
190P63.6Low63.4Low34 Ų3483.2 Ų83.222%0.22144%0.444CS..PPolyproline II helixtrans-55.3143.7169.5-20.631.8000111.3V398 Y401P190-V398 VanDerWaalsContact CA-CG1 3.43Å; P190-Y401 HydrophobicContact CG-CD2 4.33Å
191L58.6Low61Low119 Ų11993.2 Ų93.262%0.62348%0.482SS*.PPolyproline II helixtrans-62.2136.7168.9-97.878.1000108.9K193 V398L191-K193 PolarHBondContact O-N 2.87Å; L191-V398 HydrophobicContact CD1-CB 4.08Å; L191-V398 HydrophobicContact CD1-CG1 3.79Å
192P55.1Low58.4Low114 Ų11492.9 Ų92.974%0.7449%0.485SS*.  trans-61114.3169.623.9-29.1000107.8G194P192-G194 PolarHBondContact O-N 3.35Å
193K45.4Very low56.2Low153 Ų15397.9 Ų97.967%0.66552%0.516SS*.  trans-67.8123.4171.3-83.1176.5170.7165.30107.3L191 Q200L191-K193 PolarHBondContact O-N 2.87Å; K193-Q200 VanDerWaalsContact NZ-CD 3.35Å
194G35.4Very low54.2Low65 Ų65104.3 Ų104.367%0.6755%0.549SS*.  trans-53.2148162.900000109.3P192 E196P192-G194 PolarHBondContact O-N 3.35Å; G194-E196 PolarHBondContact O-N 3.47Å
195T36.4Very low52.7Low141 Ų141104.9 Ų104.987%0.86555%0.552SS**SBendtrans-45.297.7176.142.90000111.3
196E37.4Very low51.6Low185 Ų18599.5 Ų99.586%0.86454%0.538SS*.  trans168.584.8159.6-96.3164.4-153.500109.8G194G194-E196 PolarHBondContact O-N 3.47Å
197D34.1Very low51Low109 Ų109105.1 Ų105.158%0.58357%0.566SS**  trans169.481.8140.7-109.1-6.8000107.6D199 Q200D197-D199 PolarHBondContact O-N 3.11Å; D197-D199 VanDerWaalsContact O-N 3.07Å; D197-Q200 PolarHBondContact OD2-NE2 3.1Å
198N32.4Very low50.8Low169 Ų169105.9 Ų105.990%0.90457%0.572SS**THydrogen-bonded Turntrans-68.12.8171.8-78.7-30.6000112.8
199D36.6Very low51Low120 Ų120103.2 Ų103.264%0.64256%0.555SS**THydrogen-bonded Turntrans-1117.6-172-79.7-26000116.1D197 R201 A202D197-D199 PolarHBondContact O-N 3.11Å; D197-D199 VanDerWaalsContact O-N 3.07Å; D199-R201 PolarHBondContact O-N 2.88Å; D199-A202 WeakPolarHBondContact O-CB 3.48Å; D199-A202 PolarHBondContact O-N 2.86Å; D199-A202 VanDerWaalsContact O-N 3.15Å
200Q41.9Very low51.7Low112 Ų11299.5 Ų99.552%0.52354%0.54SS..THydrogen-bonded Turntrans-701.4170.9-85.9165.232.100114.5K193 D197K193-Q200 VanDerWaalsContact NZ-CD 3.35Å; D197-Q200 PolarHBondContact OD2-NE2 3.1Å
201R41.2Very low52.9Low211 Ų211101.2 Ų101.280%0.79655%0.547SS*.THydrogen-bonded Turntrans-109.818.6171.3-95.4-177.7-153.8174.48113.7D199 T203D199-R201 PolarHBondContact O-N 2.88Å; R201-T203 PolarHBondContact O-N 3.05Å
202A33.9Very low54.4Low32 Ų3295.6 Ų95.626%0.26452%0.517SS..  trans-74.8106.8-175.300000114.5D199 I204 P205D199-A202 WeakPolarHBondContact O-CB 3.48Å; D199-A202 PolarHBondContact O-N 2.86Å; D199-A202 VanDerWaalsContact O-N 3.15Å; A202-I204 VanDerWaalsContact C-N 3.33Å; A202-I204 PolarHBondContact O-N 3.41Å; A202-P205 WeakPolarHBondContact O-CD 3.37Å
203T45Very low56Low119 Ų11990.1 Ų90.173%0.7348%0.482SS*.SBendtrans49.8-36.3140.5-31.40000122.4R201 S206R201-T203 PolarHBondContact O-N 3.05Å; T203-S206 PolarHBondContact O-OG 3.35Å
204I48.6Very low58.2Low135 Ų13586.6 Ų86.669%0.69247%0.47SS*.THydrogen-bonded Turntrans-82.4-22.1-178-57.7177.2000114.6A202 S206A202-I204 VanDerWaalsContact C-N 3.33Å; A202-I204 PolarHBondContact O-N 3.41Å; I204-S206 PolarHBondContact O-N 3.48Å
205P56.6Low61Low16 Ų1686 Ų8610%0.10445%0.449CS..THydrogen-bonded Turntrans-81.71.9175.5-1732.2000116.8S68 R70 A202 S208S68-P205 WeakPolarHBondContact O-CB 3.2Å; R70-P205 HydrophobicContact CB-CG 3.57Å; R70-P205 HydrophobicContact CG-CG 4.15Å; A202-P205 WeakPolarHBondContact O-CD 3.37Å; P205-S208 PolarHBondContact O-OG 3.47Å
206S61.9Low63.6Low43 Ų4379.3 Ų79.330%0.30141%0.408SS..Hα-helixtrans-79.8-34.5-175.657.30000112.9T203 I204 M210 H271T203-S206 PolarHBondContact O-OG 3.35Å; I204-S206 PolarHBondContact O-N 3.48Å; S206-M210 VanDerWaalsContact O-CB 3.28Å; S206-M210 WeakPolarHBondContact O-CB 3.46Å; S206-M210 PolarHBondContact O-N 3.09Å; S206-H271 PolarHBondContact O-NE2 3.29Å
207L74.4Confident66.3Low140 Ų14073.1 Ų73.173%0.73338%0.377SS*.Hα-helixtrans-75.8-37.3-173.8-164.4128.5000112.6M210 L211L207-M210 PolarHBondContact O-N 2.95Å; L207-L211 PolarHBondContact O-N 3.18Å
208S80.4Confident69.2Low29 Ų2972.5 Ų72.520%0.20337%0.372CS..Hα-helixtrans-66-45.317463.50000111.1F64 S67 P205 M210 L211 G212F64-S208 WeakPolarHBondContact CB-O 3.28Å; S67-S208 WeakPolarHBondContact OG-CB 3.29Å; S67-S208 PolarHBondContact OG-OG 3.41Å; P205-S208 PolarHBondContact O-OG 3.47Å; S208-M210 VanDerWaalsContact C-N 3.32Å; S208-M210 PolarHBondContact O-N 3.04Å; S208-L211 WeakPolarHBondContact O-CB 3.3Å; S208-L211 PolarHBondContact O-N 3.44Å; S208-G212 PolarHBondContact O-N 3.28Å; S208-G212 VanDerWaalsContact O-N 3.14Å
209A81.4Confident72.2Confident0 Ų066.8 Ų66.80%034%0.339CS..Hα-helixtrans-62.9-37.8174.300000112.5F64 G212 A213F64-A209 WeakPolarHBondContact O-CA 3.3Å; A209-G212 PolarHBondContact O-N 2.88Å; A209-A213 PolarHBondContact O-N 3.27Å
210M85.3Confident74.9Confident44 Ų4461.3 Ų61.322%0.21731%0.309CS..Hα-helixtrans-66.8-36.8174.7-169.357.9-173.700112.3S206 L207 S208 G212 A213 L214 M267 H271S206-M210 VanDerWaalsContact O-CB 3.28Å; S206-M210 WeakPolarHBondContact O-CB 3.46Å; S206-M210 PolarHBondContact O-N 3.09Å; L207-M210 PolarHBondContact O-N 2.95Å; S208-M210 VanDerWaalsContact C-N 3.32Å; S208-M210 PolarHBondContact O-N 3.04Å; M210-G212 VanDerWaalsContact C-N 3.3Å; M210-G212 PolarHBondContact O-N 3.34Å; M210-A213 PolarHBondContact O-N 3.12Å; M210-A213 HydrophobicContact SD-CB 4.17Å; M210-L214 HydrophobicContact CE-CD2 3.96Å; M210-L214 HydrophobicContact CE-CG 4.1Å; M210-L214 HydrophobicContact CG-CD1 4.42Å; M210-L214 HydrophobicContact CG-CG 4.44Å; M210-L214 WeakPolarHBondContact O-CG 3.2Å; M210-L214 PolarHBondContact O-N 3.01Å; M210-M267 HydrophobicContact CB-CE 3.57Å; M210-M267 HydrophobicContact CE-CE 4.48Å; M210-M267 HydrophobicContact CG-CE 3.48Å; M210-M267 VanDerWaalsContact CG-CE 3.48Å; M210-M267 HydrophobicContact SD-CE 3.32Å; M210-M267 WeakPolarHBondContact SD-CE 3.04Å; M210-H271 PolarHBondContact N-NE2 3.21Å
211L88.8Confident77.4Confident70 Ų7056.8 Ų56.837%0.36629%0.289SS..Hα-helixtrans-57.2-47.8172.5-172.666.7000110.2L207 S208 A213 L214 F215L207-L211 PolarHBondContact O-N 3.18Å; S208-L211 WeakPolarHBondContact O-CB 3.3Å; S208-L211 PolarHBondContact O-N 3.44Å; L211-A213 PolarHBondContact O-N 3.16Å; L211-L214 PolarHBondContact O-N 3.23Å; L211-F215 HydrophobicContact CD1-CD2 4.16Å; L211-F215 HydrophobicContact CD1-CE2 3.79Å; L211-F215 HydrophobicContact CG-CD2 4.13Å; L211-F215 HydrophobicContact CG-CE2 4.04Å; L211-F215 WeakPolarHBondContact O-CD2 3.26Å; L211-F215 PolarHBondContact O-N 3.14Å; L211-F215 VanDerWaalsContact O-N 3.09Å
212G88.9Confident79.8Confident0 Ų047.4 Ų47.40%026%0.256CS..Hα-helixtrans-56.7-46.5173.300000112.8G61 S208 A209 M210 L214 F215 L216G61-G212 WeakPolarHBondContact CA-O 3.14Å; G61-G212 VanDerWaalsContact O-CA 3.27Å; G61-G212 WeakPolarHBondContact O-CA 3.4Å; S208-G212 PolarHBondContact O-N 3.28Å; S208-G212 VanDerWaalsContact O-N 3.14Å; A209-G212 PolarHBondContact O-N 2.88Å; M210-G212 VanDerWaalsContact C-N 3.3Å; M210-G212 PolarHBondContact O-N 3.34Å; G212-L214 VanDerWaalsContact C-N 3.34Å; G212-L214 PolarHBondContact O-N 2.86Å; G212-F215 PolarHBondContact O-N 3.19Å; G212-L216 WeakPolarHBondContact O-CB 3.27Å; G212-L216 WeakPolarHBondContact O-CD1 3.46Å; G212-L216 VanDerWaalsContact O-CG 3.32Å; G212-L216 WeakPolarHBondContact O-CG 3.18Å; G212-L216 PolarHBondContact O-N 2.9Å
213A89.6Confident82.4Confident0 Ų046.1 Ų46.10%025%0.245CC..Hα-helixtrans-62.2-36.5177.300000113.3L65 A209 M210 L211 L216 W217 L275L65-A213 HydrophobicContact CD1-CB 4.06Å; A209-A213 PolarHBondContact O-N 3.27Å; M210-A213 PolarHBondContact O-N 3.12Å; M210-A213 HydrophobicContact SD-CB 4.17Å; L211-A213 PolarHBondContact O-N 3.16Å; A213-L216 PolarHBondContact O-N 2.88Å; A213-W217 WeakPolarHBondContact O-CB 3.38Å; A213-W217 PolarHBondContact O-N 3.17Å; A213-L275 HydrophobicContact CB-CD1 4.36Å
214L91.9Very high84.7Confident79 Ų7941.1 Ų41.141%0.41421%0.214SC..Hα-helixtrans-67.1-46.4176.5-73170.2000111.8M210 L211 G212 L216 W217 M218M210-L214 HydrophobicContact CE-CD2 3.96Å; M210-L214 HydrophobicContact CE-CG 4.1Å; M210-L214 HydrophobicContact CG-CD1 4.42Å; M210-L214 HydrophobicContact CG-CG 4.44Å; M210-L214 WeakPolarHBondContact O-CG 3.2Å; M210-L214 PolarHBondContact O-N 3.01Å; L211-L214 PolarHBondContact O-N 3.23Å; G212-L214 VanDerWaalsContact C-N 3.34Å; G212-L214 PolarHBondContact O-N 2.86Å; L214-L216 VanDerWaalsContact C-N 3.31Å; L214-L216 PolarHBondContact O-N 3.4Å; L214-W217 PolarHBondContact O-N 2.99Å; L214-M218 WeakPolarHBondContact O-CG 3.5Å; L214-M218 PolarHBondContact O-N 3.21Å
215F93.1Very high86.6Confident51 Ų5134.7 Ų34.722%0.22418%0.181CC..Hα-helixtrans-61.1-42.5175.6-86-81.8000111.5V56 I60 L211 G212 M218 F219V56-F215 HydrophobicContact CG1-CD1 3.52Å; V56-F215 HydrophobicContact CG1-CE1 3.86Å; I60-F215 HydrophobicContact CB-CG 4.44Å; I60-F215 HydrophobicContact CG2-CB 4.46Å; I60-F215 HydrophobicContact CG2-CD1 4.36Å; I60-F215 HydrophobicContact CG2-CD2 3.57Å; I60-F215 HydrophobicContact CG2-CE2 3.82Å; I60-F215 HydrophobicContact CG2-CG 3.87Å; I60-F215 HydrophobicContact CG2-CZ 4.33Å; L211-F215 HydrophobicContact CD1-CD2 4.16Å; L211-F215 HydrophobicContact CD1-CE2 3.79Å; L211-F215 HydrophobicContact CG-CD2 4.13Å; L211-F215 HydrophobicContact CG-CE2 4.04Å; L211-F215 WeakPolarHBondContact O-CD2 3.26Å; L211-F215 PolarHBondContact O-N 3.14Å; L211-F215 VanDerWaalsContact O-N 3.09Å; G212-F215 PolarHBondContact O-N 3.19Å; F215-M218 HydrophobicContact CD1-CE 4.01Å; F215-M218 HydrophobicContact CE1-CE 4.27Å; F215-M218 HydrophobicContact CG-CE 4.17Å; F215-M218 PolarHBondContact O-N 2.93Å; F215-F219 HydrophobicContact CD1-CD2 4.1Å; F215-F219 AromaticContact CD1-CE2 3.73Å; F215-F219 HydrophobicContact CD1-CE2 3.73Å; F215-F219 HydrophobicContact CE1-CE2 4.17Å; F215-F219 VanDerWaalsContact O-CD2 3.28Å; F215-F219 WeakPolarHBondContact O-CD2 3.18Å; F215-F219 PolarHBondContact O-N 3.29Å; F215-F219 VanDerWaalsContact O-N 3.14Å
216L92.3Very high88.1Confident1 Ų134.2 Ų34.21%0.00518%0.179CC..Hα-helixtrans-57.8-50.3172.8-77.4163000111.6M57 L62 L65 G212 A213 L214 M218 F219 W220 L275M57-L216 HydrophobicContact CE-CD2 4.41Å; M57-L216 HydrophobicContact CG-CD2 3.4Å; M57-L216 VanDerWaalsContact CG-CD2 3.4Å; M57-L216 HydrophobicContact CG-CG 4.22Å; M57-L216 HydrophobicContact SD-CD2 3.66Å; L62-L216 HydrophobicContact CD2-CD1 4.21Å; L62-L216 HydrophobicContact CD2-CD2 3.83Å; L62-L216 HydrophobicContact CG-CD2 4.07Å; L65-L216 HydrophobicContact CB-CD1 3.92Å; L65-L216 HydrophobicContact CD1-CD1 4.07Å; L65-L216 HydrophobicContact CD2-CD1 3.61Å; L65-L216 HydrophobicContact CG-CD1 4.07Å; G212-L216 WeakPolarHBondContact O-CB 3.27Å; G212-L216 WeakPolarHBondContact O-CD1 3.46Å; G212-L216 VanDerWaalsContact O-CG 3.32Å; G212-L216 WeakPolarHBondContact O-CG 3.18Å; G212-L216 PolarHBondContact O-N 2.9Å; A213-L216 PolarHBondContact O-N 2.88Å; L214-L216 VanDerWaalsContact C-N 3.31Å; L214-L216 PolarHBondContact O-N 3.4Å; L216-M218 PolarHBondContact O-N 2.93Å; L216-F219 PolarHBondContact O-N 3.44Å; L216-W220 HydrophobicContact CB-CE3 3.84Å; L216-W220 HydrophobicContact CB-CZ3 3.77Å; L216-W220 HydrophobicContact CD1-CZ3 4.49Å; L216-W220 HydrophobicContact CD2-CE3 4.19Å; L216-W220 HydrophobicContact CD2-CZ3 3.76Å; L216-W220 HydrophobicContact CG-CZ3 4.21Å; L216-W220 VanDerWaalsContact O-CB 3.31Å; L216-W220 WeakPolarHBondContact O-CB 3.37Å; L216-W220 PolarHBondContact O-N 3Å; L216-L275 HydrophobicContact CB-CD1 3.99Å; L216-L275 HydrophobicContact CB-CD2 3.73Å; L216-L275 HydrophobicContact CD1-CD1 3.73Å; L216-L275 HydrophobicContact CG-CD1 4.47Å
217W94.8Very high89.2Confident55 Ų5533.2 Ų33.221%0.20817%0.169CC..Hα-helixtrans-60.5-43.5-179-171.995.8000112.6A213 L214 Y242 L245 L275A213-W217 WeakPolarHBondContact O-CB 3.38Å; A213-W217 PolarHBondContact O-N 3.17Å; L214-W217 PolarHBondContact O-N 2.99Å; W217-Y242 HydrophobicContact CH2-CD2 4.46Å; W217-Y242 AromaticContact CH2-CE2 3.72Å; W217-Y242 HydrophobicContact CH2-CE2 3.72Å; W217-Y242 HydrophobicContact CZ3-CE2 4.22Å; W217-L245 HydrophobicContact CG-CD1 4.5Å; W217-L245 HydrophobicContact CZ2-CB 4.48Å; W217-L245 PolarHBondContact NE1-O 3.24Å; W217-L245 WeakPolarHBondContact O-CD1 3.43Å; W217-L275 HydrophobicContact CB-CD2 3.96Å
218M94.9Very high89.8Confident97 Ų9727.8 Ų27.848%0.47814%0.141SC..Hα-helixtrans-65.8-41.6-179.2-71.1-175.5-63.600112.7L214 F215 L216L214-M218 WeakPolarHBondContact O-CG 3.5Å; L214-M218 PolarHBondContact O-N 3.21Å; F215-M218 HydrophobicContact CD1-CE 4.01Å; F215-M218 HydrophobicContact CE1-CE 4.27Å; F215-M218 HydrophobicContact CG-CE 4.17Å; F215-M218 PolarHBondContact O-N 2.93Å; L216-M218 PolarHBondContact O-N 2.93Å
219F94.7Very high89.8Confident48 Ų4833 Ų3321%0.21116%0.156CC..Hα-helixtrans-99.9-5.5-171.4-67.2-70.2000114.3D53 V56 M57 F215 L216 P221 S222 V223D53-F219 HydrophobicContact CB-CB 4.49Å; D53-F219 HydrophobicContact CB-CD1 3.65Å; D53-F219 HydrophobicContact CB-CE1 4.29Å; D53-F219 HydrophobicContact CB-CG 4.38Å; D53-F219 VanDerWaalsContact CG-CD1 3.48Å; D53-F219 WeakPolarHBondContact OD1-CD1 3.45Å; D53-F219 VanDerWaalsContact OD1-CE1 3.22Å; D53-F219 WeakPolarHBondContact OD1-CE1 3.47Å; V56-F219 HydrophobicContact CG1-CD2 3.92Å; V56-F219 HydrophobicContact CG1-CE2 3.68Å; V56-F219 HydrophobicContact CG1-CZ 4.33Å; M57-F219 HydrophobicContact CB-CB 4.2Å; F215-F219 HydrophobicContact CD1-CD2 4.1Å; F215-F219 AromaticContact CD1-CE2 3.73Å; F215-F219 HydrophobicContact CD1-CE2 3.73Å; F215-F219 HydrophobicContact CE1-CE2 4.17Å; F215-F219 VanDerWaalsContact O-CD2 3.28Å; F215-F219 WeakPolarHBondContact O-CD2 3.18Å; F215-F219 PolarHBondContact O-N 3.29Å; F215-F219 VanDerWaalsContact O-N 3.14Å; L216-F219 PolarHBondContact O-N 3.44Å; F219-P221 VanDerWaalsContact C-CD 3.43Å; F219-S222 WeakPolarHBondContact O-CB 3.49Å; F219-S222 PolarHBondContact O-N 3.19Å; F219-V223 PolarHBondContact O-N 3.08Å
220W93.4Very high90Very high5 Ų535 Ų352%0.01917%0.17CC..Hα-helixtrans-54.6-39.6177.8-140.4-67.7000114.8Y173 L216 S222 V223 N224 T241 L245 L275 G278 V279 F332Y173-W220 AromaticContact CE1-CZ2 3.92Å; Y173-W220 HydrophobicContact CE1-CZ2 3.92Å; Y173-W220 AromaticContact CZ-NE1 3.88Å; Y173-W220 PolarHBondContact OH-NE1 3.34Å; L216-W220 HydrophobicContact CB-CE3 3.84Å; L216-W220 HydrophobicContact CB-CZ3 3.77Å; L216-W220 HydrophobicContact CD1-CZ3 4.49Å; L216-W220 HydrophobicContact CD2-CE3 4.19Å; L216-W220 HydrophobicContact CD2-CZ3 3.76Å; L216-W220 HydrophobicContact CG-CZ3 4.21Å; L216-W220 VanDerWaalsContact O-CB 3.31Å; L216-W220 WeakPolarHBondContact O-CB 3.37Å; L216-W220 PolarHBondContact O-N 3Å; W220-S222 PolarHBondContact O-N 3.49Å; W220-V223 WeakPolarHBondContact O-CB 3.44Å; W220-V223 PolarHBondContact O-N 3.43Å; W220-V223 VanDerWaalsContact O-N 3.08Å; W220-N224 PolarHBondContact O-N 3.09Å; W220-N224 VanDerWaalsContact O-N 3.13Å; W220-T241 HydrophobicContact CB-CG2 4.24Å; W220-T241 HydrophobicContact CG-CG2 4.44Å; W220-L245 HydrophobicContact CB-CD1 3.53Å; W220-L245 HydrophobicContact CG-CD1 4.17Å; W220-L275 HydrophobicContact CE3-CB 4.47Å; W220-L275 HydrophobicContact CE3-CD2 3.83Å; W220-L275 HydrophobicContact CH2-CB 4.27Å; W220-L275 HydrophobicContact CZ3-CB 3.86Å; W220-L275 HydrophobicContact CZ3-CD1 3.91Å; W220-L275 HydrophobicContact CZ3-CD2 3.76Å; W220-L275 HydrophobicContact CZ3-CG 4.04Å; W220-G278 PolarHBondContact NE1-O 2.84Å; W220-G278 VanDerWaalsContact NE1-O 3.1Å; W220-V279 HydrophobicContact CH2-CG2 3.71Å; W220-V279 HydrophobicContact CZ2-CB 4.35Å; W220-V279 HydrophobicContact CZ2-CG2 3.36Å; W220-F332 HydrophobicContact CH2-CE1 4.03Å; W220-F332 HydrophobicContact CH2-CZ 4.24Å
221P94.1Very high90.1Very high17 Ų1737.3 Ų37.311%0.1119%0.189CC..Hα-helixtrans-57.2-34.9175.4-2736.9000113.2F219 S225 M238 T241F219-P221 VanDerWaalsContact C-CD 3.43Å; P221-S225 WeakPolarHBondContact O-CB 3.27Å; P221-S225 PolarHBondContact O-N 3.4Å; P221-S225 PolarHBondContact O-OG 2.86Å; P221-M238 HydrophobicContact CB-CB 4.42Å; P221-T241 HydrophobicContact CB-CG2 4.37Å; P221-T241 HydrophobicContact CG-CG2 4.12Å
222S91.9Very high90.1Very high15 Ų1539.1 Ų39.111%0.10520%0.198CC..Hα-helixtrans-68.2-38.2175.7-60.80000111.4D53 F219 W220 S225 A226D53-S222 WeakPolarHBondContact OD2-CB 3.39Å; D53-S222 PolarHBondContact OD2-OG 2.7Å; F219-S222 WeakPolarHBondContact O-CB 3.49Å; F219-S222 PolarHBondContact O-N 3.19Å; W220-S222 PolarHBondContact O-N 3.49Å; S222-S225 PolarHBondContact O-N 3.07Å; S222-S225 PolarHBondContact O-OG 2.87Å; S222-A226 WeakPolarHBondContact O-CA 3.4Å; S222-A226 WeakPolarHBondContact O-CB 3.4Å; S222-A226 PolarHBondContact O-N 3.38Å
223V89Confident90.2Very high4 Ų443 Ų432%0.02422%0.216CC..Hα-helixtrans-61.2-53.1176.8-178.50000112.3L54 M57 M118 M121 F172 F219 W220 S225 A226L54-V223 HydrophobicContact CD2-CB 4.22Å; L54-V223 HydrophobicContact CD2-CG1 4.48Å; L54-V223 HydrophobicContact CD2-CG2 3.86Å; M57-V223 HydrophobicContact CE-CB 4.26Å; M57-V223 HydrophobicContact CE-CG1 4.19Å; M57-V223 HydrophobicContact CE-CG2 3.1Å; M57-V223 HydrophobicContact SD-CB 4.49Å; M57-V223 HydrophobicContact SD-CG2 3.19Å; M57-V223 WeakPolarHBondContact SD-CG2 3.15Å; M118-V223 HydrophobicContact CE-CG1 3.84Å; M118-V223 HydrophobicContact SD-CG1 3.88Å; M121-V223 HydrophobicContact CE-CG1 4.18Å; F172-V223 HydrophobicContact CZ-CG1 4.31Å; F219-V223 PolarHBondContact O-N 3.08Å; W220-V223 WeakPolarHBondContact O-CB 3.44Å; W220-V223 PolarHBondContact O-N 3.43Å; W220-V223 VanDerWaalsContact O-N 3.08Å; V223-S225 PolarHBondContact O-N 3.03Å; V223-S225 VanDerWaalsContact O-N 3.16Å; V223-A226 PolarHBondContact O-N 3.39Å
224N91.8Very high90.2Very high14 Ų1446.8 Ų46.88%0.07523%0.23CC..Hα-helixtrans-67.2-17.9-176.1-74.6-6.7000112.2Y173 W220 T241 G278Y173-N224 PolarHBondContact OH-OD1 3.34Å; W220-N224 PolarHBondContact O-N 3.09Å; W220-N224 VanDerWaalsContact O-N 3.13Å; N224-T241 HydrophobicContact CB-CG2 4.4Å; N224-T241 WeakPolarHBondContact CB-OG1 3.31Å; N224-T241 WeakPolarHBondContact ND2-CG2 3.19Å; N224-T241 PolarHBondContact ND2-OG1 3.39Å; N224-G278 PolarHBondContact ND2-O 3.46Å
225S90.2Very high90.2Very high0 Ų047.6 Ų47.60%023%0.23CC..Hα-helixtrans-108.9-11.3-17968.20000114.4P221 S222 V223 L227 L228 M238P221-S225 WeakPolarHBondContact O-CB 3.27Å; P221-S225 PolarHBondContact O-N 3.4Å; P221-S225 PolarHBondContact O-OG 2.86Å; S222-S225 PolarHBondContact O-N 3.07Å; S222-S225 PolarHBondContact O-OG 2.87Å; V223-S225 PolarHBondContact O-N 3.03Å; V223-S225 VanDerWaalsContact O-N 3.16Å; S225-L227 VanDerWaalsContact C-N 3.27Å; S225-L227 PolarHBondContact O-N 2.86Å; S225-L227 VanDerWaalsContact O-N 3.16Å; S225-L228 WeakPolarHBondContact O-CB 3.48Å; S225-L228 PolarHBondContact O-N 3.42Å; S225-M238 VanDerWaalsContact OG-CE 3.27Å; S225-M238 WeakPolarHBondContact OG-CE 3.39Å; S225-M238 WeakPolarHBondContact OG-CG 3.48Å
226A87.1Confident90.2Very high7 Ų747.3 Ų47.36%0.05823%0.231CC..THydrogen-bonded Turntrans-59.4-33.7-168.900000114.4V50 L54 S222 V223V50-A226 HydrophobicContact CG1-CB 3.61Å; L54-A226 HydrophobicContact CD1-CB 3.94Å; L54-A226 HydrophobicContact CD2-CB 4.16Å; L54-A226 HydrophobicContact CG-CB 4.36Å; S222-A226 WeakPolarHBondContact O-CA 3.4Å; S222-A226 WeakPolarHBondContact O-CB 3.4Å; S222-A226 PolarHBondContact O-N 3.38Å; V223-A226 PolarHBondContact O-N 3.39Å
227L85.4Confident90.3Very high21 Ų2147.3 Ų47.311%0.1123%0.231CC..THydrogen-bonded Turntrans-94.5-6.2-177.7-57.2178000112.5F111 L115 M118 M167 L169 S225 R229F111-L227 HydrophobicContact CE2-CD2 4.13Å; F111-L227 HydrophobicContact CZ-CD2 4.27Å; L115-L227 HydrophobicContact CD1-CD1 4.27Å; L115-L227 HydrophobicContact CD1-CD2 3.95Å; M118-L227 HydrophobicContact CE-CD1 4.38Å; M118-L227 HydrophobicContact CG-CD1 4.26Å; M118-L227 HydrophobicContact CG-CD2 4.41Å; M118-L227 HydrophobicContact CG-CG 4.41Å; M167-L227 HydrophobicContact CE-CB 4.38Å; M167-L227 WeakPolarHBondContact CE-O 3.29Å; L169-L227 HydrophobicContact CB-CD1 3.75Å; L169-L227 HydrophobicContact CD1-CD1 3.64Å; L169-L227 HydrophobicContact CG-CD1 4.26Å; S225-L227 VanDerWaalsContact C-N 3.27Å; S225-L227 PolarHBondContact O-N 2.86Å; S225-L227 VanDerWaalsContact O-N 3.16Å; L227-R229 PolarHBondContact O-N 2.89Å
228L86.3Confident90.2Very high27 Ų2747.6 Ų47.614%0.14124%0.235CC..  trans-78.5117.2-177.9-63.7174000111.7S225 Q233 R234 A237 H286S225-L228 WeakPolarHBondContact O-CB 3.48Å; S225-L228 PolarHBondContact O-N 3.42Å; L228-Q233 HydrophobicContact CD1-CB 4.38Å; L228-R234 HydrophobicContact CB-CB 4.27Å; L228-R234 PolarHBondContact O-NE 3.27Å; L228-R234 VanDerWaalsContact O-NE 3.09Å; L228-A237 HydrophobicContact CD1-CB 3.4Å; L228-A237 VanDerWaalsContact CD1-CB 3.4Å; L228-H286 HydrophobicContact CD1-CB 3.72Å; L228-H286 HydrophobicContact CD2-CB 4.28Å
229R81.3Confident90.3Very high138 Ų13848 Ų4852%0.52124%0.235SC..  trans-70.2-48.1178.9-67.5180175.1165.2-2.8112.2D164 M167 L227 R234D164-R229 IonicContact OD1-NH1 3.93Å; D164-R229 IonicContact OD2-CZ 2.93Å; D164-R229 IonicContact OD2-NH1 3.94Å; D164-R229 PolarHBondContact OD2-NH1 3.27Å; M167-R229 HydrophobicContact CE-CG 4.36Å; M167-R229 HydrophobicContact SD-CG 4.23Å; L227-R229 PolarHBondContact O-N 2.89Å; R229-R234 PolarHBondContact O-NH2 3.14Å
230S85.7Confident90.4Very high41 Ų4146 Ų4629%0.28723%0.226SC..SBendtrans-65.7126.9-177.4170.40000111.4I232 Q233 R234S230-I232 VanDerWaalsContact C-N 3.25Å; S230-I232 PolarHBondContact O-N 3.25Å; S230-Q233 PolarHBondContact O-N 3.05Å; S230-R234 WeakPolarHBondContact O-CB 3.22Å; S230-R234 PolarHBondContact O-N 3.49Å
231P86.6Confident90.5Very high93 Ų9345.8 Ų45.860%0.60423%0.225SC*.Hα-helixtrans-63.5-33.7-178.325.5-33.6000112.1K235P231-K235 WeakPolarHBondContact O-CB 3.5Å; P231-K235 PolarHBondContact O-N 3.21Å
232I89.1Confident90.7Very high109 Ų10950.7 Ų50.756%0.55924%0.243SC*.Hα-helixtrans-69.9-45.9178.7-66153.5000110.3S230 R234 K235 N236S230-I232 VanDerWaalsContact C-N 3.25Å; S230-I232 PolarHBondContact O-N 3.25Å; I232-R234 VanDerWaalsContact C-N 3.32Å; I232-R234 PolarHBondContact O-N 3.17Å; I232-K235 PolarHBondContact O-N 2.96Å; I232-N236 WeakPolarHBondContact O-CB 3.24Å; I232-N236 PolarHBondContact O-N 2.92Å; I232-N236 PolarHBondContact O-OD1 3.21Å
233Q90.1Very high91Very high80 Ų8054.4 Ų54.437%0.37426%0.255SS..Hα-helixtrans-62.5-41.5176.2-70.9177-2.900111.2L228 S230 N236 A237 H286L228-Q233 HydrophobicContact CD1-CB 4.38Å; S230-Q233 PolarHBondContact O-N 3.05Å; Q233-N236 PolarHBondContact O-N 2.93Å; Q233-A237 VanDerWaalsContact O-CB 3.28Å; Q233-A237 WeakPolarHBondContact O-CB 3.29Å; Q233-A237 PolarHBondContact O-N 3.1Å; Q233-H286 HydrophobicContact CB-CB 4.12Å
234R89.6Confident91.4Very high81 Ų8154.2 Ų54.231%0.30625%0.254SS..Hα-helixtrans-60-49.3176.3-160.9-174.5-45160.613.7111.8L228 R229 S230 I232 N236 A237 M238L228-R234 HydrophobicContact CB-CB 4.27Å; L228-R234 PolarHBondContact O-NE 3.27Å; L228-R234 VanDerWaalsContact O-NE 3.09Å; R229-R234 PolarHBondContact O-NH2 3.14Å; S230-R234 WeakPolarHBondContact O-CB 3.22Å; S230-R234 PolarHBondContact O-N 3.49Å; I232-R234 VanDerWaalsContact C-N 3.32Å; I232-R234 PolarHBondContact O-N 3.17Å; R234-N236 PolarHBondContact O-N 3.35Å; R234-A237 PolarHBondContact O-N 3.43Å; R234-M238 HydrophobicContact CG-CE 4.2Å; R234-M238 WeakPolarHBondContact O-CG 3.44Å; R234-M238 PolarHBondContact O-N 2.99Å
235K92.1Very high91.6Very high95 Ų9553.6 Ų53.641%0.41325%0.25SS..Hα-helixtrans-57.5-47.9175.3-179.3-175.265.966.70111.7P231 I232 M238 F239P231-K235 WeakPolarHBondContact O-CB 3.5Å; P231-K235 PolarHBondContact O-N 3.21Å; I232-K235 PolarHBondContact O-N 2.96Å; K235-M238 PolarHBondContact O-N 3.49Å; K235-F239 HydrophobicContact CD-CE2 3.85Å; K235-F239 HydrophobicContact CD-CZ 4.23Å; K235-F239 HydrophobicContact CG-CD2 4.05Å; K235-F239 HydrophobicContact CG-CE2 3.52Å; K235-F239 HydrophobicContact CG-CZ 3.81Å; K235-F239 WeakPolarHBondContact O-CG 3.47Å; K235-F239 PolarHBondContact O-N 2.63Å; K235-F239 VanDerWaalsContact O-N 3.08Å
236N93.1Very high92Very high46 Ų4655.2 Ų55.225%0.24626%0.264CS..Hα-helixtrans-65.3-42.6-179-68.2-3.1000111.3I232 Q233 R234 M238 F239 N240I232-N236 WeakPolarHBondContact O-CB 3.24Å; I232-N236 PolarHBondContact O-N 2.92Å; I232-N236 PolarHBondContact O-OD1 3.21Å; Q233-N236 PolarHBondContact O-N 2.93Å; R234-N236 PolarHBondContact O-N 3.35Å; N236-M238 VanDerWaalsContact C-N 3.32Å; N236-M238 PolarHBondContact O-N 3.44Å; N236-F239 PolarHBondContact O-N 2.58Å; N236-N240 VanDerWaalsContact O-CB 3.29Å; N236-N240 WeakPolarHBondContact O-CB 3.28Å; N236-N240 VanDerWaalsContact O-CG 3.24Å; N236-N240 PolarHBondContact O-N 2.97Å; N236-N240 PolarHBondContact O-ND2 2.94Å; N236-N240 VanDerWaalsContact O-ND2 3.12Å
237A94.1Very high92.5Very high0 Ų056 Ų560%027%0.268CS..Hα-helixtrans-58.5-42.817500000112.4L228 Q233 R234 T241 C285 H286L228-A237 HydrophobicContact CD1-CB 3.4Å; L228-A237 VanDerWaalsContact CD1-CB 3.4Å; Q233-A237 VanDerWaalsContact O-CB 3.28Å; Q233-A237 WeakPolarHBondContact O-CB 3.29Å; Q233-A237 PolarHBondContact O-N 3.1Å; R234-A237 PolarHBondContact O-N 3.43Å; A237-T241 WeakPolarHBondContact O-CB 3.45Å; A237-T241 PolarHBondContact O-N 3.23Å; A237-T241 PolarHBondContact O-OG1 3.27Å; A237-C285 HydrophobicContact CB-CB 4.08Å; A237-C285 WeakPolarHBondContact CB-SG 3.49Å; A237-H286 HydrophobicContact CB-CB 4.29Å
238M94.4Very high93Very high61 Ų6155 Ų5530%0.326%0.263SS..Hα-helixtrans-60.9-51.7175.8-72.1174.5171.200111.6P221 S225 R234 K235 N236 T241 Y242P221-M238 HydrophobicContact CB-CB 4.42Å; S225-M238 VanDerWaalsContact OG-CE 3.27Å; S225-M238 WeakPolarHBondContact OG-CE 3.39Å; S225-M238 WeakPolarHBondContact OG-CG 3.48Å; R234-M238 HydrophobicContact CG-CE 4.2Å; R234-M238 WeakPolarHBondContact O-CG 3.44Å; R234-M238 PolarHBondContact O-N 2.99Å; K235-M238 PolarHBondContact O-N 3.49Å; N236-M238 VanDerWaalsContact C-N 3.32Å; N236-M238 PolarHBondContact O-N 3.44Å; M238-T241 PolarHBondContact O-N 2.72Å; M238-Y242 WeakPolarHBondContact O-CB 3.44Å; M238-Y242 PolarHBondContact O-N 2.9Å
239F95.9Very high93.5Very high106 Ų10655.6 Ų55.647%0.46527%0.267SS..Hα-helixtrans-62.6-49.2-179.5-66.2-19.9000112.2K235 N236 T241 Y242 Y243K235-F239 HydrophobicContact CD-CE2 3.85Å; K235-F239 HydrophobicContact CD-CZ 4.23Å; K235-F239 HydrophobicContact CG-CD2 4.05Å; K235-F239 HydrophobicContact CG-CE2 3.52Å; K235-F239 HydrophobicContact CG-CZ 3.81Å; K235-F239 WeakPolarHBondContact O-CG 3.47Å; K235-F239 PolarHBondContact O-N 2.63Å; K235-F239 VanDerWaalsContact O-N 3.08Å; N236-F239 PolarHBondContact O-N 2.58Å; F239-T241 VanDerWaalsContact C-N 3.31Å; F239-T241 PolarHBondContact O-N 3.34Å; F239-Y242 PolarHBondContact O-N 3.41Å; F239-Y243 HydrophobicContact CB-CD2 4.37Å; F239-Y243 HydrophobicContact CB-CE2 4.14Å; F239-Y243 WeakPolarHBondContact O-CD2 3.29Å; F239-Y243 PolarHBondContact O-N 3.35Å
240N96.9Very high94.2Very high7 Ų753.5 Ų53.54%0.03727%0.27CS..Hα-helixtrans-62.5-40.1-179.4-69.9-31.6000111.5N236 A244 C285 I288 A294N236-N240 VanDerWaalsContact O-CB 3.29Å; N236-N240 WeakPolarHBondContact O-CB 3.28Å; N236-N240 VanDerWaalsContact O-CG 3.24Å; N236-N240 PolarHBondContact O-N 2.97Å; N236-N240 PolarHBondContact O-ND2 2.94Å; N236-N240 VanDerWaalsContact O-ND2 3.12Å; N240-A244 WeakPolarHBondContact O-CB 3.37Å; N240-A244 PolarHBondContact O-N 2.82Å; N240-C285 PolarHBondContact ND2-O 3.23Å; N240-I288 HydrophobicContact CB-CB 4.48Å; N240-I288 HydrophobicContact CB-CD1 4.47Å; N240-I288 WeakPolarHBondContact ND2-CB 3.14Å; N240-I288 PolarHBondContact ND2-O 2.96Å; N240-A294 HydrophobicContact CB-CB 3.84Å; N240-A294 WeakPolarHBondContact O-CB 3.19Å
241T96.6Very high94.7Very high0 Ų052 Ų520%026%0.259CS..Hα-helixtrans-63.4-45.1175.3-57.60000111.6W220 P221 N224 A237 M238 F239 A244 L245 V281W220-T241 HydrophobicContact CB-CG2 4.24Å; W220-T241 HydrophobicContact CG-CG2 4.44Å; P221-T241 HydrophobicContact CB-CG2 4.37Å; P221-T241 HydrophobicContact CG-CG2 4.12Å; N224-T241 HydrophobicContact CB-CG2 4.4Å; N224-T241 WeakPolarHBondContact CB-OG1 3.31Å; N224-T241 WeakPolarHBondContact ND2-CG2 3.19Å; N224-T241 PolarHBondContact ND2-OG1 3.39Å; A237-T241 WeakPolarHBondContact O-CB 3.45Å; A237-T241 PolarHBondContact O-N 3.23Å; A237-T241 PolarHBondContact O-OG1 3.27Å; M238-T241 PolarHBondContact O-N 2.72Å; F239-T241 VanDerWaalsContact C-N 3.31Å; F239-T241 PolarHBondContact O-N 3.34Å; T241-A244 PolarHBondContact O-N 2.96Å; T241-L245 HydrophobicContact CG2-CD1 4.14Å; T241-L245 WeakPolarHBondContact O-CB 3.26Å; T241-L245 WeakPolarHBondContact O-CG 3.27Å; T241-L245 PolarHBondContact O-N 2.93Å; T241-V281 HydrophobicContact CG2-CG2 4.16Å
242Y97.2Very high95Very high120 Ų12047.6 Ų47.647%0.47123%0.23SC..Hα-helixtrans-61.7-47.2178.9-176.1-94.2000112.2W217 M238 F239 A244 L245 A246W217-Y242 HydrophobicContact CH2-CD2 4.46Å; W217-Y242 AromaticContact CH2-CE2 3.72Å; W217-Y242 HydrophobicContact CH2-CE2 3.72Å; W217-Y242 HydrophobicContact CZ3-CE2 4.22Å; M238-Y242 WeakPolarHBondContact O-CB 3.44Å; M238-Y242 PolarHBondContact O-N 2.9Å; F239-Y242 PolarHBondContact O-N 3.41Å; Y242-A244 PolarHBondContact O-N 3.42Å; Y242-L245 PolarHBondContact O-N 3.05Å; Y242-A246 WeakPolarHBondContact O-CB 3.34Å; Y242-A246 PolarHBondContact O-N 3.44Å
243Y98Very high95.2Very high92 Ų9246 Ų4636%0.36122%0.222SC..Hα-helixtrans-64.5-41.2179-71-56.7000112.7F239 A246 V247 P291F239-Y243 HydrophobicContact CB-CD2 4.37Å; F239-Y243 HydrophobicContact CB-CE2 4.14Å; F239-Y243 WeakPolarHBondContact O-CD2 3.29Å; F239-Y243 PolarHBondContact O-N 3.35Å; Y243-A246 PolarHBondContact O-N 2.89Å; Y243-V247 WeakPolarHBondContact O-CG2 3.37Å; Y243-V247 PolarHBondContact O-N 3.44Å; Y243-V247 VanDerWaalsContact O-N 3.12Å; Y243-P291 HydrophobicContact CD2-CB 3.72Å; Y243-P291 HydrophobicContact CD2-CG 4.38Å; Y243-P291 HydrophobicContact CE2-CB 3.79Å; Y243-P291 HydrophobicContact CE2-CG 4.06Å; Y243-P291 HydrophobicContact CG-CB 4.38Å
244A97.9Very high95.4Very high0 Ų045.6 Ų45.60%023%0.228CC..Hα-helixtrans-62.3-44.3175.900000111.7N240 T241 Y242 V247 S248 V281 A294 G298N240-A244 WeakPolarHBondContact O-CB 3.37Å; N240-A244 PolarHBondContact O-N 2.82Å; T241-A244 PolarHBondContact O-N 2.96Å; Y242-A244 PolarHBondContact O-N 3.42Å; A244-V247 PolarHBondContact O-N 3.42Å; A244-S248 WeakPolarHBondContact O-CB 3.2Å; A244-S248 PolarHBondContact O-N 3.18Å; A244-S248 PolarHBondContact O-OG 3.42Å; A244-S248 VanDerWaalsContact O-OG 3.09Å; A244-V281 HydrophobicContact CB-CB 4.45Å; A244-V281 HydrophobicContact CB-CG1 3.46Å; A244-V281 VanDerWaalsContact CB-CG1 3.46Å; A244-V281 HydrophobicContact CB-CG2 4.17Å; A244-A294 WeakPolarHBondContact CA-O 3.2Å; A244-A294 WeakPolarHBondContact CB-O 3.39Å; A244-G298 WeakPolarHBondContact O-CA 3.34Å
245L96.9Very high95.5Very high1 Ų142.3 Ų42.31%0.00522%0.22CC..Hα-helixtrans-63.7-41.9176.4-84.1179.2000113.1W217 W220 T241 Y242 V247 S248 V249W217-L245 HydrophobicContact CG-CD1 4.5Å; W217-L245 HydrophobicContact CZ2-CB 4.48Å; W217-L245 PolarHBondContact NE1-O 3.24Å; W217-L245 WeakPolarHBondContact O-CD1 3.43Å; W220-L245 HydrophobicContact CB-CD1 3.53Å; W220-L245 HydrophobicContact CG-CD1 4.17Å; T241-L245 HydrophobicContact CG2-CD1 4.14Å; T241-L245 WeakPolarHBondContact O-CB 3.26Å; T241-L245 WeakPolarHBondContact O-CG 3.27Å; T241-L245 PolarHBondContact O-N 2.93Å; Y242-L245 PolarHBondContact O-N 3.05Å; L245-V247 VanDerWaalsContact C-N 3.34Å; L245-V247 PolarHBondContact O-N 3.47Å; L245-S248 PolarHBondContact O-N 3.09Å; L245-V249 WeakPolarHBondContact O-CG2 3.29Å; L245-V249 PolarHBondContact O-N 3.13Å
246A97.5Very high95.4Very high34 Ų3437.8 Ų37.828%0.28120%0.2SC..Hα-helixtrans-59.4-45.8176.700000111.3Y242 Y243 V249 V250Y242-A246 WeakPolarHBondContact O-CB 3.34Å; Y242-A246 PolarHBondContact O-N 3.44Å; Y243-A246 PolarHBondContact O-N 2.89Å; A246-V249 PolarHBondContact O-N 3.46Å; A246-V250 PolarHBondContact O-N 3.44Å
247V97.8Very high95.3Very high25 Ų2537.4 Ų37.415%0.15220%0.2CC..Hα-helixtrans-68.8-37.8177.7177.70000111.7Y243 A244 L245 V249 V250 T251 M295 L299Y243-V247 WeakPolarHBondContact O-CG2 3.37Å; Y243-V247 PolarHBondContact O-N 3.44Å; Y243-V247 VanDerWaalsContact O-N 3.12Å; A244-V247 PolarHBondContact O-N 3.42Å; L245-V247 VanDerWaalsContact C-N 3.34Å; L245-V247 PolarHBondContact O-N 3.47Å; V247-V249 VanDerWaalsContact C-N 3.29Å; V247-V249 PolarHBondContact O-N 3.36Å; V247-V250 PolarHBondContact O-N 3.04Å; V247-T251 WeakPolarHBondContact O-CB 3.34Å; V247-T251 PolarHBondContact O-N 3.46Å; V247-T251 PolarHBondContact O-OG1 3.31Å; V247-M295 WeakPolarHBondContact CG1-O 3.46Å; V247-M295 HydrophobicContact CG2-CB 3.74Å; V247-M295 HydrophobicContact CG2-CE 3.73Å; V247-M295 HydrophobicContact CG2-CG 3.78Å; V247-L299 HydrophobicContact CG1-CB 3.72Å
248S96.4Very high95.1Very high0 Ų043.6 Ų43.60%023%0.233CC..Hα-helixtrans-59.7-36.7174.3-710000112.8A244 L245 T251 A252 G277 G298A244-S248 WeakPolarHBondContact O-CB 3.2Å; A244-S248 PolarHBondContact O-N 3.18Å; A244-S248 PolarHBondContact O-OG 3.42Å; A244-S248 VanDerWaalsContact O-OG 3.09Å; L245-S248 PolarHBondContact O-N 3.09Å; S248-T251 PolarHBondContact O-N 3.02Å; S248-A252 WeakPolarHBondContact O-CB 3.43Å; S248-A252 PolarHBondContact O-N 3.34Å; S248-G277 WeakPolarHBondContact OG-CA 3.47Å; S248-G277 PolarHBondContact OG-N 3.17Å; S248-G298 PolarHBondContact OG-O 2.83Å
249V96Very high94.6Very high39 Ų3941.6 Ų41.624%0.23623%0.226CC..Hα-helixtrans-64.1-48.6174.8173.80000111.5L245 A246 V247 T251 A252 I253 V274L245-V249 WeakPolarHBondContact O-CG2 3.29Å; L245-V249 PolarHBondContact O-N 3.13Å; A246-V249 PolarHBondContact O-N 3.46Å; V247-V249 VanDerWaalsContact C-N 3.29Å; V247-V249 PolarHBondContact O-N 3.36Å; V249-T251 VanDerWaalsContact C-N 3.27Å; V249-T251 PolarHBondContact O-N 3.04Å; V249-A252 WeakPolarHBondContact O-CB 3.45Å; V249-A252 PolarHBondContact O-N 2.94Å; V249-I253 HydrophobicContact CG1-CD1 4.2Å; V249-I253 PolarHBondContact O-N 3.26Å; V249-V274 HydrophobicContact CB-CG2 4.49Å; V249-V274 HydrophobicContact CG2-CB 4.45Å; V249-V274 HydrophobicContact CG2-CG1 4.16Å; V249-V274 HydrophobicContact CG2-CG2 4.06Å
250V96.8Very high94Very high94 Ų9439 Ų3957%0.5722%0.216SC*.Hα-helixtrans-60.4-42.7178.4176.80000110.3A246 V247 S254A246-V250 PolarHBondContact O-N 3.44Å; V247-V250 PolarHBondContact O-N 3.04Å; V250-S254 VanDerWaalsContact O-CB 3.24Å; V250-S254 WeakPolarHBondContact O-CB 3.39Å; V250-S254 PolarHBondContact O-N 2.87Å; V250-S254 PolarHBondContact O-OG 3.34Å
251T95.6Very high93.3Very high10 Ų1044.7 Ų44.76%0.06125%0.253CS..Hα-helixtrans-64.5-40.9176.4-52.60000111.7V247 S248 V249 G255 L299 L303 I306V247-T251 WeakPolarHBondContact O-CB 3.34Å; V247-T251 PolarHBondContact O-N 3.46Å; V247-T251 PolarHBondContact O-OG1 3.31Å; S248-T251 PolarHBondContact O-N 3.02Å; V249-T251 VanDerWaalsContact C-N 3.27Å; V249-T251 PolarHBondContact O-N 3.04Å; T251-G255 VanDerWaalsContact O-CA 3.3Å; T251-G255 WeakPolarHBondContact O-CA 3.32Å; T251-G255 PolarHBondContact O-N 2.96Å; T251-L299 HydrophobicContact CG2-CD1 3.86Å; T251-L299 WeakPolarHBondContact OG1-CD1 3.33Å; T251-L303 HydrophobicContact CG2-CD2 3.87Å; T251-L303 HydrophobicContact CG2-CG 3.85Å; T251-I306 WeakPolarHBondContact O-CD1 3.38Å
252A93.1Very high92.7Very high0 Ų050.8 Ų50.80%028%0.281CS..Hα-helixtrans-60.1-49.317900000111.3S248 V249 S256 A273 V274S248-A252 WeakPolarHBondContact O-CB 3.43Å; S248-A252 PolarHBondContact O-N 3.34Å; V249-A252 WeakPolarHBondContact O-CB 3.45Å; V249-A252 PolarHBondContact O-N 2.94Å; A252-S256 WeakPolarHBondContact O-CA 3.28Å; A252-S256 WeakPolarHBondContact O-CB 3.38Å; A252-S256 PolarHBondContact O-N 3.1Å; A252-A273 HydrophobicContact CB-CB 3.52Å; A252-V274 HydrophobicContact CB-CG2 3.93Å
253I93.4Very high92.1Very high75 Ų7554 Ų5439%0.38529%0.292SS..Hα-helixtrans-68.9-50-178.8-65.1173.3000110.5V249 S256 S257 I265V249-I253 HydrophobicContact CG1-CD1 4.2Å; V249-I253 PolarHBondContact O-N 3.26Å; I253-S256 PolarHBondContact O-N 3.18Å; I253-S257 PolarHBondContact O-N 3.44Å; I253-S257 VanDerWaalsContact O-N 3.08Å; I253-I265 HydrophobicContact CG2-CD1 3.82Å; I253-I265 HydrophobicContact CG2-CG1 4.36Å
254S94.6Very high91.6Very high72 Ų7255.4 Ų55.450%0.50330%0.3SS..Hα-helixtrans-68-47.8-175.2-49.80000111.3V250 S257 L258V250-S254 VanDerWaalsContact O-CB 3.24Å; V250-S254 WeakPolarHBondContact O-CB 3.39Å; V250-S254 PolarHBondContact O-N 2.87Å; V250-S254 PolarHBondContact O-OG 3.34Å; S254-S257 PolarHBondContact O-N 3.34Å; S254-L258 PolarHBondContact O-N 2.95Å
255G90.7Very high91Very high12 Ų1260.4 Ų60.412%0.12433%0.326CS..Hα-helixtrans-68.7-33.3177.800000112.6T251 L258 A259T251-G255 VanDerWaalsContact O-CA 3.3Å; T251-G255 WeakPolarHBondContact O-CA 3.32Å; T251-G255 PolarHBondContact O-N 2.96Å; G255-L258 PolarHBondContact O-N 2.85Å; G255-A259 WeakPolarHBondContact O-CB 3.01Å; G255-A259 PolarHBondContact O-N 3.34Å
256S89.6Confident90.4Very high0 Ų061.6 Ų61.60%033%0.334CS..Hα-helixtrans-62.2-44.9171.9174.30000111.4A252 I253 L258 A259 H260 S266A252-S256 WeakPolarHBondContact O-CA 3.28Å; A252-S256 WeakPolarHBondContact O-CB 3.38Å; A252-S256 PolarHBondContact O-N 3.1Å; I253-S256 PolarHBondContact O-N 3.18Å; S256-L258 VanDerWaalsContact C-N 3.34Å; S256-A259 PolarHBondContact O-N 2.78Å; S256-H260 WeakPolarHBondContact O-CB 3.45Å; S256-H260 PolarHBondContact O-N 3.48Å; S256-S266 PolarHBondContact OG-N 3.41Å
257S91.6Very high89.6Confident37 Ų3763.2 Ų63.226%0.25934%0.337SS..Hα-helixtrans-62.3-44.6177.7-179.80000110.5I253 S254 A259 H260 R263I253-S257 PolarHBondContact O-N 3.44Å; I253-S257 VanDerWaalsContact O-N 3.08Å; S254-S257 PolarHBondContact O-N 3.34Å; S257-A259 PolarHBondContact O-N 3.45Å; S257-H260 PolarHBondContact O-N 3.32Å; S257-R263 VanDerWaalsContact O-CA 3.32Å; S257-R263 WeakPolarHBondContact O-CA 3.47Å; S257-R263 PolarHBondContact OG-O 3.31Å
258L89.6Confident88.7Confident130 Ų13066.1 Ų66.168%0.68136%0.355SS*.Hα-helixtrans-65.8-37.4179-172.263.4000113.3S254 G255 S256S254-L258 PolarHBondContact O-N 2.95Å; G255-L258 PolarHBondContact O-N 2.85Å; S256-L258 VanDerWaalsContact C-N 3.34Å
259A84.6Confident88Confident20 Ų2067.8 Ų67.817%0.16536%0.362CS..Hα-helixtrans-78.5-20.7-176.400000113.8G255 S256 S257 Y269 I306 K310G255-A259 WeakPolarHBondContact O-CB 3.01Å; G255-A259 PolarHBondContact O-N 3.34Å; S256-A259 PolarHBondContact O-N 2.78Å; S257-A259 PolarHBondContact O-N 3.45Å; A259-Y269 HydrophobicContact CB-CE2 4.38Å; A259-I306 HydrophobicContact CB-CG2 3.84Å; A259-K310 PolarHBondContact O-NZ 3.31Å
260H82.9Confident87.6Confident52 Ų5266.4 Ų66.424%0.24135%0.353CS..SBendtrans-83.9131.9-177.6-165.9-86.5000111.6S256 S257 Q262 R263 K264S256-H260 WeakPolarHBondContact O-CB 3.45Å; S256-H260 PolarHBondContact O-N 3.48Å; S257-H260 PolarHBondContact O-N 3.32Å; H260-Q262 PolarHBondContact ND1-N 3.46Å; H260-Q262 PolarHBondContact O-N 2.88Å; H260-Q262 VanDerWaalsContact O-N 3.08Å; H260-R263 PolarHBondContact O-N 2.88Å; H260-K264 WeakPolarHBondContact CB-O 3.46Å
261P82.3Confident86.8Confident125 Ų12563 Ų6381%0.81233%0.331SS*.THydrogen-bonded Turntrans-55.1-34.3-176.5-27.134.3000114.6
262Q84.7Confident86.1Confident129 Ų12962.9 Ų62.960%0.60333%0.331SS*.THydrogen-bonded Turntrans-92.58.7179.2-59.8-178.1-5.100114.5H260 K264H260-Q262 PolarHBondContact ND1-N 3.46Å; H260-Q262 PolarHBondContact O-N 2.88Å; H260-Q262 VanDerWaalsContact O-N 3.08Å; Q262-K264 HydrophobicContact CB-CD 4.31Å; Q262-K264 HydrophobicContact CB-CG 4.2Å; Q262-K264 PolarHBondContact O-N 3.04Å
263R84.9Confident86Confident186 Ų18662.9 Ų62.970%0.70233%0.331SS*.SBendtrans52.734.2-172-58.8-145.6-176-175.23.5115.6S257 H260S257-R263 VanDerWaalsContact O-CA 3.32Å; S257-R263 WeakPolarHBondContact O-CA 3.47Å; S257-R263 PolarHBondContact OG-O 3.31Å; H260-R263 PolarHBondContact O-N 2.88Å
264K86.4Confident86Confident122 Ų12259.7 Ų59.753%0.5332%0.315SS..  trans-101.1152.8175.6-67.5-179.4-178.5166.40110.3H260 Q262H260-K264 WeakPolarHBondContact CB-O 3.46Å; Q262-K264 HydrophobicContact CB-CD 4.31Å; Q262-K264 HydrophobicContact CB-CG 4.2Å; Q262-K264 PolarHBondContact O-N 3.04Å
265I86.7Confident85.9Confident105 Ų10556.3 Ų56.354%0.53829%0.291SS..  trans-77.8127175.6-58.9164.2000108.6I253 V270I253-I265 HydrophobicContact CG2-CD1 3.82Å; I253-I265 HydrophobicContact CG2-CG1 4.36Å; I265-V270 HydrophobicContact CG2-CG2 3.54Å
266S83.8Confident86Confident26 Ų2655.8 Ų55.818%0.18229%0.285CS..  trans-106.1124.2178.6172.60000109.6S256 T268 Y269 V270S256-S266 PolarHBondContact OG-N 3.41Å; S266-T268 PolarHBondContact O-N 3.37Å; S266-Y269 PolarHBondContact O-N 3.43Å; S266-Y269 VanDerWaalsContact O-N 3.1Å; S266-V270 WeakPolarHBondContact O-CG2 3.35Å; S266-V270 PolarHBondContact O-N 3.35Å; S266-V270 VanDerWaalsContact O-N 3.11Å
267M81.2Confident86.3Confident68 Ų6855.8 Ų55.834%0.33529%0.285SS..Hα-helixtrans-62-28.4-178.5-155.567.8-179.700113M210 Y269 V270 H271M210-M267 HydrophobicContact CB-CE 3.57Å; M210-M267 HydrophobicContact CE-CE 4.48Å; M210-M267 HydrophobicContact CG-CE 3.48Å; M210-M267 VanDerWaalsContact CG-CE 3.48Å; M210-M267 HydrophobicContact SD-CE 3.32Å; M210-M267 WeakPolarHBondContact SD-CE 3.04Å; M267-Y269 VanDerWaalsContact C-N 3.34Å; M267-Y269 PolarHBondContact O-N 3.42Å; M267-V270 PolarHBondContact O-N 3.24Å; M267-V270 HydrophobicContact SD-CB 4.37Å; M267-V270 HydrophobicContact SD-CG1 4.45Å; M267-H271 WeakPolarHBondContact CE-NE2 3.5Å; M267-H271 WeakPolarHBondContact CG-NE2 3.29Å; M267-H271 WeakPolarHBondContact O-CB 3.35Å; M267-H271 VanDerWaalsContact O-CG 3.27Å; M267-H271 PolarHBondContact O-N 3.08Å
268T77Confident86.4Confident86 Ų8654 Ų5453%0.52827%0.273SS..Hα-helixtrans-61.6-42.5176.1-50.80000111.8S266 S272S266-T268 PolarHBondContact O-N 3.37Å; T268-S272 PolarHBondContact O-N 3.04Å
269Y83.4Confident86.5Confident35 Ų3547.9 Ų47.914%0.13724%0.241CC..Hα-helixtrans-72.9-40.5177.3-60.6-36.8000111A259 S266 M267 S272 A273 A309 K310A259-Y269 HydrophobicContact CB-CE2 4.38Å; S266-Y269 PolarHBondContact O-N 3.43Å; S266-Y269 VanDerWaalsContact O-N 3.1Å; M267-Y269 VanDerWaalsContact C-N 3.34Å; M267-Y269 PolarHBondContact O-N 3.42Å; Y269-S272 PolarHBondContact O-N 3.38Å; Y269-A273 VanDerWaalsContact O-CB 3.26Å; Y269-A273 WeakPolarHBondContact O-CB 3.22Å; Y269-A273 PolarHBondContact O-N 3.35Å; Y269-A309 HydrophobicContact CD1-CB 3.69Å; Y269-A309 HydrophobicContact CE1-CB 3.93Å; Y269-K310 HydrophobicContact CE1-CB 4.47Å
270V86.8Confident86.9Confident10 Ų1046.9 Ų46.96%0.06123%0.233CC..Hα-helixtrans-61-50.8178.4175.50000111.4I265 S266 M267 S272 A273 V274I265-V270 HydrophobicContact CG2-CG2 3.54Å; S266-V270 WeakPolarHBondContact O-CG2 3.35Å; S266-V270 PolarHBondContact O-N 3.35Å; S266-V270 VanDerWaalsContact O-N 3.11Å; M267-V270 PolarHBondContact O-N 3.24Å; M267-V270 HydrophobicContact SD-CB 4.37Å; M267-V270 HydrophobicContact SD-CG1 4.45Å; V270-S272 VanDerWaalsContact C-N 3.26Å; V270-S272 PolarHBondContact O-N 3.42Å; V270-A273 PolarHBondContact O-N 2.9Å; V270-V274 HydrophobicContact CG1-CG2 3.78Å; V270-V274 VanDerWaalsContact O-CB 3.3Å; V270-V274 WeakPolarHBondContact O-CB 3.38Å; V270-V274 WeakPolarHBondContact O-CG2 3.4Å; V270-V274 PolarHBondContact O-N 3.1Å
271H80.9Confident87.4Confident24 Ų2444.4 Ų44.411%0.11122%0.221CC..Hα-helixtrans-57-38.8179-74169.3000113S206 M210 M267S206-H271 PolarHBondContact O-NE2 3.29Å; M210-H271 PolarHBondContact N-NE2 3.21Å; M267-H271 WeakPolarHBondContact CE-NE2 3.5Å; M267-H271 WeakPolarHBondContact CG-NE2 3.29Å; M267-H271 WeakPolarHBondContact O-CB 3.35Å; M267-H271 VanDerWaalsContact O-CG 3.27Å; M267-H271 PolarHBondContact O-N 3.08Å
272S79.9Confident87.8Confident7 Ų739 Ų395%0.04919%0.188CC..Hα-helixtrans-76.4-37.5-179-169.50000112.7T268 Y269 V270 S305 I331T268-S272 PolarHBondContact O-N 3.04Å; Y269-S272 PolarHBondContact O-N 3.38Å; V270-S272 VanDerWaalsContact C-N 3.26Å; V270-S272 PolarHBondContact O-N 3.42Å; S272-S305 WeakPolarHBondContact CB-OG 3.46Å; S272-S305 PolarHBondContact O-OG 3.18Å; S272-S305 PolarHBondContact OG-OG 3.46Å; S272-I331 WeakPolarHBondContact OG-CD1 3.32Å
273A90.4Very high88Confident0 Ų033.2 Ų33.20%016%0.162CC..Hα-helixtrans-93.6-27.4-169.200000113.9A252 Y269 V270 L275 A276 S305 I306A252-A273 HydrophobicContact CB-CB 3.52Å; Y269-A273 VanDerWaalsContact O-CB 3.26Å; Y269-A273 WeakPolarHBondContact O-CB 3.22Å; Y269-A273 PolarHBondContact O-N 3.35Å; V270-A273 PolarHBondContact O-N 2.9Å; A273-L275 PolarHBondContact O-N 3.28Å; A273-A276 VanDerWaalsContact O-CB 3.28Å; A273-A276 WeakPolarHBondContact O-CB 3.07Å; A273-A276 PolarHBondContact O-N 2.95Å; A273-A276 VanDerWaalsContact O-N 3.09Å; A273-S305 WeakPolarHBondContact CA-OG 2.9Å; A273-S305 PolarHBondContact N-OG 3.41Å; A273-I306 HydrophobicContact CB-CD1 4.35Å; A273-I306 HydrophobicContact CB-CG1 3.81Å
274V93.1Very high88.3Confident8 Ų824.4 Ų24.45%0.04813%0.128CC..THydrogen-bonded Turntrans-56.6-34.5-179.8149.30000112.9V249 A252 V270V249-V274 HydrophobicContact CB-CG2 4.49Å; V249-V274 HydrophobicContact CG2-CB 4.45Å; V249-V274 HydrophobicContact CG2-CG1 4.16Å; V249-V274 HydrophobicContact CG2-CG2 4.06Å; A252-V274 HydrophobicContact CB-CG2 3.93Å; V270-V274 HydrophobicContact CG1-CG2 3.78Å; V270-V274 VanDerWaalsContact O-CB 3.3Å; V270-V274 WeakPolarHBondContact O-CB 3.38Å; V270-V274 WeakPolarHBondContact O-CG2 3.4Å; V270-V274 PolarHBondContact O-N 3.1Å
275L92.6Very high88.5Confident1 Ų118.6 Ų18.61%0.00510%0.103CC..THydrogen-bonded Turntrans-96.4-3.2-176.8-59.3173.2000113.2L65 A213 L216 W217 W220 A273 G277 G278 V279L65-L275 HydrophobicContact CD1-CD1 4.17Å; L65-L275 HydrophobicContact CD2-CD1 4.43Å; A213-L275 HydrophobicContact CB-CD1 4.36Å; L216-L275 HydrophobicContact CB-CD1 3.99Å; L216-L275 HydrophobicContact CB-CD2 3.73Å; L216-L275 HydrophobicContact CD1-CD1 3.73Å; L216-L275 HydrophobicContact CG-CD1 4.47Å; W217-L275 HydrophobicContact CB-CD2 3.96Å; W220-L275 HydrophobicContact CE3-CB 4.47Å; W220-L275 HydrophobicContact CE3-CD2 3.83Å; W220-L275 HydrophobicContact CH2-CB 4.27Å; W220-L275 HydrophobicContact CZ3-CB 3.86Å; W220-L275 HydrophobicContact CZ3-CD1 3.91Å; W220-L275 HydrophobicContact CZ3-CD2 3.76Å; W220-L275 HydrophobicContact CZ3-CG 4.04Å; A273-L275 PolarHBondContact O-N 3.28Å; L275-G277 PolarHBondContact O-N 2.94Å; L275-G278 PolarHBondContact O-N 3.15Å; L275-G278 VanDerWaalsContact O-N 3.15Å; L275-V279 PolarHBondContact O-N 3.09Å
276A93.9Very high88.7Confident0 Ų015.5 Ų15.50%09%0.086CC..Hα-helixtrans-62.9-42.6-165.900000112.9A273 G278 V279 A280 A301 L335A273-A276 VanDerWaalsContact O-CB 3.28Å; A273-A276 WeakPolarHBondContact O-CB 3.07Å; A273-A276 PolarHBondContact O-N 2.95Å; A273-A276 VanDerWaalsContact O-N 3.09Å; A276-G278 VanDerWaalsContact C-N 3.32Å; A276-G278 PolarHBondContact O-N 3.4Å; A276-V279 PolarHBondContact O-N 3.1Å; A276-A280 WeakPolarHBondContact O-CB 3.38Å; A276-A280 PolarHBondContact O-N 3.49Å; A276-A301 HydrophobicContact CB-CB 4.03Å; A276-L335 HydrophobicContact CB-CD1 3.66Å; A276-L335 HydrophobicContact CB-CD2 3.97Å; A276-L335 HydrophobicContact CB-CG 4.48Å
277G95.1Very high89Confident0 Ų016.8 Ų16.80%09%0.091CC..Hα-helixtrans-64-34.8178.200000113.2S248 L275 A280 V281S248-G277 WeakPolarHBondContact OG-CA 3.47Å; S248-G277 PolarHBondContact OG-N 3.17Å; L275-G277 PolarHBondContact O-N 2.94Å; G277-A280 PolarHBondContact O-N 2.86Å; G277-V281 WeakPolarHBondContact O-CG2 3.37Å; G277-V281 PolarHBondContact O-N 3.34Å
278G93.4Very high89.5Confident0 Ų013.7 Ų13.70%08%0.076CC..Hα-helixtrans-65.3-41.4178.400000112.6W220 N224 L275 A276 G282W220-G278 PolarHBondContact NE1-O 2.84Å; W220-G278 VanDerWaalsContact NE1-O 3.1Å; N224-G278 PolarHBondContact ND2-O 3.46Å; L275-G278 PolarHBondContact O-N 3.15Å; L275-G278 VanDerWaalsContact O-N 3.15Å; A276-G278 VanDerWaalsContact C-N 3.32Å; A276-G278 PolarHBondContact O-N 3.4Å; G278-G282 PolarHBondContact O-N 2.79Å
279V92.5Very high90.1Very high1 Ų114.4 Ų14.41%0.0068%0.082CC..Hα-helixtrans-67.1-47.8172.7-176.50000110.3Y173 W220 L275 A276 V281 G282 F332 L335Y173-V279 HydrophobicContact CD1-CG1 4.07Å; Y173-V279 HydrophobicContact CG-CG1 4.09Å; W220-V279 HydrophobicContact CH2-CG2 3.71Å; W220-V279 HydrophobicContact CZ2-CB 4.35Å; W220-V279 HydrophobicContact CZ2-CG2 3.36Å; L275-V279 PolarHBondContact O-N 3.09Å; A276-V279 PolarHBondContact O-N 3.1Å; V279-V281 PolarHBondContact O-N 3.44Å; V279-G282 PolarHBondContact O-N 3.02Å; V279-F332 HydrophobicContact CG2-CD1 3.97Å; V279-F332 HydrophobicContact CG2-CE1 3.83Å; V279-F332 HydrophobicContact CG2-CZ 4.3Å; V279-L335 HydrophobicContact CB-CB 4.02Å; V279-L335 HydrophobicContact CB-CD1 4.42Å; V279-L335 HydrophobicContact CG1-CB 3.73Å
280A93.9Very high90.6Very high0 Ų013.9 Ų13.90%08%0.083CC..Hα-helixtrans-65.9-37.2-174.300000113.6A276 G277 G282 L297 A301 L338 G339A276-A280 WeakPolarHBondContact O-CB 3.38Å; A276-A280 PolarHBondContact O-N 3.49Å; G277-A280 PolarHBondContact O-N 2.86Å; A280-G282 VanDerWaalsContact C-N 3.27Å; A280-L297 HydrophobicContact CB-CD2 4.39Å; A280-L297 HydrophobicContact CB-CG 4.3Å; A280-A301 HydrophobicContact CB-CB 3.62Å; A280-L338 HydrophobicContact CB-CD2 4.03Å; A280-G339 WeakPolarHBondContact O-CA 3.19Å
281V93.7Very high90.9Very high0 Ų016.4 Ų16.40%010%0.1CC..THydrogen-bonded Turntrans-78.8-9.6172.8-66.40000112.9T241 A244 G277 V279 T283 S284 C285 I288 L297T241-V281 HydrophobicContact CG2-CG2 4.16Å; A244-V281 HydrophobicContact CB-CB 4.45Å; A244-V281 HydrophobicContact CB-CG1 3.46Å; A244-V281 VanDerWaalsContact CB-CG1 3.46Å; A244-V281 HydrophobicContact CB-CG2 4.17Å; G277-V281 WeakPolarHBondContact O-CG2 3.37Å; G277-V281 PolarHBondContact O-N 3.34Å; V279-V281 PolarHBondContact O-N 3.44Å; V281-T283 VanDerWaalsContact C-N 3.33Å; V281-T283 PolarHBondContact O-N 3.48Å; V281-T283 VanDerWaalsContact O-N 3.12Å; V281-S284 CarbonylContact O-C 3.57Å; V281-S284 PolarHBondContact O-N 2.88Å; V281-S284 PolarHBondContact O-OG 3.44Å; V281-C285 HydrophobicContact CB-CB 4.2Å; V281-C285 HydrophobicContact CG2-CB 4.4Å; V281-C285 WeakPolarHBondContact O-CA 3.38Å; V281-C285 WeakPolarHBondContact O-CB 3.31Å; V281-C285 PolarHBondContact O-N 3.06Å; V281-I288 HydrophobicContact CG1-CD1 4.05Å; V281-L297 HydrophobicContact CB-CD2 4.39Å; V281-L297 HydrophobicContact CG1-CB 4.46Å; V281-L297 HydrophobicContact CG1-CD2 3.61Å; V281-L297 HydrophobicContact CG1-CG 4.41Å
282G90Very high91.7Very high11 Ų1122.7 Ų22.711%0.11312%0.123CC..THydrogen-bonded Turntrans-46.9-52-166.200000114.3G278 V279 A280 C285G278-G282 PolarHBondContact O-N 2.79Å; V279-G282 PolarHBondContact O-N 3.02Å; A280-G282 VanDerWaalsContact C-N 3.27Å; G282-C285 PolarHBondContact O-SG 3.33Å
283T88.3Confident92.4Very high8 Ų824.8 Ų24.85%0.04913%0.133CC..THydrogen-bonded Turntrans-80.8-29.3-176.563.80000113.5R170 V281 H286 G339 E340 Y343R170-T283 HydrophobicContact CG-CG2 4.15Å; R170-T283 WeakPolarHBondContact O-CG2 3.4Å; V281-T283 VanDerWaalsContact C-N 3.33Å; V281-T283 PolarHBondContact O-N 3.48Å; V281-T283 VanDerWaalsContact O-N 3.12Å; T283-H286 PolarHBondContact O-CE1 3.43Å; T283-G339 PolarHBondContact OG1-O 3.03Å; T283-E340 HydrophobicContact CG2-CG 4.46Å; T283-E340 WeakPolarHBondContact CG2-OE1 3.33Å; T283-E340 PolarHBondContact OG1-N 2.82Å; T283-Y343 WeakPolarHBondContact O-CD2 3.48Å
284S90.9Very high92.7Very high0 Ų024.8 Ų24.80%013%0.133CC..THydrogen-bonded Turntrans-102.2-7.9-171.4560000114.5V281 H286 L287 I288V281-S284 CarbonylContact O-C 3.57Å; V281-S284 PolarHBondContact O-N 2.88Å; V281-S284 PolarHBondContact O-OG 3.44Å; S284-H286 PolarHBondContact O-N 2.92Å; S284-H286 VanDerWaalsContact O-N 3.07Å; S284-L287 PolarHBondContact O-N 2.95Å; S284-I288 PolarHBondContact O-N 2.91Å
285C91Very high93Very high1 Ų128.4 Ų28.41%0.00715%0.15CC..THydrogen-bonded Turntrans-55.4-34-169.157.80000114.2A237 N240 V281 G282A237-C285 HydrophobicContact CB-CB 4.08Å; A237-C285 WeakPolarHBondContact CB-SG 3.49Å; N240-C285 PolarHBondContact ND2-O 3.23Å; V281-C285 HydrophobicContact CB-CB 4.2Å; V281-C285 HydrophobicContact CG2-CB 4.4Å; V281-C285 WeakPolarHBondContact O-CA 3.38Å; V281-C285 WeakPolarHBondContact O-CB 3.31Å; V281-C285 PolarHBondContact O-N 3.06Å; G282-C285 PolarHBondContact O-SG 3.33Å
286H90.1Very high93.2Very high39 Ų3931.7 Ų31.718%0.18117%0.171CC..THydrogen-bonded Turntrans-81.3-18.9-179.768.1-78.3000113.8L228 Q233 A237 T283 S284 Y343L228-H286 HydrophobicContact CD1-CB 3.72Å; L228-H286 HydrophobicContact CD2-CB 4.28Å; Q233-H286 HydrophobicContact CB-CB 4.12Å; A237-H286 HydrophobicContact CB-CB 4.29Å; T283-H286 PolarHBondContact O-CE1 3.43Å; S284-H286 PolarHBondContact O-N 2.92Å; S284-H286 VanDerWaalsContact O-N 3.07Å; H286-Y343 AromaticContact CE1-CE2 3.99Å
287L90.3Very high93.3Very high53 Ų5332.5 Ų32.528%0.27718%0.175SC..THydrogen-bonded Turntrans-93.5-17.1179.7-64.8-174.7000113.3S284 P289 Y343 L346S284-L287 PolarHBondContact O-N 2.95Å; L287-P289 VanDerWaalsContact O-CD 3.23Å; L287-P289 WeakPolarHBondContact O-CD 3.1Å; L287-Y343 HydrophobicContact CD1-CD2 3.54Å; L287-Y343 HydrophobicContact CD1-CE2 3.31Å; L287-Y343 HydrophobicContact CG-CD2 4.45Å; L287-Y343 HydrophobicContact CG-CE2 4.22Å; L287-L346 HydrophobicContact CB-CB 4.3Å; L287-L346 HydrophobicContact CB-CD1 4.27Å
288I92.6Very high93.4Very high4 Ų432.5 Ų32.52%0.02118%0.175CC..  trans-66.8116.1179.8-66.7166.4000109.2N240 V281 S284 S290 L293 A294 L346N240-I288 HydrophobicContact CB-CB 4.48Å; N240-I288 HydrophobicContact CB-CD1 4.47Å; N240-I288 WeakPolarHBondContact ND2-CB 3.14Å; N240-I288 PolarHBondContact ND2-O 2.96Å; V281-I288 HydrophobicContact CG1-CD1 4.05Å; S284-I288 PolarHBondContact O-N 2.91Å; I288-S290 VanDerWaalsContact CG2-O 3.24Å; I288-S290 WeakPolarHBondContact CG2-O 3.32Å; I288-L293 HydrophobicContact CG2-CB 3.77Å; I288-A294 HydrophobicContact CD1-CB 4.16Å; I288-A294 HydrophobicContact CG2-CB 4.21Å; I288-L346 HydrophobicContact CG1-CD1 3.52Å
289P89.9Confident93.6Very high100 Ų10036.1 Ų36.165%0.64919%0.194SC*.  trans-78.9-26.2-172.330.7-35.7000113.2L287 L293L287-P289 VanDerWaalsContact O-CD 3.23Å; L287-P289 WeakPolarHBondContact O-CD 3.1Å; P289-L293 HydrophobicContact CG-CD1 3.89Å
290S92.6Very high93.8Very high25 Ų2538.9 Ų38.918%0.17521%0.21CC..SBendtrans-133.2141.5-173.460.90000112.4I288 W292 L293I288-S290 VanDerWaalsContact CG2-O 3.24Å; I288-S290 WeakPolarHBondContact CG2-O 3.32Å; S290-W292 VanDerWaalsContact C-N 3.29Å; S290-W292 PolarHBondContact O-N 3.45Å; S290-W292 VanDerWaalsContact OG-CD1 3.25Å; S290-W292 PolarHBondContact OG-NE1 3.5Å; S290-L293 PolarHBondContact O-N 3.37Å; S290-L293 VanDerWaalsContact OG-CD1 3.29Å; S290-L293 WeakPolarHBondContact OG-CD1 3.35Å; S290-L293 WeakPolarHBondContact OG-CG 3.09Å
291P94.8Very high93.8Very high62 Ų6238.9 Ų38.940%0.40321%0.21SC..Hα-helixtrans-57.5-36.2-178.2-29.636.7000114.7Y243 L293 A294 M295Y243-P291 HydrophobicContact CD2-CB 3.72Å; Y243-P291 HydrophobicContact CD2-CG 4.38Å; Y243-P291 HydrophobicContact CE2-CB 3.79Å; Y243-P291 HydrophobicContact CE2-CG 4.06Å; Y243-P291 HydrophobicContact CG-CB 4.38Å; P291-L293 VanDerWaalsContact C-N 3.25Å; P291-L293 PolarHBondContact O-N 3.41Å; P291-A294 WeakPolarHBondContact O-CB 3.36Å; P291-A294 PolarHBondContact O-N 3.22Å; P291-A294 VanDerWaalsContact O-N 3.12Å; P291-M295 WeakPolarHBondContact O-CG 3.44Å; P291-M295 PolarHBondContact O-N 3.43Å
292W96Very high93.9Very high156 Ų15638.9 Ų38.959%0.59121%0.21SC*.Hα-helixtrans-64.6-30.4-176.875.4-97.9000112.5S290 M295 V296S290-W292 VanDerWaalsContact C-N 3.29Å; S290-W292 PolarHBondContact O-N 3.45Å; S290-W292 VanDerWaalsContact OG-CD1 3.25Å; S290-W292 PolarHBondContact OG-NE1 3.5Å; W292-M295 WeakPolarHBondContact O-CB 3.32Å; W292-M295 PolarHBondContact O-N 3.09Å; W292-V296 HydrophobicContact CE3-CG2 3.91Å; W292-V296 HydrophobicContact CZ3-CG2 4.14Å; W292-V296 WeakPolarHBondContact O-CG2 3.47Å; W292-V296 PolarHBondContact O-N 3.46Å
293L95.8Very high94.1Very high52 Ų5242.9 Ų42.927%0.27223%0.229SC..Hα-helixtrans-66.6-41.6174.6-72.2172.2000111I288 P289 S290 P291 M295 V296 L297I288-L293 HydrophobicContact CG2-CB 3.77Å; P289-L293 HydrophobicContact CG-CD1 3.89Å; S290-L293 PolarHBondContact O-N 3.37Å; S290-L293 VanDerWaalsContact OG-CD1 3.29Å; S290-L293 WeakPolarHBondContact OG-CD1 3.35Å; S290-L293 WeakPolarHBondContact OG-CG 3.09Å; P291-L293 VanDerWaalsContact C-N 3.25Å; P291-L293 PolarHBondContact O-N 3.41Å; L293-M295 VanDerWaalsContact C-N 3.32Å; L293-M295 PolarHBondContact O-N 3.45Å; L293-V296 PolarHBondContact O-N 3.27Å; L293-L297 PolarHBondContact O-N 3.12Å
294A96.8Very high94.3Very high0 Ų045.4 Ų45.40%024%0.241CC..Hα-helixtrans-64.4-38.8174.400000111.6N240 A244 I288 P291 L297 G298N240-A294 HydrophobicContact CB-CB 3.84Å; N240-A294 WeakPolarHBondContact O-CB 3.19Å; A244-A294 WeakPolarHBondContact CA-O 3.2Å; A244-A294 WeakPolarHBondContact CB-O 3.39Å; I288-A294 HydrophobicContact CD1-CB 4.16Å; I288-A294 HydrophobicContact CG2-CB 4.21Å; P291-A294 WeakPolarHBondContact O-CB 3.36Å; P291-A294 PolarHBondContact O-N 3.22Å; P291-A294 VanDerWaalsContact O-N 3.12Å; A294-L297 PolarHBondContact O-N 3.25Å; A294-G298 PolarHBondContact O-N 3.3Å
295M98.1Very high94.3Very high83 Ų8345.4 Ų45.441%0.40924%0.241SC..Hα-helixtrans-60.9-47173.9-69.6177.875.300112.1V247 P291 W292 L293 L297 G298 L299V247-M295 WeakPolarHBondContact CG1-O 3.46Å; V247-M295 HydrophobicContact CG2-CB 3.74Å; V247-M295 HydrophobicContact CG2-CE 3.73Å; V247-M295 HydrophobicContact CG2-CG 3.78Å; P291-M295 WeakPolarHBondContact O-CG 3.44Å; P291-M295 PolarHBondContact O-N 3.43Å; W292-M295 WeakPolarHBondContact O-CB 3.32Å; W292-M295 PolarHBondContact O-N 3.09Å; L293-M295 VanDerWaalsContact C-N 3.32Å; L293-M295 PolarHBondContact O-N 3.45Å; M295-L297 VanDerWaalsContact C-N 3.33Å; M295-L297 PolarHBondContact O-N 3.1Å; M295-G298 PolarHBondContact O-N 2.92Å; M295-L299 PolarHBondContact O-N 3.17Å
296V97.3Very high94.3Very high71 Ų7145.9 Ų45.943%0.4324%0.243SC..Hα-helixtrans-60.8-43.6176169.90000110.7W292 L293 G298 L299 V300W292-V296 HydrophobicContact CE3-CG2 3.91Å; W292-V296 HydrophobicContact CZ3-CG2 4.14Å; W292-V296 WeakPolarHBondContact O-CG2 3.47Å; W292-V296 PolarHBondContact O-N 3.46Å; L293-V296 PolarHBondContact O-N 3.27Å; V296-G298 VanDerWaalsContact C-N 3.32Å; V296-G298 PolarHBondContact O-N 2.88Å; V296-L299 WeakPolarHBondContact O-CB 3.43Å; V296-L299 PolarHBondContact O-N 2.95Å; V296-V300 HydrophobicContact CG1-CG2 4.41Å; V296-V300 WeakPolarHBondContact O-CG2 3.41Å; V296-V300 PolarHBondContact O-N 2.89Å
297L96.3Very high94.2Very high17 Ų1745.5 Ų45.59%0.08925%0.251CS..Hα-helixtrans-62.7-40.4177-166.365.3000111.7A280 V281 L293 A294 M295 L299 V300 A301 L338 T342A280-L297 HydrophobicContact CB-CD2 4.39Å; A280-L297 HydrophobicContact CB-CG 4.3Å; V281-L297 HydrophobicContact CB-CD2 4.39Å; V281-L297 HydrophobicContact CG1-CB 4.46Å; V281-L297 HydrophobicContact CG1-CD2 3.61Å; V281-L297 HydrophobicContact CG1-CG 4.41Å; L293-L297 PolarHBondContact O-N 3.12Å; A294-L297 PolarHBondContact O-N 3.25Å; M295-L297 VanDerWaalsContact C-N 3.33Å; M295-L297 PolarHBondContact O-N 3.1Å; L297-L299 PolarHBondContact O-N 3.02Å; L297-V300 PolarHBondContact O-N 3.4Å; L297-A301 WeakPolarHBondContact O-CB 3.5Å; L297-A301 PolarHBondContact O-N 3.48Å; L297-L338 HydrophobicContact CD1-CD1 4.42Å; L297-L338 HydrophobicContact CD1-CD2 4.15Å; L297-L338 HydrophobicContact CD1-CG 4.1Å; L297-T342 HydrophobicContact CD1-CG2 4.3Å; L297-T342 WeakPolarHBondContact CD1-OG1 3.35Å; L297-T342 HydrophobicContact CD2-CG2 3.88Å
298G97Very high93.9Very high0 Ų043.4 Ų43.40%024%0.241CC..Hα-helixtrans-61.8-37.8174.400000113.8A244 S248 A294 M295 V296 G302A244-G298 WeakPolarHBondContact O-CA 3.34Å; S248-G298 PolarHBondContact OG-O 2.83Å; A294-G298 PolarHBondContact O-N 3.3Å; M295-G298 PolarHBondContact O-N 2.92Å; V296-G298 VanDerWaalsContact C-N 3.32Å; V296-G298 PolarHBondContact O-N 2.88Å; G298-G302 PolarHBondContact O-N 3.12Å
299L97.2Very high93.3Very high76 Ų7643.7 Ų43.740%0.39825%0.245SC..Hα-helixtrans-65.5-51.5174.1177.264.8000111V247 T251 M295 V296 L297 A301 G302 L303V247-L299 HydrophobicContact CG1-CB 3.72Å; T251-L299 HydrophobicContact CG2-CD1 3.86Å; T251-L299 WeakPolarHBondContact OG1-CD1 3.33Å; M295-L299 PolarHBondContact O-N 3.17Å; V296-L299 WeakPolarHBondContact O-CB 3.43Å; V296-L299 PolarHBondContact O-N 2.95Å; L297-L299 PolarHBondContact O-N 3.02Å; L299-A301 VanDerWaalsContact C-N 3.35Å; L299-A301 PolarHBondContact O-N 3.39Å; L299-G302 PolarHBondContact O-N 3.47Å; L299-L303 HydrophobicContact CD1-CD1 4.39Å; L299-L303 HydrophobicContact CG-CD1 4.37Å; L299-L303 WeakPolarHBondContact O-CG 3.32Å; L299-L303 PolarHBondContact O-N 2.95Å
300V96.4Very high92.8Very high58 Ų5844.2 Ų44.235%0.35224%0.237SC..Hα-helixtrans-60.6-45.9179.8172.40000110.6V296 L297 G302 L303 I304 L338V296-V300 HydrophobicContact CG1-CG2 4.41Å; V296-V300 WeakPolarHBondContact O-CG2 3.41Å; V296-V300 PolarHBondContact O-N 2.89Å; L297-V300 PolarHBondContact O-N 3.4Å; V300-G302 PolarHBondContact O-N 3.24Å; V300-L303 PolarHBondContact O-N 2.84Å; V300-I304 HydrophobicContact CG1-CD1 3.65Å; V300-I304 HydrophobicContact CG1-CG1 4.4Å; V300-I304 WeakPolarHBondContact O-CB 3.33Å; V300-I304 VanDerWaalsContact O-CG1 3.29Å; V300-I304 WeakPolarHBondContact O-CG1 3.3Å; V300-I304 PolarHBondContact O-N 3.22Å; V300-L338 HydrophobicContact CG1-CD2 4.33Å
301A96Very high92.2Very high0 Ų046.4 Ų46.40%025%0.251CS..Hα-helixtrans-58.9-45175.600000112.3A276 A280 L297 L299 I304 S305 L335 L338A276-A301 HydrophobicContact CB-CB 4.03Å; A280-A301 HydrophobicContact CB-CB 3.62Å; L297-A301 WeakPolarHBondContact O-CB 3.5Å; L297-A301 PolarHBondContact O-N 3.48Å; L299-A301 VanDerWaalsContact C-N 3.35Å; L299-A301 PolarHBondContact O-N 3.39Å; A301-I304 PolarHBondContact O-N 2.96Å; A301-S305 WeakPolarHBondContact O-CB 3.41Å; A301-S305 PolarHBondContact O-N 3.26Å; A301-L335 HydrophobicContact CB-CD2 3.75Å; A301-L338 HydrophobicContact CB-CD2 4.15Å
302G94.9Very high91.1Very high0 Ų045.2 Ų45.20%024%0.241CC..Hα-helixtrans-60.6-44.9176.600000112.5G298 L299 V300 S305 I306G298-G302 PolarHBondContact O-N 3.12Å; L299-G302 PolarHBondContact O-N 3.47Å; V300-G302 PolarHBondContact O-N 3.24Å; G302-S305 PolarHBondContact O-N 3.36Å; G302-I306 VanDerWaalsContact O-CG1 3.31Å; G302-I306 WeakPolarHBondContact O-CG1 3.32Å; G302-I306 PolarHBondContact O-N 3.38Å
303L93.8Very high89.8Confident95 Ų9539.7 Ų39.750%0.49723%0.226SC..Hα-helixtrans-65.8-42.8177.3-68.6175.2000112.3T251 L299 V300 S305 I306 G307T251-L303 HydrophobicContact CG2-CD2 3.87Å; T251-L303 HydrophobicContact CG2-CG 3.85Å; L299-L303 HydrophobicContact CD1-CD1 4.39Å; L299-L303 HydrophobicContact CG-CD1 4.37Å; L299-L303 WeakPolarHBondContact O-CG 3.32Å; L299-L303 PolarHBondContact O-N 2.95Å; V300-L303 PolarHBondContact O-N 2.84Å; L303-S305 VanDerWaalsContact C-N 3.29Å; L303-S305 PolarHBondContact O-N 2.99Å; L303-I306 PolarHBondContact O-N 3.34Å; L303-G307 PolarHBondContact O-N 2.86Å
304I93.2Very high88.4Confident61 Ų6142 Ų4231%0.31324%0.242SC..Hα-helixtrans-60.5-41.9175-71.5166.7000110.3V300 A301 G307 G308 L334 L338V300-I304 HydrophobicContact CG1-CD1 3.65Å; V300-I304 HydrophobicContact CG1-CG1 4.4Å; V300-I304 WeakPolarHBondContact O-CB 3.33Å; V300-I304 VanDerWaalsContact O-CG1 3.29Å; V300-I304 WeakPolarHBondContact O-CG1 3.3Å; V300-I304 PolarHBondContact O-N 3.22Å; A301-I304 PolarHBondContact O-N 2.96Å; I304-G307 PolarHBondContact O-N 3.02Å; I304-G308 PolarHBondContact O-N 3.09Å; I304-L334 HydrophobicContact CG2-CB 4.48Å; I304-L338 HydrophobicContact CD1-CD1 4.45Å; I304-L338 HydrophobicContact CD1-CD2 3.85Å
305S91.5Very high86.8Confident0 Ų045.6 Ų45.60%027%0.266CS..Hα-helixtrans-62.9-44.3177.4-178.30000112.2S272 A273 A301 G302 L303 G308 A309 I331S272-S305 WeakPolarHBondContact CB-OG 3.46Å; S272-S305 PolarHBondContact O-OG 3.18Å; S272-S305 PolarHBondContact OG-OG 3.46Å; A273-S305 WeakPolarHBondContact CA-OG 2.9Å; A273-S305 PolarHBondContact N-OG 3.41Å; A301-S305 WeakPolarHBondContact O-CB 3.41Å; A301-S305 PolarHBondContact O-N 3.26Å; G302-S305 PolarHBondContact O-N 3.36Å; L303-S305 VanDerWaalsContact C-N 3.29Å; L303-S305 PolarHBondContact O-N 2.99Å; S305-G308 PolarHBondContact O-N 3.15Å; S305-A309 WeakPolarHBondContact O-CB 3.1Å; S305-A309 PolarHBondContact O-N 2.96Å; S305-I331 WeakPolarHBondContact OG-CG2 3.43Å
306I89.5Confident84.9Confident11 Ų1142.8 Ų42.86%0.05625%0.254CS..Hα-helixtrans-65.5-46.1177.1-64.1165.9000111.1T251 A259 A273 G302 L303 G308 A309 K310T251-I306 WeakPolarHBondContact O-CD1 3.38Å; A259-I306 HydrophobicContact CB-CG2 3.84Å; A273-I306 HydrophobicContact CB-CD1 4.35Å; A273-I306 HydrophobicContact CB-CG1 3.81Å; G302-I306 VanDerWaalsContact O-CG1 3.31Å; G302-I306 WeakPolarHBondContact O-CG1 3.32Å; G302-I306 PolarHBondContact O-N 3.38Å; L303-I306 PolarHBondContact O-N 3.34Å; I306-G308 VanDerWaalsContact C-N 3.33Å; I306-G308 PolarHBondContact O-N 3.19Å; I306-A309 PolarHBondContact O-N 2.75Å; I306-K310 PolarHBondContact O-N 3.25Å; I306-K310 VanDerWaalsContact O-N 3.12Å
307G87.6Confident83.1Confident32 Ų3242 Ų4233%0.3325%0.247SC..Hα-helixtrans-60.5-43.6176.400000111.7L303 I304 K310 C311L303-G307 PolarHBondContact O-N 2.86Å; I304-G307 PolarHBondContact O-N 3.02Å; G307-K310 PolarHBondContact O-N 3.16Å; G307-C311 WeakPolarHBondContact O-CB 3.3Å; G307-C311 PolarHBondContact O-N 3.37Å; G307-C311 PolarHBondContact O-SG 3.44Å
308G84Confident81.1Confident8 Ų852 Ų528%0.08228%0.284CS..Hα-helixtrans-59.9-48.7174.600000112I304 S305 I306 K310 C311 L312I304-G308 PolarHBondContact O-N 3.09Å; S305-G308 PolarHBondContact O-N 3.15Å; I306-G308 VanDerWaalsContact C-N 3.33Å; I306-G308 PolarHBondContact O-N 3.19Å; G308-K310 PolarHBondContact O-N 3.32Å; G308-C311 PolarHBondContact O-N 3.03Å; G308-L312 WeakPolarHBondContact O-CB 3.45Å; G308-L312 WeakPolarHBondContact O-CD1 3.35Å; G308-L312 WeakPolarHBondContact O-CG 3.37Å; G308-L312 PolarHBondContact O-N 2.95Å
309A80.3Confident78.8Confident11 Ų1157.7 Ų57.79%0.09132%0.318CS..Hα-helixtrans-61.7-28179.500000113.1Y269 S305 I306 P313 I331Y269-A309 HydrophobicContact CD1-CB 3.69Å; Y269-A309 HydrophobicContact CE1-CB 3.93Å; S305-A309 WeakPolarHBondContact O-CB 3.1Å; S305-A309 PolarHBondContact O-N 2.96Å; I306-A309 PolarHBondContact O-N 2.75Å; A309-P313 WeakPolarHBondContact O-CD 3.43Å; A309-P313 WeakPolarHBondContact O-CG 3.33Å; A309-I331 HydrophobicContact CB-CD1 3.85Å
310K80.9Confident76.5Confident111 Ų11158.6 Ų58.648%0.48332%0.323SS..Hα-helixtrans-84.2-45.3176.6-172.2172.7179.4171.70112.9A259 Y269 I306 G307 G308A259-K310 PolarHBondContact O-NZ 3.31Å; Y269-K310 HydrophobicContact CE1-CB 4.47Å; I306-K310 PolarHBondContact O-N 3.25Å; I306-K310 VanDerWaalsContact O-N 3.12Å; G307-K310 PolarHBondContact O-N 3.16Å; G308-K310 PolarHBondContact O-N 3.32Å
311C78.4Confident74.1Confident71 Ų7157.1 Ų57.148%0.4832%0.32SS..Hα-helixtrans-94-38.4-169.2-63.10000113.9G307 G308 P313 V314 C315G307-C311 WeakPolarHBondContact O-CB 3.3Å; G307-C311 PolarHBondContact O-N 3.37Å; G307-C311 PolarHBondContact O-SG 3.44Å; G308-C311 PolarHBondContact O-N 3.03Å; C311-P313 VanDerWaalsContact C-CD 3.49Å; C311-V314 PolarHBondContact O-N 2.95Å; C311-V314 VanDerWaalsContact O-N 3.13Å; C311-C315 PolarHBondContact O-N 3.26Å; C311-C315 PolarHBondContact O-SG 3.45Å
312L73.3Confident72Confident37 Ų3758 Ų5819%0.19433%0.325CS..Hα-helixtrans-58.4-43.1-176.8-74.8158.1000113.3G308 V314 C315 C316 I331 L334G308-L312 WeakPolarHBondContact O-CB 3.45Å; G308-L312 WeakPolarHBondContact O-CD1 3.35Å; G308-L312 WeakPolarHBondContact O-CG 3.37Å; G308-L312 PolarHBondContact O-N 2.95Å; L312-V314 PolarHBondContact O-N 3.4Å; L312-C315 PolarHBondContact O-N 3.34Å; L312-C316 WeakPolarHBondContact O-CB 3.38Å; L312-C316 PolarHBondContact O-N 2.96Å; L312-I331 HydrophobicContact CD1-CG1 3.86Å; L312-L334 HydrophobicContact CD1-CD1 4Å
313P67.2Low69.7Low40 Ų4062.8 Ų62.826%0.2635%0.347SS..Hα-helixtrans-59.4-35.7178.3-21.731.9000112.4A309 C311 N317 V327A309-P313 WeakPolarHBondContact O-CD 3.43Å; A309-P313 WeakPolarHBondContact O-CG 3.33Å; C311-P313 VanDerWaalsContact C-CD 3.49Å; P313-N317 WeakPolarHBondContact O-CB 3.14Å; P313-N317 PolarHBondContact O-N 2.71Å; P313-N317 PolarHBondContact O-ND2 2.85Å; P313-V327 HydrophobicContact CB-CG2 4.45Å; P313-V327 HydrophobicContact CG-CG1 4.06Å; P313-V327 HydrophobicContact CG-CG2 3.79Å
314V67.4Low67.7Low101 Ų10162.9 Ų62.961%0.61234%0.344SS*.Hα-helixtrans-75.3-47.1-179.5-176.30000110.6C311 L312 R318C311-V314 PolarHBondContact O-N 2.95Å; C311-V314 VanDerWaalsContact O-N 3.13Å; L312-V314 PolarHBondContact O-N 3.4Å; V314-R318 WeakPolarHBondContact O-CB 3.39Å; V314-R318 PolarHBondContact O-N 3.46Å
315C62.6Low65.6Low75 Ų7561 Ų6151%0.50733%0.334SS..Hα-helixtrans-69.9-48.2-178.2-65.20000112.4C311 L312 N317 R318 V319C311-C315 PolarHBondContact O-N 3.26Å; C311-C315 PolarHBondContact O-SG 3.45Å; L312-C315 PolarHBondContact O-N 3.34Å; C315-N317 PolarHBondContact O-N 2.99Å; C315-R318 PolarHBondContact O-N 3.42Å; C315-V319 WeakPolarHBondContact O-CB 3.33Å; C315-V319 WeakPolarHBondContact O-CG2 3.42Å; C315-V319 PolarHBondContact O-N 3.22Å
316C59.1Low64.1Low24 Ų2462.7 Ų62.716%0.16235%0.346CS..Hα-helixtrans-68.7-33.3-178.8-680000112.4L312 L320 G321L312-C316 WeakPolarHBondContact O-CB 3.38Å; L312-C316 PolarHBondContact O-N 2.96Å; C316-L320 HydrophobicContact CB-CD1 4.42Å; C316-L320 WeakPolarHBondContact O-CB 3.28Å; C316-L320 PolarHBondContact O-N 2.99Å; C316-G321 PolarHBondContact O-N 3.46Å
317N59.2Low62.7Low53 Ų5364.5 Ų64.528%0.28336%0.358SS..Hα-helixtrans-67.9-39.2174.8-77.4-2.5000112.2P313 C315 G321 I322 H323P313-N317 WeakPolarHBondContact O-CB 3.14Å; P313-N317 PolarHBondContact O-N 2.71Å; P313-N317 PolarHBondContact O-ND2 2.85Å; C315-N317 PolarHBondContact O-N 2.99Å; N317-G321 WeakPolarHBondContact O-CA 3.48Å; N317-G321 PolarHBondContact O-N 3.41Å; N317-I322 PolarHBondContact OD1-O 2.91Å; N317-H323 VanDerWaalsContact OD1-CA 3.3Å; N317-H323 WeakPolarHBondContact OD1-CA 3.31Å
318R52.8Low61.5Low227 Ų22765 Ų6586%0.85735%0.352SS*.Hα-helixtrans-77.4-38.3-176.5-160.7177.9-161.4-178.94.8113.2V314 C315V314-R318 WeakPolarHBondContact O-CB 3.39Å; V314-R318 PolarHBondContact O-N 3.46Å; C315-R318 PolarHBondContact O-N 3.42Å
319V50.6Low60.9Low120 Ų12064.9 Ų64.973%0.72735%0.349SS*.Hα-helixtrans-97.7-42.1-172.1-178.90000112.6C315C315-V319 WeakPolarHBondContact O-CB 3.33Å; C315-V319 WeakPolarHBondContact O-CG2 3.42Å; C315-V319 PolarHBondContact O-N 3.22Å
320L47.3Very low60.4Low95 Ų9565 Ų6550%0.49735%0.35SS..THydrogen-bonded Turntrans-99.3-10.9-174.9-62165.7000112.4C316 I322C316-L320 HydrophobicContact CB-CD1 4.42Å; C316-L320 WeakPolarHBondContact O-CB 3.28Å; C316-L320 PolarHBondContact O-N 2.99Å; L320-I322 HydrophobicContact CB-CD1 3.58Å; L320-I322 HydrophobicContact CB-CG1 3.64Å; L320-I322 HydrophobicContact CD1-CD1 4.18Å; L320-I322 HydrophobicContact CG-CD1 4.41Å; L320-I322 VanDerWaalsContact O-CG1 3.27Å; L320-I322 WeakPolarHBondContact O-CG1 3.26Å; L320-I322 PolarHBondContact O-N 3.24Å
321G46.4Very low60.3Low28 Ų2859.8 Ų59.829%0.28933%0.327SS..  trans61.428.1-177.900000113K189 C316 N317K189-G321 WeakPolarHBondContact CD-O 3.29Å; K189-G321 VanDerWaalsContact CE-O 3.28Å; K189-G321 WeakPolarHBondContact CE-O 3.36Å; K189-G321 PolarHBondContact NZ-O 2.71Å; C316-G321 PolarHBondContact O-N 3.46Å; N317-G321 WeakPolarHBondContact O-CA 3.48Å; N317-G321 PolarHBondContact O-N 3.41Å
322I52.1Low60.3Low19 Ų1956.9 Ų56.910%0.09731%0.306CS..  trans-104.386.7-173.7-45.2172.4000109.6W185 N317 L320 H324 I325W185-I322 VanDerWaalsContact CD1-CD1 3.48Å; W185-I322 HydrophobicContact CG-CD1 4.43Å; N317-I322 PolarHBondContact OD1-O 2.91Å; L320-I322 HydrophobicContact CB-CD1 3.58Å; L320-I322 HydrophobicContact CB-CG1 3.64Å; L320-I322 HydrophobicContact CD1-CD1 4.18Å; L320-I322 HydrophobicContact CG-CD1 4.41Å; L320-I322 VanDerWaalsContact O-CG1 3.27Å; L320-I322 WeakPolarHBondContact O-CG1 3.26Å; L320-I322 PolarHBondContact O-N 3.24Å; I322-H324 PolarHBondContact O-N 2.96Å; I322-H324 VanDerWaalsContact O-N 3.08Å; I322-I325 HydrophobicContact CB-CD1 3.74Å; I322-I325 HydrophobicContact CB-CG1 4.28Å; I322-I325 HydrophobicContact CD1-CD1 3.45Å; I322-I325 VanDerWaalsContact CD1-CD1 3.45Å; I322-I325 HydrophobicContact CG1-CD1 4.17Å; I322-I325 HydrophobicContact CG2-CB 4.44Å; I322-I325 HydrophobicContact CG2-CD1 3.4Å; I322-I325 VanDerWaalsContact CG2-CD1 3.4Å; I322-I325 HydrophobicContact CG2-CG1 3.42Å; I322-I325 VanDerWaalsContact CG2-CG1 3.42Å
323H46Very low60.8Low100 Ų10055.3 Ų55.346%0.46330%0.299SS..THydrogen-bonded Turntrans-62.4-22.2-165.8-11051.2000116N317N317-H323 VanDerWaalsContact OD1-CA 3.3Å; N317-H323 WeakPolarHBondContact OD1-CA 3.31Å
324H51.3Low61.7Low97 Ų9757 Ų5745%0.44931%0.305SS..THydrogen-bonded Turntrans-155.366.7179-64.8-66.3000110.8K133 I322K133-H324 PolarHBondContact NZ-O 3.11Å; I322-H324 PolarHBondContact O-N 2.96Å; I322-H324 VanDerWaalsContact O-N 3.08Å
325I49.9Very low62.9Low20 Ų2052.2 Ų52.210%0.10328%0.276CS..  trans-64.4142.3148.5-76.3150.8000106.4L181 I322 V327 S330L181-I325 HydrophobicContact CD1-CB 4.29Å; L181-I325 HydrophobicContact CD1-CD1 3.56Å; L181-I325 HydrophobicContact CD1-CG1 3.74Å; L181-I325 HydrophobicContact CD1-CG2 3.49Å; L181-I325 VanDerWaalsContact CD1-CG2 3.49Å; I322-I325 HydrophobicContact CB-CD1 3.74Å; I322-I325 HydrophobicContact CB-CG1 4.28Å; I322-I325 HydrophobicContact CD1-CD1 3.45Å; I322-I325 VanDerWaalsContact CD1-CD1 3.45Å; I322-I325 HydrophobicContact CG1-CD1 4.17Å; I322-I325 HydrophobicContact CG2-CB 4.44Å; I322-I325 HydrophobicContact CG2-CD1 3.4Å; I322-I325 VanDerWaalsContact CG2-CD1 3.4Å; I322-I325 HydrophobicContact CG2-CG1 3.42Å; I322-I325 VanDerWaalsContact CG2-CG1 3.42Å; I325-V327 VanDerWaalsContact C-N 3.32Å; I325-V327 PolarHBondContact O-N 3.31Å; I325-S330 VanDerWaalsContact CG2-OG 3.28Å; I325-S330 WeakPolarHBondContact CG2-OG 3.42Å
326S60.1Low64.2Low36 Ų3648.7 Ų48.725%0.25225%0.252SS..  trans-57.7102.6168.3-179.70000107.3G128 M328 H329 S330G128-S326 VanDerWaalsContact O-CB 3.29Å; G128-S326 WeakPolarHBondContact O-CB 3.41Å; S326-M328 PolarHBondContact O-N 2.91Å; S326-H329 WeakPolarHBondContact O-CA 3.4Å; S326-H329 VanDerWaalsContact O-CB 3.3Å; S326-H329 WeakPolarHBondContact O-CB 2.96Å; S326-H329 PolarHBondContact O-N 3.3Å; S326-S330 PolarHBondContact O-N 2.99Å
327V59.3Low65.7Low50 Ų5049.3 Ų49.330%0.30325%0.254SS..Hα-helixtrans-50.2-34.7-179.9173.50000110.1P313 I325 H329 S330 I331P313-V327 HydrophobicContact CB-CG2 4.45Å; P313-V327 HydrophobicContact CG-CG1 4.06Å; P313-V327 HydrophobicContact CG-CG2 3.79Å; I325-V327 VanDerWaalsContact C-N 3.32Å; I325-V327 PolarHBondContact O-N 3.31Å; V327-H329 PolarHBondContact O-N 3.18Å; V327-S330 PolarHBondContact O-N 3.49Å; V327-I331 HydrophobicContact CG1-CD1 3.94Å; V327-I331 WeakPolarHBondContact O-CD1 3.49Å; V327-I331 VanDerWaalsContact O-CG1 3.27Å; V327-I331 WeakPolarHBondContact O-CG1 3.4Å; V327-I331 PolarHBondContact O-N 3.45Å; V327-I331 VanDerWaalsContact O-N 3.14Å
328M63.6Low67.4Low42 Ų4248.3 Ų48.321%0.20725%0.248CC..Hα-helixtrans-57.1-44.9172.2-164.2177.686.600112.2L65 S326 I331 F332L65-M328 HydrophobicContact CD1-SD 4.35Å; L65-M328 HydrophobicContact CD2-CE 3.35Å; L65-M328 HydrophobicContact CD2-SD 3.9Å; L65-M328 HydrophobicContact CG-CE 3.79Å; L65-M328 HydrophobicContact CG-SD 4Å; S326-M328 PolarHBondContact O-N 2.91Å; M328-I331 WeakPolarHBondContact O-CB 3.18Å; M328-I331 PolarHBondContact O-N 3.08Å; M328-F332 HydrophobicContact CG-CD2 4.22Å; M328-F332 HydrophobicContact CG-CE2 3.92Å; M328-F332 WeakPolarHBondContact O-CD2 3.16Å; M328-F332 PolarHBondContact O-N 2.88Å
329H70.9Confident69.3Low5 Ų537.5 Ų37.52%0.02321%0.208CC..Hα-helixtrans-69.3-37.7-178.7-161.377.6000113.3I125 A129 A177 L181 S326 V327 I331 F332 S333I125-H329 PolarHBondContact O-CE1 2.86Å; I125-H329 PolarHBondContact O-ND1 3.46Å; A129-H329 HydrophobicContact CB-CB 4.29Å; A177-H329 WeakPolarHBondContact CA-NE2 3.32Å; A177-H329 PolarHBondContact O-CD2 3.06Å; A177-H329 PolarHBondContact O-NE2 3.38Å; L181-H329 PolarHBondContact N-NE2 3.43Å; S326-H329 WeakPolarHBondContact O-CA 3.4Å; S326-H329 VanDerWaalsContact O-CB 3.3Å; S326-H329 WeakPolarHBondContact O-CB 2.96Å; S326-H329 PolarHBondContact O-N 3.3Å; V327-H329 PolarHBondContact O-N 3.18Å; H329-I331 VanDerWaalsContact C-N 3.26Å; H329-I331 PolarHBondContact O-N 3.46Å; H329-F332 PolarHBondContact O-N 2.92Å; H329-S333 PolarHBondContact O-N 2.92Å; H329-S333 PolarHBondContact O-OG 2.93Å; H329-S333 VanDerWaalsContact O-OG 3.05Å
330S69.6Low71.2Confident14 Ų1432 Ų3210%0.09817%0.174CC..Hα-helixtrans-63.7-34.1171.4-61.80000112.2I325 S326 V327 S333 L334I325-S330 VanDerWaalsContact CG2-OG 3.28Å; I325-S330 WeakPolarHBondContact CG2-OG 3.42Å; S326-S330 PolarHBondContact O-N 2.99Å; V327-S330 PolarHBondContact O-N 3.49Å; S330-S333 WeakPolarHBondContact O-CB 3.5Å; S330-S333 PolarHBondContact O-N 3.08Å; S330-L334 PolarHBondContact O-N 2.93Å
331I78.4Confident73.3Confident1 Ų131.9 Ų31.91%0.00517%0.173CC..Hα-helixtrans-69.7-42175.2-69.4164.2000110.7S272 S305 A309 L312 V327 M328 H329 S333 L334 L335S272-I331 WeakPolarHBondContact OG-CD1 3.32Å; S305-I331 WeakPolarHBondContact OG-CG2 3.43Å; A309-I331 HydrophobicContact CB-CD1 3.85Å; L312-I331 HydrophobicContact CD1-CG1 3.86Å; V327-I331 HydrophobicContact CG1-CD1 3.94Å; V327-I331 WeakPolarHBondContact O-CD1 3.49Å; V327-I331 VanDerWaalsContact O-CG1 3.27Å; V327-I331 WeakPolarHBondContact O-CG1 3.4Å; V327-I331 PolarHBondContact O-N 3.45Å; V327-I331 VanDerWaalsContact O-N 3.14Å; M328-I331 WeakPolarHBondContact O-CB 3.18Å; M328-I331 PolarHBondContact O-N 3.08Å; H329-I331 VanDerWaalsContact C-N 3.26Å; H329-I331 PolarHBondContact O-N 3.46Å; I331-S333 PolarHBondContact O-N 3.02Å; I331-L334 PolarHBondContact O-N 3.03Å; I331-L334 VanDerWaalsContact O-N 3.16Å; I331-L335 HydrophobicContact CG2-CD1 3.73Å; I331-L335 HydrophobicContact CG2-CG 4.18Å; I331-L335 VanDerWaalsContact O-CG 3.22Å; I331-L335 WeakPolarHBondContact O-CG 3.36Å; I331-L335 PolarHBondContact O-N 3.25Å
332F79.6Confident75.5Confident10 Ų1031.9 Ų31.94%0.04417%0.167CC..Hα-helixtrans-57.6-36.3172.4-87.7-120.9000112I125 W220 V279 M328 H329 L335 G336I125-F332 HydrophobicContact CG2-CD1 4.4Å; W220-F332 HydrophobicContact CH2-CE1 4.03Å; W220-F332 HydrophobicContact CH2-CZ 4.24Å; V279-F332 HydrophobicContact CG2-CD1 3.97Å; V279-F332 HydrophobicContact CG2-CE1 3.83Å; V279-F332 HydrophobicContact CG2-CZ 4.3Å; M328-F332 HydrophobicContact CG-CD2 4.22Å; M328-F332 HydrophobicContact CG-CE2 3.92Å; M328-F332 WeakPolarHBondContact O-CD2 3.16Å; M328-F332 PolarHBondContact O-N 2.88Å; H329-F332 PolarHBondContact O-N 2.92Å; F332-L335 PolarHBondContact O-N 3.22Å; F332-G336 PolarHBondContact O-N 3.43Å
333S82.6Confident77.4Confident5 Ų532.1 Ų32.14%0.03517%0.167CC..Hα-helixtrans-61.8-48.4174.9-50.90000111.9A177 H329 S330 I331 L335 G336 L337A177-S333 VanDerWaalsContact CB-OG 3.26Å; A177-S333 WeakPolarHBondContact CB-OG 3.5Å; H329-S333 PolarHBondContact O-N 2.92Å; H329-S333 PolarHBondContact O-OG 2.93Å; H329-S333 VanDerWaalsContact O-OG 3.05Å; S330-S333 WeakPolarHBondContact O-CB 3.5Å; S330-S333 PolarHBondContact O-N 3.08Å; I331-S333 PolarHBondContact O-N 3.02Å; S333-L335 VanDerWaalsContact C-N 3.34Å; S333-L335 PolarHBondContact O-N 2.7Å; S333-G336 PolarHBondContact O-N 3.39Å; S333-L337 PolarHBondContact O-N 3.04Å; S333-L337 VanDerWaalsContact O-N 3.09Å
334L87.9Confident79.5Confident75 Ų7528.6 Ų28.639%0.39315%0.151SC..Hα-helixtrans-64-39.8178.8-69.7173.1000112.1I304 L312 S330 I331 L337 L338I304-L334 HydrophobicContact CG2-CB 4.48Å; L312-L334 HydrophobicContact CD1-CD1 4Å; S330-L334 PolarHBondContact O-N 2.93Å; I331-L334 PolarHBondContact O-N 3.03Å; I331-L334 VanDerWaalsContact O-N 3.16Å; L334-L337 PolarHBondContact O-N 2.97Å; L334-L338 WeakPolarHBondContact O-CB 3.35Å; L334-L338 PolarHBondContact O-N 3.37Å
335L91.5Very high81.4Confident0 Ų028.3 Ų28.30%016%0.156CC..Hα-helixtrans-70.2-38.4178.9-66171.5000112.2A276 V279 A301 I331 F332 S333 L338 G339A276-L335 HydrophobicContact CB-CD1 3.66Å; A276-L335 HydrophobicContact CB-CD2 3.97Å; A276-L335 HydrophobicContact CB-CG 4.48Å; V279-L335 HydrophobicContact CB-CB 4.02Å; V279-L335 HydrophobicContact CB-CD1 4.42Å; V279-L335 HydrophobicContact CG1-CB 3.73Å; A301-L335 HydrophobicContact CB-CD2 3.75Å; I331-L335 HydrophobicContact CG2-CD1 3.73Å; I331-L335 HydrophobicContact CG2-CG 4.18Å; I331-L335 VanDerWaalsContact O-CG 3.22Å; I331-L335 WeakPolarHBondContact O-CG 3.36Å; I331-L335 PolarHBondContact O-N 3.25Å; F332-L335 PolarHBondContact O-N 3.22Å; S333-L335 VanDerWaalsContact C-N 3.34Å; S333-L335 PolarHBondContact O-N 2.7Å; L335-L338 WeakPolarHBondContact O-CB 3.44Å; L335-L338 PolarHBondContact O-N 3.32Å; L335-G339 PolarHBondContact O-N 3.12Å
336G89.6Confident83.4Confident1 Ų128.3 Ų28.31%0.0116%0.156CC..Hα-helixtrans-59.5-47.7172.500000111.4V174 F332 S333 L338 G339 E340V174-G336 VanDerWaalsContact CG2-C 3.41Å; F332-G336 PolarHBondContact O-N 3.43Å; S333-G336 PolarHBondContact O-N 3.39Å; G336-L338 VanDerWaalsContact C-N 3.34Å; G336-L338 PolarHBondContact O-N 3.4Å; G336-G339 PolarHBondContact O-N 3.28Å; G336-G339 VanDerWaalsContact O-N 3.13Å; G336-E340 WeakPolarHBondContact O-CG 3.38Å; G336-E340 PolarHBondContact O-N 2.9Å; G336-E340 VanDerWaalsContact O-N 3.09Å
337L91.8Very high84.7Confident38 Ų3827.9 Ų27.920%0.19915%0.151CC..Hα-helixtrans-60.6-41.6175-75.2-178.3000112.7V174 Y178 S333 L334 G339 E340 I341 I374V174-L337 HydrophobicContact CG1-CD2 4.23Å; V174-L337 HydrophobicContact CG2-CD2 4.33Å; Y178-L337 HydrophobicContact CE2-CD1 4.33Å; Y178-L337 HydrophobicContact CE2-CD2 4.34Å; Y178-L337 HydrophobicContact CE2-CG 4.21Å; Y178-L337 WeakPolarHBondContact OH-CD1 3.5Å; S333-L337 PolarHBondContact O-N 3.04Å; S333-L337 VanDerWaalsContact O-N 3.09Å; L334-L337 PolarHBondContact O-N 2.97Å; L337-G339 PolarHBondContact O-N 3.38Å; L337-E340 PolarHBondContact O-N 3.16Å; L337-I341 VanDerWaalsContact O-CG1 3.29Å; L337-I341 WeakPolarHBondContact O-CG1 3.22Å; L337-I341 PolarHBondContact O-N 3.11Å; L337-I374 HydrophobicContact CD2-CD1 4.24Å
338L93.9Very high86.1Confident32 Ų3227.7 Ų27.717%0.16815%0.15CC..Hα-helixtrans-57.7-40.3175.518065.8000111.2A280 L297 V300 A301 I304 L334 L335 G336 T342A280-L338 HydrophobicContact CB-CD2 4.03Å; L297-L338 HydrophobicContact CD1-CD1 4.42Å; L297-L338 HydrophobicContact CD1-CD2 4.15Å; L297-L338 HydrophobicContact CD1-CG 4.1Å; V300-L338 HydrophobicContact CG1-CD2 4.33Å; A301-L338 HydrophobicContact CB-CD2 4.15Å; I304-L338 HydrophobicContact CD1-CD1 4.45Å; I304-L338 HydrophobicContact CD1-CD2 3.85Å; L334-L338 WeakPolarHBondContact O-CB 3.35Å; L334-L338 PolarHBondContact O-N 3.37Å; L335-L338 WeakPolarHBondContact O-CB 3.44Å; L335-L338 PolarHBondContact O-N 3.32Å; G336-L338 VanDerWaalsContact C-N 3.34Å; G336-L338 PolarHBondContact O-N 3.4Å; L338-T342 WeakPolarHBondContact O-CB 3.28Å; L338-T342 PolarHBondContact O-N 3.35Å; L338-T342 PolarHBondContact O-OG1 3.13Å
339G91.9Very high87.1Confident0 Ų030.7 Ų30.70%017%0.166CC..Hα-helixtrans-64.8-44.7176.300000113.4A280 T283 L335 G336 L337 T342 Y343A280-G339 WeakPolarHBondContact O-CA 3.19Å; T283-G339 PolarHBondContact OG1-O 3.03Å; L335-G339 PolarHBondContact O-N 3.12Å; G336-G339 PolarHBondContact O-N 3.28Å; G336-G339 VanDerWaalsContact O-N 3.13Å; L337-G339 PolarHBondContact O-N 3.38Å; G339-T342 WeakPolarHBondContact O-CB 3.32Å; G339-T342 PolarHBondContact O-N 3.16Å; G339-Y343 PolarHBondContact O-N 3.34Å
340E91.3Very high87.8Confident3 Ų335.8 Ų35.81%0.01419%0.19CC..Hα-helixtrans-62.2-43.6176.5-64.5-69.4-178.700112.7H171 V174 T283 G336 L337 T342 Y343 I344 L370H171-E340 VanDerWaalsContact CA-OE1 3.32Å; H171-E340 WeakPolarHBondContact CA-OE1 3.48Å; H171-E340 IonicContact CE1-OE1 3.12Å; H171-E340 IonicContact CE1-OE2 3.9Å; H171-E340 PolarHBondContact CE1-OE2 3.32Å; H171-E340 IonicContact CG-OE1 3.54Å; H171-E340 IonicContact ND1-OE1 2.64Å; H171-E340 PolarHBondContact ND1-OE1 3.17Å; H171-E340 IonicContact ND1-OE2 3.05Å; H171-E340 PolarHBondContact ND1-OE2 3.41Å; V174-E340 HydrophobicContact CG2-CG 3.82Å; T283-E340 HydrophobicContact CG2-CG 4.46Å; T283-E340 WeakPolarHBondContact CG2-OE1 3.33Å; T283-E340 PolarHBondContact OG1-N 2.82Å; G336-E340 WeakPolarHBondContact O-CG 3.38Å; G336-E340 PolarHBondContact O-N 2.9Å; G336-E340 VanDerWaalsContact O-N 3.09Å; L337-E340 PolarHBondContact O-N 3.16Å; E340-T342 VanDerWaalsContact C-N 3.3Å; E340-T342 PolarHBondContact O-N 3.31Å; E340-Y343 WeakPolarHBondContact O-CB 3.31Å; E340-Y343 PolarHBondContact O-N 3.08Å; E340-I344 WeakPolarHBondContact O-CG1 3.34Å; E340-I344 PolarHBondContact O-N 2.73Å; E340-L370 HydrophobicContact CB-CD1 4.18Å; E340-L370 HydrophobicContact CB-CD2 4.03Å; E340-L370 HydrophobicContact CG-CD1 3.78Å
341I92.2Very high88.4Confident94 Ų9435.5 Ų35.548%0.48219%0.188SC..Hα-helixtrans-61.5-44175.1-66.7165.2000109.8L337 Y343 I344 V345L337-I341 VanDerWaalsContact O-CG1 3.29Å; L337-I341 WeakPolarHBondContact O-CG1 3.22Å; L337-I341 PolarHBondContact O-N 3.11Å; I341-Y343 VanDerWaalsContact C-N 3.31Å; I341-Y343 PolarHBondContact O-N 3.36Å; I341-I344 PolarHBondContact O-N 2.93Å; I341-V345 HydrophobicContact CG2-CG2 4.46Å; I341-V345 WeakPolarHBondContact O-CG2 3.41Å; I341-V345 PolarHBondContact O-N 3.43Å
342T92.7Very high88.6Confident27 Ų2739.4 Ų39.417%0.16621%0.211CC..Hα-helixtrans-62.2-39.7177.4-56.10000111.5L297 L338 G339 E340 V345 L346L297-T342 HydrophobicContact CD1-CG2 4.3Å; L297-T342 WeakPolarHBondContact CD1-OG1 3.35Å; L297-T342 HydrophobicContact CD2-CG2 3.88Å; L338-T342 WeakPolarHBondContact O-CB 3.28Å; L338-T342 PolarHBondContact O-N 3.35Å; L338-T342 PolarHBondContact O-OG1 3.13Å; G339-T342 WeakPolarHBondContact O-CB 3.32Å; G339-T342 PolarHBondContact O-N 3.16Å; E340-T342 VanDerWaalsContact C-N 3.3Å; E340-T342 PolarHBondContact O-N 3.31Å; T342-V345 PolarHBondContact O-N 3.47Å; T342-L346 HydrophobicContact CG2-CD1 3.95Å; T342-L346 HydrophobicContact CG2-CG 4.39Å; T342-L346 WeakPolarHBondContact O-CB 3.5Å; T342-L346 VanDerWaalsContact O-CG 3.31Å; T342-L346 WeakPolarHBondContact O-CG 3.14Å; T342-L346 PolarHBondContact O-N 2.93Å
343Y91.6Very high88.6Confident25 Ų2549.5 Ų49.510%0.09825%0.249CC..Hα-helixtrans-59.9-49174.6176.2-94.5000111.5T283 H286 L287 G339 E340 I341 V345 L346 L347T283-Y343 WeakPolarHBondContact O-CD2 3.48Å; H286-Y343 AromaticContact CE1-CE2 3.99Å; L287-Y343 HydrophobicContact CD1-CD2 3.54Å; L287-Y343 HydrophobicContact CD1-CE2 3.31Å; L287-Y343 HydrophobicContact CG-CD2 4.45Å; L287-Y343 HydrophobicContact CG-CE2 4.22Å; G339-Y343 PolarHBondContact O-N 3.34Å; E340-Y343 WeakPolarHBondContact O-CB 3.31Å; E340-Y343 PolarHBondContact O-N 3.08Å; I341-Y343 VanDerWaalsContact C-N 3.31Å; I341-Y343 PolarHBondContact O-N 3.36Å; Y343-V345 VanDerWaalsContact C-N 3.34Å; Y343-V345 PolarHBondContact O-N 3.31Å; Y343-L346 PolarHBondContact O-N 3.27Å; Y343-L347 HydrophobicContact CE1-CD2 4.4Å; Y343-L347 VanDerWaalsContact O-CB 3.32Å; Y343-L347 WeakPolarHBondContact O-CB 3.35Å; Y343-L347 PolarHBondContact O-N 3.03Å
344I90.6Very high88.6Confident26 Ų2653.9 Ų53.913%0.13327%0.272CS..Hα-helixtrans-60.6-44178.2-66.9163.3000110.8E340 I341 L347 V348 V363 I367E340-I344 WeakPolarHBondContact O-CG1 3.34Å; E340-I344 PolarHBondContact O-N 2.73Å; I341-I344 PolarHBondContact O-N 2.93Å; I344-L347 WeakPolarHBondContact O-CB 3.45Å; I344-L347 PolarHBondContact O-N 3.42Å; I344-V348 WeakPolarHBondContact O-CG2 3.22Å; I344-V348 PolarHBondContact O-N 3.14Å; I344-V363 HydrophobicContact CG2-CG1 4.24Å; I344-V363 HydrophobicContact CG2-CG2 4.48Å; I344-I367 HydrophobicContact CD1-CG1 3.91Å
345V91.3Very high88Confident91 Ų9153.6 Ų53.655%0.55229%0.288SS*.Hα-helixtrans-62.2-45178.1171.10000111.5I341 T342 Y343 V348 L349I341-V345 HydrophobicContact CG2-CG2 4.46Å; I341-V345 WeakPolarHBondContact O-CG2 3.41Å; I341-V345 PolarHBondContact O-N 3.43Å; T342-V345 PolarHBondContact O-N 3.47Å; Y343-V345 VanDerWaalsContact C-N 3.34Å; Y343-V345 PolarHBondContact O-N 3.31Å; V345-V348 PolarHBondContact O-N 2.69Å; V345-L349 PolarHBondContact O-N 2.73Å
346L90.2Very high87.1Confident19 Ų1956.9 Ų56.910%0.09931%0.305CS..Hα-helixtrans-67.7-36.5178.2-71.7170.4000112.2L287 I288 T342 Y343 L349 H350L287-L346 HydrophobicContact CB-CB 4.3Å; L287-L346 HydrophobicContact CB-CD1 4.27Å; I288-L346 HydrophobicContact CG1-CD1 3.52Å; T342-L346 HydrophobicContact CG2-CD1 3.95Å; T342-L346 HydrophobicContact CG2-CG 4.39Å; T342-L346 WeakPolarHBondContact O-CB 3.5Å; T342-L346 VanDerWaalsContact O-CG 3.31Å; T342-L346 WeakPolarHBondContact O-CG 3.14Å; T342-L346 PolarHBondContact O-N 2.93Å; Y343-L346 PolarHBondContact O-N 3.27Å; L346-L349 PolarHBondContact O-N 3.47Å; L346-H350 WeakPolarHBondContact O-CB 3.44Å; L346-H350 PolarHBondContact O-N 3.22Å
347L88.2Confident86.2Confident27 Ų2760.6 Ų60.614%0.14134%0.343CS..Hα-helixtrans-60.3-48.3173.3-176.170.8000110.6Y343 I344 L349 H350 T351 Q362 S366Y343-L347 HydrophobicContact CE1-CD2 4.4Å; Y343-L347 VanDerWaalsContact O-CB 3.32Å; Y343-L347 WeakPolarHBondContact O-CB 3.35Å; Y343-L347 PolarHBondContact O-N 3.03Å; I344-L347 WeakPolarHBondContact O-CB 3.45Å; I344-L347 PolarHBondContact O-N 3.42Å; L347-L349 PolarHBondContact O-N 3.27Å; L347-H350 PolarHBondContact O-N 3.07Å; L347-T351 HydrophobicContact CD1-CG2 4.47Å; L347-T351 WeakPolarHBondContact O-CB 3.06Å; L347-T351 WeakPolarHBondContact O-CG2 3.48Å; L347-T351 PolarHBondContact O-N 3.04Å; L347-T351 PolarHBondContact O-OG1 2.92Å; L347-Q362 HydrophobicContact CD2-CB 4.26Å; L347-S366 VanDerWaalsContact CD2-OG 3.3Å; L347-S366 WeakPolarHBondContact CD2-OG 3.44Å
348V87.9Confident85.5Confident47 Ų4763.5 Ų63.529%0.28536%0.357SS..Hα-helixtrans-58.6-47.8175.4172.10000110.9I344 V345 H350 T351 V352 I359 V363I344-V348 WeakPolarHBondContact O-CG2 3.22Å; I344-V348 PolarHBondContact O-N 3.14Å; V345-V348 PolarHBondContact O-N 2.69Å; V348-H350 VanDerWaalsContact C-N 3.35Å; V348-H350 PolarHBondContact O-N 3.3Å; V348-T351 WeakPolarHBondContact CA-OG1 3.32Å; V348-T351 PolarHBondContact O-N 3.44Å; V348-T351 PolarHBondContact O-OG1 3.33Å; V348-V352 HydrophobicContact CG1-CG2 4.22Å; V348-V352 VanDerWaalsContact O-CG2 3.24Å; V348-V352 WeakPolarHBondContact O-CG2 3.24Å; V348-V352 PolarHBondContact O-N 2.86Å; V348-I359 HydrophobicContact CG1-CG2 4.07Å; V348-I359 HydrophobicContact CG2-CG2 4.19Å; V348-V363 HydrophobicContact CG2-CG2 3.23Å
349L86.4Confident84.9Confident105 Ų10564.3 Ų64.355%0.5536%0.361SS..Hα-helixtrans-60.7-44.6-179-172.968.1000112.1V345 L346 L347 T351 W353V345-L349 PolarHBondContact O-N 2.73Å; L346-L349 PolarHBondContact O-N 3.47Å; L347-L349 PolarHBondContact O-N 3.27Å; L349-T351 VanDerWaalsContact C-N 3.34Å; L349-T351 PolarHBondContact O-N 3.05Å; L349-W353 WeakPolarHBondContact O-CB 3.05Å; L349-W353 PolarHBondContact O-N 2.99Å
350H83.8Confident84.4Confident112 Ų11267 Ų6752%0.51939%0.389SS..Hα-helixtrans-65.9-37.1179.3-173.9-92.9000112.3L346 L347 V348 N354L346-H350 WeakPolarHBondContact O-CB 3.44Å; L346-H350 PolarHBondContact O-N 3.22Å; L347-H350 PolarHBondContact O-N 3.07Å; V348-H350 VanDerWaalsContact C-N 3.35Å; V348-H350 PolarHBondContact O-N 3.3Å; H350-N354 PolarHBondContact CE1-ND2 3.3Å; H350-N354 PolarHBondContact O-N 3.41Å; H350-N354 VanDerWaalsContact O-N 3.13Å
351T82.1Confident84Confident8 Ų872 Ų725%0.04941%0.411CS..Hα-helixtrans-73.8-38.4-179.256.10000112.4L347 V348 L349 N354 G355 N356L347-T351 HydrophobicContact CD1-CG2 4.47Å; L347-T351 WeakPolarHBondContact O-CB 3.06Å; L347-T351 WeakPolarHBondContact O-CG2 3.48Å; L347-T351 PolarHBondContact O-N 3.04Å; L347-T351 PolarHBondContact O-OG1 2.92Å; V348-T351 WeakPolarHBondContact CA-OG1 3.32Å; V348-T351 PolarHBondContact O-N 3.44Å; V348-T351 PolarHBondContact O-OG1 3.33Å; L349-T351 VanDerWaalsContact C-N 3.34Å; L349-T351 PolarHBondContact O-N 3.05Å; T351-N354 PolarHBondContact O-N 3.09Å; T351-G355 PolarHBondContact O-N 3.03Å; T351-N356 PolarHBondContact O-N 3.26Å; T351-N356 VanDerWaalsContact O-N 3.16Å
352V83Confident83.5Confident83 Ų8370.3 Ų70.350%0.50340%0.401SS..Hα-helixtrans-60.9-47.5170.4172.20000110.6V348 N354 G355 I359V348-V352 HydrophobicContact CG1-CG2 4.22Å; V348-V352 VanDerWaalsContact O-CG2 3.24Å; V348-V352 WeakPolarHBondContact O-CG2 3.24Å; V348-V352 PolarHBondContact O-N 2.86Å; V352-N354 VanDerWaalsContact C-N 3.26Å; V352-N354 PolarHBondContact O-N 2.9Å; V352-G355 PolarHBondContact O-N 3.46Å; V352-I359 HydrophobicContact CB-CD1 4.44Å; V352-I359 HydrophobicContact CG2-CD1 3.47Å; V352-I359 VanDerWaalsContact CG2-CD1 3.47Å; V352-I359 HydrophobicContact CG2-CG1 4.42Å
353W80.8Confident83.2Confident221 Ų22170.5 Ų70.584%0.83740%0.402SS*.Hα-helixtrans-60.6-36.7-179.4-172.9-94000112.7L349 G355L349-W353 WeakPolarHBondContact O-CB 3.05Å; L349-W353 PolarHBondContact O-N 2.99Å; W353-G355 PolarHBondContact O-N 3.29Å
354N81.2Confident83Confident98 Ų9874.9 Ų74.952%0.52443%0.426SS..THydrogen-bonded Turntrans-82.23.8178.7-68.6-5.7000113.7H350 T351 V352 N356H350-N354 PolarHBondContact CE1-ND2 3.3Å; H350-N354 PolarHBondContact O-N 3.41Å; H350-N354 VanDerWaalsContact O-N 3.13Å; T351-N354 PolarHBondContact O-N 3.09Å; V352-N354 VanDerWaalsContact C-N 3.26Å; V352-N354 PolarHBondContact O-N 2.9Å; N354-N356 PolarHBondContact O-N 2.83Å
355G75.4Confident82.8Confident69 Ų6976.1 Ų76.171%0.71143%0.433SS*.THydrogen-bonded Turntrans65.822.3178.500000114.4T351 V352 W353T351-G355 PolarHBondContact O-N 3.03Å; V352-G355 PolarHBondContact O-N 3.46Å; W353-G355 PolarHBondContact O-N 3.29Å
356N74Confident82.6Confident69 Ų6972.2 Ų72.237%0.36941%0.41SS..  trans-85.4124.7-176.2-165.716.4000111T351 N354 M358 I359T351-N356 PolarHBondContact O-N 3.26Å; T351-N356 VanDerWaalsContact O-N 3.16Å; N354-N356 PolarHBondContact O-N 2.83Å; N356-M358 VanDerWaalsContact C-N 3.26Å; N356-M358 PolarHBondContact O-N 2.96Å; N356-I359 WeakPolarHBondContact O-CG1 3.37Å
357G69.3Low82.6Confident79 Ų7975 Ų7581%0.81442%0.424SS*.THydrogen-bonded Turntrans-74.2-5.8-176.800000115.7I359G357-I359 VanDerWaalsContact C-N 3.33Å; G357-I359 PolarHBondContact O-N 2.96Å
358M77.8Confident82.7Confident99 Ų9975.2 Ų75.249%0.48843%0.432SS..THydrogen-bonded Turntrans-89.119.9-174.9-76.6177.463.300115.1N356 G360 F361 Q362N356-M358 VanDerWaalsContact C-N 3.26Å; N356-M358 PolarHBondContact O-N 2.96Å; M358-G360 VanDerWaalsContact C-N 3.34Å; M358-G360 PolarHBondContact O-N 3.26Å; M358-F361 HydrophobicContact CE-CD1 3.6Å; M358-F361 HydrophobicContact CE-CE1 4.12Å; M358-F361 HydrophobicContact CE-CG 4.38Å; M358-F361 PolarHBondContact O-N 3.39Å; M358-F361 VanDerWaalsContact O-N 3.16Å; M358-Q362 PolarHBondContact O-N 3.35Å; M358-Q362 VanDerWaalsContact O-N 3.12Å
359I81.7Confident82.7Confident49 Ų4973.3 Ų73.325%0.25142%0.42SS..Hα-helixtrans-53.8-49.8-176-55.3165.5000111.2V348 V352 N356 G357 F361 Q362 V363V348-I359 HydrophobicContact CG1-CG2 4.07Å; V348-I359 HydrophobicContact CG2-CG2 4.19Å; V352-I359 HydrophobicContact CB-CD1 4.44Å; V352-I359 HydrophobicContact CG2-CD1 3.47Å; V352-I359 VanDerWaalsContact CG2-CD1 3.47Å; V352-I359 HydrophobicContact CG2-CG1 4.42Å; N356-I359 WeakPolarHBondContact O-CG1 3.37Å; G357-I359 VanDerWaalsContact C-N 3.33Å; G357-I359 PolarHBondContact O-N 2.96Å; I359-F361 VanDerWaalsContact C-N 3.29Å; I359-F361 PolarHBondContact O-N 3.46Å; I359-Q362 PolarHBondContact O-N 3.38Å; I359-V363 HydrophobicContact CG2-CG2 4.35Å; I359-V363 WeakPolarHBondContact O-CG2 3.44Å; I359-V363 PolarHBondContact O-N 2.93Å
360G80.4Confident83Confident56 Ų5669.3 Ų69.358%0.57740%0.399SS*.Hα-helixtrans-60.1-39.1-177.600000112.8M358 L364M358-G360 VanDerWaalsContact C-N 3.34Å; M358-G360 PolarHBondContact O-N 3.26Å; G360-L364 WeakPolarHBondContact O-CB 3.36Å; G360-L364 PolarHBondContact O-N 2.95Å
361F82.8Confident83.4Confident108 Ų10866.8 Ų66.847%0.47439%0.394SS..Hα-helixtrans-67.1-46.8177.9-177-108.2000111.5M358 I359 V363 L364 L365M358-F361 HydrophobicContact CE-CD1 3.6Å; M358-F361 HydrophobicContact CE-CE1 4.12Å; M358-F361 HydrophobicContact CE-CG 4.38Å; M358-F361 PolarHBondContact O-N 3.39Å; M358-F361 VanDerWaalsContact O-N 3.16Å; I359-F361 VanDerWaalsContact C-N 3.29Å; I359-F361 PolarHBondContact O-N 3.46Å; F361-V363 PolarHBondContact O-N 3.36Å; F361-L364 WeakPolarHBondContact O-CB 3.34Å; F361-L364 PolarHBondContact O-N 2.94Å; F361-L365 HydrophobicContact CD1-CD1 4.05Å; F361-L365 HydrophobicContact CD1-CG 4.36Å; F361-L365 HydrophobicContact CE1-CD1 3.53Å; F361-L365 HydrophobicContact CE1-CD2 4.35Å; F361-L365 HydrophobicContact CE1-CG 4.09Å; F361-L365 HydrophobicContact CE2-CD2 4.05Å; F361-L365 HydrophobicContact CE2-CG 4.46Å; F361-L365 HydrophobicContact CZ-CD1 3.88Å; F361-L365 HydrophobicContact CZ-CD2 3.88Å; F361-L365 HydrophobicContact CZ-CG 4.13Å; F361-L365 WeakPolarHBondContact O-CG 3.47Å; F361-L365 PolarHBondContact O-N 3.23Å
362Q81.9Confident83.9Confident58 Ų5868.5 Ų68.527%0.27140%0.403SS..Hα-helixtrans-65.3-36.8-179.4-72.5178.2-39.500113.3L347 M358 I359 S366L347-Q362 HydrophobicContact CD2-CB 4.26Å; M358-Q362 PolarHBondContact O-N 3.35Å; M358-Q362 VanDerWaalsContact O-N 3.12Å; I359-Q362 PolarHBondContact O-N 3.38Å; Q362-S366 PolarHBondContact O-N 3.43Å; Q362-S366 PolarHBondContact O-OG 2.99Å
363V86.7Confident84.3Confident32 Ų3264.5 Ų64.519%0.19438%0.379CS..Hα-helixtrans-64.3-45.4172.6172.80000110.6I344 V348 I359 F361 L365 S366 I367I344-V363 HydrophobicContact CG2-CG1 4.24Å; I344-V363 HydrophobicContact CG2-CG2 4.48Å; V348-V363 HydrophobicContact CG2-CG2 3.23Å; I359-V363 HydrophobicContact CG2-CG2 4.35Å; I359-V363 WeakPolarHBondContact O-CG2 3.44Å; I359-V363 PolarHBondContact O-N 2.93Å; F361-V363 PolarHBondContact O-N 3.36Å; V363-L365 VanDerWaalsContact C-N 3.33Å; V363-L365 PolarHBondContact O-N 2.91Å; V363-S366 PolarHBondContact O-N 3.4Å; V363-I367 HydrophobicContact CG1-CD1 3.62Å; V363-I367 HydrophobicContact CG1-CG1 4.31Å; V363-I367 WeakPolarHBondContact O-CG1 3.16Å; V363-I367 PolarHBondContact O-N 3.47Å
364L87.6Confident85Confident117 Ų11755.9 Ų55.961%0.61335%0.348SS*.Hα-helixtrans-59.8-43.1178.3-173.867.6000111.7G360 F361 G368G360-L364 WeakPolarHBondContact O-CB 3.36Å; G360-L364 PolarHBondContact O-N 2.95Å; F361-L364 WeakPolarHBondContact O-CB 3.34Å; F361-L364 PolarHBondContact O-N 2.94Å; L364-G368 PolarHBondContact O-N 3.34Å
365L86.3Confident85.6Confident51 Ų5155 Ų5527%0.26735%0.347SS..Hα-helixtrans-62.5-46.9175.7-61-174.6000111.5F161 F361 V363 I367 G368 E369F161-L365 HydrophobicContact CD1-CB 4.05Å; F161-L365 HydrophobicContact CD1-CD1 4.31Å; F161-L365 HydrophobicContact CD1-CD2 3.69Å; F161-L365 HydrophobicContact CD1-CG 4.19Å; F161-L365 HydrophobicContact CE1-CB 4Å; F161-L365 HydrophobicContact CE1-CD2 3.56Å; F161-L365 HydrophobicContact CE1-CG 4.27Å; F361-L365 HydrophobicContact CD1-CD1 4.05Å; F361-L365 HydrophobicContact CD1-CG 4.36Å; F361-L365 HydrophobicContact CE1-CD1 3.53Å; F361-L365 HydrophobicContact CE1-CD2 4.35Å; F361-L365 HydrophobicContact CE1-CG 4.09Å; F361-L365 HydrophobicContact CE2-CD2 4.05Å; F361-L365 HydrophobicContact CE2-CG 4.46Å; F361-L365 HydrophobicContact CZ-CD1 3.88Å; F361-L365 HydrophobicContact CZ-CD2 3.88Å; F361-L365 HydrophobicContact CZ-CG 4.13Å; F361-L365 WeakPolarHBondContact O-CG 3.47Å; F361-L365 PolarHBondContact O-N 3.23Å; V363-L365 VanDerWaalsContact C-N 3.33Å; V363-L365 PolarHBondContact O-N 2.91Å; L365-I367 PolarHBondContact O-N 3.47Å; L365-G368 CarbonylContact O-C 3.6Å; L365-G368 WeakPolarHBondContact O-CA 3.38Å; L365-G368 PolarHBondContact O-N 2.96Å; L365-G368 VanDerWaalsContact O-N 3.1Å; L365-E369 WeakPolarHBondContact O-CG 3.43Å; L365-E369 PolarHBondContact O-N 2.98Å
366S87.3Confident86.6Confident10 Ų1053.1 Ų53.17%0.0732%0.32CS..Hα-helixtrans-63-41.1-178.7-60.30000112.4L347 Q362 V363 G368 L370L347-S366 VanDerWaalsContact CD2-OG 3.3Å; L347-S366 WeakPolarHBondContact CD2-OG 3.44Å; Q362-S366 PolarHBondContact O-N 3.43Å; Q362-S366 PolarHBondContact O-OG 2.99Å; V363-S366 PolarHBondContact O-N 3.4Å; S366-G368 VanDerWaalsContact C-N 3.34Å; S366-L370 WeakPolarHBondContact O-CB 3.24Å; S366-L370 PolarHBondContact O-N 3.39Å; S366-L370 VanDerWaalsContact O-N 3.11Å
367I89.7Confident87.6Confident78 Ų7849.9 Ų49.940%0.430%0.303SS..Hα-helixtrans-67.6-37.9174.2-66.6172.1000110.6I344 V363 L365 L370 S371I344-I367 HydrophobicContact CD1-CG1 3.91Å; V363-I367 HydrophobicContact CG1-CD1 3.62Å; V363-I367 HydrophobicContact CG1-CG1 4.31Å; V363-I367 WeakPolarHBondContact O-CG1 3.16Å; V363-I367 PolarHBondContact O-N 3.47Å; L365-I367 PolarHBondContact O-N 3.47Å; I367-L370 PolarHBondContact O-N 3.44Å; I367-S371 VanDerWaalsContact O-CB 3.27Å; I367-S371 WeakPolarHBondContact O-CB 3.31Å; I367-S371 PolarHBondContact O-N 2.88Å; I367-S371 PolarHBondContact O-OG 3.37Å
368G90Very high88.8Confident30 Ų3049.5 Ų49.531%0.30928%0.282SS..Hα-helixtrans-61.1-47.1175.700000112.6L364 L365 S366 S371 L372L364-G368 PolarHBondContact O-N 3.34Å; L365-G368 CarbonylContact O-C 3.6Å; L365-G368 WeakPolarHBondContact O-CA 3.38Å; L365-G368 PolarHBondContact O-N 2.96Å; L365-G368 VanDerWaalsContact O-N 3.1Å; S366-G368 VanDerWaalsContact C-N 3.34Å; G368-S371 PolarHBondContact O-N 3.07Å; G368-L372 WeakPolarHBondContact O-CB 3.45Å; G368-L372 PolarHBondContact O-N 3.34Å
369E89.6Confident89.7Confident8 Ų848.8 Ų48.84%0.03728%0.283CS..Hα-helixtrans-61.4-46175.9-69.5179167.700111.8I157 F161 R170 H171 L365 S371 L372 A373I157-E369 HydrophobicContact CD1-CB 4.49Å; I157-E369 HydrophobicContact CG2-CG 4.18Å; F161-E369 HydrophobicContact CD1-CG 4.27Å; F161-E369 HydrophobicContact CD2-CG 3.72Å; F161-E369 HydrophobicContact CE1-CG 4.16Å; F161-E369 HydrophobicContact CE2-CG 3.6Å; F161-E369 HydrophobicContact CG-CG 4.08Å; F161-E369 HydrophobicContact CZ-CG 3.83Å; R170-E369 IonicContact CZ-OE2 2.72Å; R170-E369 IonicContact NH1-OE2 3.23Å; R170-E369 PolarHBondContact NH1-OE2 2.77Å; R170-E369 IonicContact NH2-OE2 3.61Å; H171-E369 WeakPolarHBondContact NE2-CB 3.36Å; H171-E369 IonicContact NE2-OE2 3.02Å; L365-E369 WeakPolarHBondContact O-CG 3.43Å; L365-E369 PolarHBondContact O-N 2.98Å; E369-S371 PolarHBondContact O-N 3.22Å; E369-L372 PolarHBondContact O-N 2.8Å; E369-A373 WeakPolarHBondContact O-CB 3.38Å; E369-A373 PolarHBondContact O-N 3.17Å
370L91Very high90.4Very high20 Ų2047.1 Ų47.111%0.10528%0.275CS..Hα-helixtrans-60.5-45.6175.6177.159.9000111.8V174 E340 S366 I367 L372 A373 I374V174-L370 HydrophobicContact CG1-CD1 4.09Å; V174-L370 HydrophobicContact CG2-CD1 4.47Å; E340-L370 HydrophobicContact CB-CD1 4.18Å; E340-L370 HydrophobicContact CB-CD2 4.03Å; E340-L370 HydrophobicContact CG-CD1 3.78Å; S366-L370 WeakPolarHBondContact O-CB 3.24Å; S366-L370 PolarHBondContact O-N 3.39Å; S366-L370 VanDerWaalsContact O-N 3.11Å; I367-L370 PolarHBondContact O-N 3.44Å; L370-L372 VanDerWaalsContact C-N 3.35Å; L370-L372 PolarHBondContact O-N 3.28Å; L370-A373 PolarHBondContact O-N 2.77Å; L370-I374 HydrophobicContact CD1-CD1 4.06Å; L370-I374 HydrophobicContact CD1-CG1 4.38Å; L370-I374 HydrophobicContact CG-CD1 4.07Å; L370-I374 WeakPolarHBondContact O-CG1 3.19Å; L370-I374 PolarHBondContact O-N 3Å
371S92.3Very high91.2Very high59 Ų5944.4 Ų44.441%0.41325%0.248SC..Hα-helixtrans-63.1-43.3179.9-600000110.9I367 G368 E369 I374 V375I367-S371 VanDerWaalsContact O-CB 3.27Å; I367-S371 WeakPolarHBondContact O-CB 3.31Å; I367-S371 PolarHBondContact O-N 2.88Å; I367-S371 PolarHBondContact O-OG 3.37Å; G368-S371 PolarHBondContact O-N 3.07Å; E369-S371 PolarHBondContact O-N 3.22Å; S371-I374 PolarHBondContact O-N 3.02Å; S371-V375 VanDerWaalsContact O-CG2 3.29Å; S371-V375 WeakPolarHBondContact O-CG2 3.35Å; S371-V375 PolarHBondContact O-N 3.19Å
372L92.6Very high91.8Very high44 Ų4442.8 Ų42.823%0.2324%0.244CC..Hα-helixtrans-61.2-44.4174.8-178.666.5000111.5L153 V156 I157 G368 E369 L370 I374 V375 I376L153-L372 HydrophobicContact CD1-CD2 4.23Å; L153-L372 HydrophobicContact CD1-CG 4.03Å; V156-L372 HydrophobicContact CB-CD2 4.41Å; V156-L372 HydrophobicContact CG1-CD2 3.68Å; I157-L372 HydrophobicContact CG1-CD2 3.92Å; G368-L372 WeakPolarHBondContact O-CB 3.45Å; G368-L372 PolarHBondContact O-N 3.34Å; E369-L372 PolarHBondContact O-N 2.8Å; L370-L372 VanDerWaalsContact C-N 3.35Å; L370-L372 PolarHBondContact O-N 3.28Å; L372-I374 VanDerWaalsContact C-N 3.35Å; L372-I374 PolarHBondContact O-N 2.72Å; L372-V375 PolarHBondContact O-N 2.97Å; L372-I376 HydrophobicContact CD1-CD1 3.9Å; L372-I376 HydrophobicContact CD1-CG1 4.19Å; L372-I376 HydrophobicContact CG-CD1 4.03Å; L372-I376 WeakPolarHBondContact O-CG1 3.38Å; L372-I376 PolarHBondContact O-N 2.81Å
373A92.9Very high92.5Very high0 Ų045.5 Ų45.50%026%0.26CS..Hα-helixtrans-59.2-44.5177.400000112.1L153 H171 E369 L370 A377L153-A373 HydrophobicContact CD1-CB 4.11Å; L153-A373 HydrophobicContact CD2-CB 3.81Å; H171-A373 HydrophobicContact CB-CB 3.62Å; E369-A373 WeakPolarHBondContact O-CB 3.38Å; E369-A373 PolarHBondContact O-N 3.17Å; L370-A373 PolarHBondContact O-N 2.77Å; A373-A377 VanDerWaalsContact O-CB 3.23Å; A373-A377 WeakPolarHBondContact O-CB 3.42Å; A373-A377 PolarHBondContact O-N 2.71Å
374I93.8Very high92.9Very high39 Ų3944 Ų4420%0.225%0.251CS..Hα-helixtrans-65.1-45.2176.9-66.7167.5000110.7V174 L337 L370 S371 L372 I376 A377 L378V174-I374 HydrophobicContact CG1-CD1 4.29Å; V174-I374 HydrophobicContact CG1-CG1 3.74Å; L337-I374 HydrophobicContact CD2-CD1 4.24Å; L370-I374 HydrophobicContact CD1-CD1 4.06Å; L370-I374 HydrophobicContact CD1-CG1 4.38Å; L370-I374 HydrophobicContact CG-CD1 4.07Å; L370-I374 WeakPolarHBondContact O-CG1 3.19Å; L370-I374 PolarHBondContact O-N 3Å; S371-I374 PolarHBondContact O-N 3.02Å; L372-I374 VanDerWaalsContact C-N 3.35Å; L372-I374 PolarHBondContact O-N 2.72Å; I374-I376 PolarHBondContact O-N 2.93Å; I374-A377 PolarHBondContact O-N 2.85Å; I374-L378 HydrophobicContact CG2-CD1 3.79Å; I374-L378 HydrophobicContact CG2-CG 4.17Å; I374-L378 WeakPolarHBondContact O-CB 3.42Å; I374-L378 VanDerWaalsContact O-CG 3.26Å; I374-L378 WeakPolarHBondContact O-CG 3.21Å; I374-L378 PolarHBondContact O-N 3.12Å
375V95.6Very high93.1Very high81 Ų8138.5 Ų38.549%0.49122%0.221SC..Hα-helixtrans-61.4-46.6179.6169.50000111.2S371 L372 L378 T379S371-V375 VanDerWaalsContact O-CG2 3.29Å; S371-V375 WeakPolarHBondContact O-CG2 3.35Å; S371-V375 PolarHBondContact O-N 3.19Å; L372-V375 PolarHBondContact O-N 2.97Å; V375-L378 PolarHBondContact O-N 3.35Å; V375-T379 HydrophobicContact CG1-CG2 4.34Å; V375-T379 WeakPolarHBondContact O-CB 3.24Å; V375-T379 VanDerWaalsContact O-CG2 3.28Å; V375-T379 WeakPolarHBondContact O-CG2 3.24Å; V375-T379 PolarHBondContact O-N 3.04Å; V375-T379 PolarHBondContact O-OG1 3.01Å
376I94.9Very high93.5Very high29 Ų2940.8 Ų40.815%0.14923%0.234CC..Hα-helixtrans-65.5-41.3177.8-63.9-178.4000110.3A149 L153 F175 L372 I374 L378 T379 S380A149-I376 HydrophobicContact CB-CG2 4.43Å; L153-I376 HydrophobicContact CB-CD1 4.2Å; L153-I376 HydrophobicContact CD1-CD1 3.81Å; F175-I376 HydrophobicContact CE2-CB 4.47Å; F175-I376 HydrophobicContact CE2-CG2 4Å; L372-I376 HydrophobicContact CD1-CD1 3.9Å; L372-I376 HydrophobicContact CD1-CG1 4.19Å; L372-I376 HydrophobicContact CG-CD1 4.03Å; L372-I376 WeakPolarHBondContact O-CG1 3.38Å; L372-I376 PolarHBondContact O-N 2.81Å; I374-I376 PolarHBondContact O-N 2.93Å; I376-L378 PolarHBondContact O-N 3.26Å; I376-T379 WeakPolarHBondContact CA-OG1 3.05Å; I376-T379 PolarHBondContact O-OG1 3.37Å; I376-S380 VanDerWaalsContact O-CB 3.27Å; I376-S380 WeakPolarHBondContact O-CB 3.34Å; I376-S380 PolarHBondContact O-N 3.12Å; I376-S380 PolarHBondContact O-OG 3.09Å
377A95.2Very high93.7Very high0 Ų043.2 Ų43.20%025%0.246CC..Hα-helixtrans-60.2-46.7176.700000112.7F175 F179 A373 I374 G381F175-A377 HydrophobicContact CD2-CB 3.64Å; F175-A377 HydrophobicContact CE2-CB 3.96Å; F175-A377 HydrophobicContact CG-CB 4.22Å; F175-A377 WeakPolarHBondContact O-CB 3.46Å; F179-A377 HydrophobicContact CB-CB 4.36Å; A373-A377 VanDerWaalsContact O-CB 3.23Å; A373-A377 WeakPolarHBondContact O-CB 3.42Å; A373-A377 PolarHBondContact O-N 2.71Å; I374-A377 PolarHBondContact O-N 2.85Å; A377-G381 WeakPolarHBondContact O-CA 3.27Å; A377-G381 PolarHBondContact O-N 2.63Å
378L95.5Very high93.7Very high72 Ų7239.5 Ų39.538%0.37723%0.226SC..Hα-helixtrans-67.5-45.7179.5-68.5176.8000111.7Y178 T182 I374 V375 I376 L382Y178-L378 HydrophobicContact CD1-CD2 4.04Å; T182-L378 VanDerWaalsContact OG1-CD2 3.23Å; T182-L378 WeakPolarHBondContact OG1-CD2 3.3Å; I374-L378 HydrophobicContact CG2-CD1 3.79Å; I374-L378 HydrophobicContact CG2-CG 4.17Å; I374-L378 WeakPolarHBondContact O-CB 3.42Å; I374-L378 VanDerWaalsContact O-CG 3.26Å; I374-L378 WeakPolarHBondContact O-CG 3.21Å; I374-L378 PolarHBondContact O-N 3.12Å; V375-L378 PolarHBondContact O-N 3.35Å; I376-L378 PolarHBondContact O-N 3.26Å; L378-L382 VanDerWaalsContact O-CB 3.23Å; L378-L382 WeakPolarHBondContact O-CB 3.33Å; L378-L382 PolarHBondContact O-N 3.29Å
379T96.7Very high93.6Very high84 Ų8441.7 Ų41.752%0.51523%0.231SC..Hα-helixtrans-67.9-48.2-177.751.10000112V375 I376 L382 L383V375-T379 HydrophobicContact CG1-CG2 4.34Å; V375-T379 WeakPolarHBondContact O-CB 3.24Å; V375-T379 VanDerWaalsContact O-CG2 3.28Å; V375-T379 WeakPolarHBondContact O-CG2 3.24Å; V375-T379 PolarHBondContact O-N 3.04Å; V375-T379 PolarHBondContact O-OG1 3.01Å; I376-T379 WeakPolarHBondContact CA-OG1 3.05Å; I376-T379 PolarHBondContact O-OG1 3.37Å; T379-L382 PolarHBondContact O-N 3.32Å; T379-L383 WeakPolarHBondContact O-CB 3.28Å; T379-L383 PolarHBondContact O-N 2.92Å
380S96.8Very high93.5Very high13 Ų1345.1 Ų45.19%0.09125%0.249CC..Hα-helixtrans-68.6-34.8176.563.50000112.2F179 I376 L383 T384F179-S380 VanDerWaalsContact CD2-OG 3.29Å; F179-S380 WeakPolarHBondContact CD2-OG 3.36Å; F179-S380 VanDerWaalsContact CE2-C 3.46Å; F179-S380 WeakPolarHBondContact CE2-OG 3.44Å; I376-S380 VanDerWaalsContact O-CB 3.27Å; I376-S380 WeakPolarHBondContact O-CB 3.34Å; I376-S380 PolarHBondContact O-N 3.12Å; I376-S380 PolarHBondContact O-OG 3.09Å; S380-L383 PolarHBondContact O-N 3.29Å; S380-T384 VanDerWaalsContact O-CB 3.3Å; S380-T384 WeakPolarHBondContact O-CB 3.35Å; S380-T384 PolarHBondContact O-N 3.36Å; S380-T384 PolarHBondContact O-OG1 2.97Å
381G95.9Very high93Very high0 Ų053.8 Ų53.80%029%0.286CS..Hα-helixtrans-66.5-39.4174.400000112.5F179 V183 A377 T384 G385F179-G381 VanDerWaalsContact CD2-CA 3.49Å; V183-G381 VanDerWaalsContact CG2-O 3.32Å; V183-G381 WeakPolarHBondContact CG2-O 3.37Å; A377-G381 WeakPolarHBondContact O-CA 3.27Å; A377-G381 PolarHBondContact O-N 2.63Å; G381-T384 PolarHBondContact O-N 3Å; G381-G385 PolarHBondContact O-N 2.84Å
382L95.6Very high92.4Very high74 Ų7457.4 Ų57.439%0.38730%0.299SS..Hα-helixtrans-64.9-48.1174.1179.665000110.9T182 L378 T379 T384 G385 L386T182-L382 HydrophobicContact CG2-CB 3.94Å; L378-L382 VanDerWaalsContact O-CB 3.23Å; L378-L382 WeakPolarHBondContact O-CB 3.33Å; L378-L382 PolarHBondContact O-N 3.29Å; T379-L382 PolarHBondContact O-N 3.32Å; L382-T384 VanDerWaalsContact C-N 3.32Å; L382-T384 PolarHBondContact O-N 3.47Å; L382-G385 PolarHBondContact O-N 2.93Å; L382-L386 HydrophobicContact CD1-CD1 4.45Å; L382-L386 HydrophobicContact CD1-CG 4.49Å; L382-L386 HydrophobicContact CG-CD1 4.29Å; L382-L386 VanDerWaalsContact O-CG 3.31Å; L382-L386 WeakPolarHBondContact O-CG 3.35Å; L382-L386 PolarHBondContact O-N 3.12Å
383L95.9Very high91.7Very high115 Ų11558.3 Ų58.360%0.60230%0.3SS*.Hα-helixtrans-57.6-47.2176.6-179.566.2000111.1T379 S380 L386 L387T379-L383 WeakPolarHBondContact O-CB 3.28Å; T379-L383 PolarHBondContact O-N 2.92Å; S380-L383 PolarHBondContact O-N 3.29Å; L383-L386 PolarHBondContact O-N 3.47Å; L383-L387 WeakPolarHBondContact O-CB 3.23Å; L383-L387 PolarHBondContact O-N 3.41Å
384T96.1Very high91Very high1 Ų165 Ų651%0.00633%0.328CS..Hα-helixtrans-62.4-47.8177.6-56.80000110.6M142 V145 F179 V183 S380 G381 L382 L386 L387 L388M142-T384 HydrophobicContact CB-CG2 4.37Å; M142-T384 HydrophobicContact CG-CG2 4.32Å; V145-T384 WeakPolarHBondContact CG1-OG1 3.42Å; F179-T384 HydrophobicContact CE1-CG2 4.44Å; F179-T384 HydrophobicContact CZ-CG2 3.94Å; F179-T384 WeakPolarHBondContact CZ-OG1 3.03Å; V183-T384 HydrophobicContact CG2-CG2 3.96Å; S380-T384 VanDerWaalsContact O-CB 3.3Å; S380-T384 WeakPolarHBondContact O-CB 3.35Å; S380-T384 PolarHBondContact O-N 3.36Å; S380-T384 PolarHBondContact O-OG1 2.97Å; G381-T384 PolarHBondContact O-N 3Å; L382-T384 VanDerWaalsContact C-N 3.32Å; L382-T384 PolarHBondContact O-N 3.47Å; T384-L386 VanDerWaalsContact C-N 3.33Å; T384-L386 PolarHBondContact O-N 3.34Å; T384-L387 WeakPolarHBondContact O-CB 3.24Å; T384-L387 PolarHBondContact O-N 3.21Å; T384-L387 VanDerWaalsContact O-N 3.12Å; T384-L388 HydrophobicContact CG2-CD1 4.12Å; T384-L388 HydrophobicContact CG2-CG 4.08Å; T384-L388 WeakPolarHBondContact O-CB 3.43Å; T384-L388 VanDerWaalsContact O-CG 3.26Å; T384-L388 WeakPolarHBondContact O-CG 3.29Å; T384-L388 PolarHBondContact O-N 3.43Å
385G92.4Very high90.1Very high0 Ų065.4 Ų65.40%034%0.338CS..Hα-helixtrans-56.8-43.7177.900000113.2G381 L382 L388 N389G381-G385 PolarHBondContact O-N 2.84Å; L382-G385 PolarHBondContact O-N 2.93Å; G385-L388 PolarHBondContact O-N 2.96Å; G385-N389 WeakPolarHBondContact O-CB 3.43Å; G385-N389 PolarHBondContact O-N 2.81Å; G385-N389 VanDerWaalsContact O-N 3.09Å
386L93.1Very high89.1Confident100 Ų10062.4 Ų62.452%0.52432%0.32SS..Hα-helixtrans-64.3-44174.5-68.5173.1000111.8L382 L383 T384 L388 N389L382-L386 HydrophobicContact CD1-CD1 4.45Å; L382-L386 HydrophobicContact CD1-CG 4.49Å; L382-L386 HydrophobicContact CG-CD1 4.29Å; L382-L386 VanDerWaalsContact O-CG 3.31Å; L382-L386 WeakPolarHBondContact O-CG 3.35Å; L382-L386 PolarHBondContact O-N 3.12Å; L383-L386 PolarHBondContact O-N 3.47Å; T384-L386 VanDerWaalsContact C-N 3.33Å; T384-L386 PolarHBondContact O-N 3.34Å; L386-L388 PolarHBondContact O-N 2.87Å; L386-N389 PolarHBondContact O-N 3.31Å
387L93.1Very high88.1Confident61 Ų6167.3 Ų67.332%0.31934%0.342SS..Hα-helixtrans-61.8-43.6177.9-174.767.3000111.6V141 L383 T384 N389 L390 W393V141-L387 HydrophobicContact CG1-CD2 3.37Å; V141-L387 HydrophobicContact CG1-CG 4.17Å; L383-L387 WeakPolarHBondContact O-CB 3.23Å; L383-L387 PolarHBondContact O-N 3.41Å; T384-L387 WeakPolarHBondContact O-CB 3.24Å; T384-L387 PolarHBondContact O-N 3.21Å; T384-L387 VanDerWaalsContact O-N 3.12Å; L387-N389 VanDerWaalsContact C-N 3.28Å; L387-N389 PolarHBondContact O-N 2.98Å; L387-L390 HydrophobicContact CD1-CD1 3.9Å; L387-L390 WeakPolarHBondContact O-CB 3.4Å; L387-L390 VanDerWaalsContact O-CG 3.3Å; L387-L390 WeakPolarHBondContact O-CG 3.44Å; L387-L390 PolarHBondContact O-N 3.39Å; L387-W393 PolarHBondContact O-NE1 2.89Å
388L89.9Confident87.1Confident0 Ų068.8 Ų68.80%035%0.351CS..Hα-helixtrans-69.3-26.1178.5-63.5-168.2000112.4Q138 V141 M142 V183 L187 T384 G385 L386 L390Q138-L388 HydrophobicContact CB-CD1 4.39Å; Q138-L388 HydrophobicContact CB-CD2 3.83Å; Q138-L388 HydrophobicContact CG-CD2 4.16Å; Q138-L388 PolarHBondContact NE2-O 2.95Å; Q138-L388 VanDerWaalsContact O-CD2 3.28Å; Q138-L388 WeakPolarHBondContact O-CD2 3.43Å; V141-L388 HydrophobicContact CB-CD2 3.97Å; V141-L388 HydrophobicContact CG1-CD2 3.97Å; M142-L388 HydrophobicContact CB-CD1 4.36Å; V183-L388 HydrophobicContact CG1-CD1 3.8Å; L187-L388 HydrophobicContact CD2-CB 4.28Å; T384-L388 HydrophobicContact CG2-CD1 4.12Å; T384-L388 HydrophobicContact CG2-CG 4.08Å; T384-L388 WeakPolarHBondContact O-CB 3.43Å; T384-L388 VanDerWaalsContact O-CG 3.26Å; T384-L388 WeakPolarHBondContact O-CG 3.29Å; T384-L388 PolarHBondContact O-N 3.43Å; G385-L388 PolarHBondContact O-N 2.96Å; L386-L388 PolarHBondContact O-N 2.87Å; L388-L390 PolarHBondContact O-N 3.33Å
389N87.8Confident85.7Confident76 Ų7669.1 Ų69.141%0.40636%0.364SS..THydrogen-bonded Turntrans-77.8-5.5178.1-159.819.3000113.4C186 G385 L386 L387C186-N389 PolarHBondContact O-ND2 3.08Å; G385-N389 WeakPolarHBondContact O-CB 3.43Å; G385-N389 PolarHBondContact O-N 2.81Å; G385-N389 VanDerWaalsContact O-N 3.09Å; L386-N389 PolarHBondContact O-N 3.31Å; L387-N389 VanDerWaalsContact C-N 3.28Å; L387-N389 PolarHBondContact O-N 2.98Å
390L86.6Confident84.5Confident79 Ų7967.6 Ų67.641%0.41435%0.35SS..SBendtrans-64.6138.3175.6-62.3178.7000111.6L387 L388 I392 W393L387-L390 HydrophobicContact CD1-CD1 3.9Å; L387-L390 WeakPolarHBondContact O-CB 3.4Å; L387-L390 VanDerWaalsContact O-CG 3.3Å; L387-L390 WeakPolarHBondContact O-CG 3.44Å; L387-L390 PolarHBondContact O-N 3.39Å; L388-L390 PolarHBondContact O-N 3.33Å; L390-I392 HydrophobicContact CD1-CD1 4.4Å; L390-I392 PolarHBondContact O-N 3.03Å; L390-W393 PolarHBondContact O-N 3.44Å
391K79.6Confident83.5Confident203 Ų20368.2 Ų68.288%0.88335%0.351SS*.G310 helixtrans-64.6-13.7-178.2-67-176.2179.6177.40114.4W393 K394K391-W393 PolarHBondContact O-N 3.11Å; K391-K394 PolarHBondContact O-N 2.92Å
392I80.6Confident82.4Confident134 Ų13470.5 Ų70.569%0.68736%0.361SS*.G310 helixtrans-59.3-34.4-179.1-56.8168.1000111L390 K394L390-I392 HydrophobicContact CD1-CD1 4.4Å; L390-I392 PolarHBondContact O-N 3.03Å; I392-K394 VanDerWaalsContact C-N 3.26Å; I392-K394 PolarHBondContact O-N 3.49Å
393W78.6Confident81.5Confident64 Ų6468.3 Ų68.324%0.24235%0.349CS..G310 helixtrans-76.2-8.7-173.3-53.9115.2000114.6N135 A137 Q138 V141 L387 L390 K391 A395N135-W393 PolarHBondContact ND2-O 3.4Å; A137-W393 HydrophobicContact CB-CE3 4.27Å; Q138-W393 HydrophobicContact CG-CB 3.7Å; Q138-W393 HydrophobicContact CG-CG 3.92Å; V141-W393 HydrophobicContact CG2-CH2 3.51Å; V141-W393 HydrophobicContact CG2-CZ2 3.88Å; V141-W393 HydrophobicContact CG2-CZ3 3.93Å; L387-W393 PolarHBondContact O-NE1 2.89Å; L390-W393 PolarHBondContact O-N 3.44Å; K391-W393 PolarHBondContact O-N 3.11Å; W393-A395 VanDerWaalsContact C-N 3.29Å; W393-A395 PolarHBondContact O-N 3.28Å
394K77.3Confident80.8Confident139 Ų13963 Ų6360%0.60432%0.322SS*.  trans48.452.6-174.7-60.3179.1-177.7173.40111.4N135 K391 I392N135-K394 PolarHBondContact ND2-O 3.12Å; K391-K394 PolarHBondContact O-N 2.92Å; I392-K394 VanDerWaalsContact C-N 3.26Å; I392-K394 PolarHBondContact O-N 3.49Å
395A76.1Confident80Confident49 Ų4964.4 Ų64.441%0.40533%0.328SS..PPolyproline II helixtrans-51.8149.4177.700000111.3W393 H397W393-A395 VanDerWaalsContact C-N 3.29Å; W393-A395 PolarHBondContact O-N 3.28Å; A395-H397 PolarHBondContact O-N 3.37Å
396P73.2Confident79.1Confident17 Ų1766.1 Ų66.111%0.1134%0.339CS..PPolyproline II helixtrans-57.9141176.425.4-32.6000109.8K133 V398 Y401K133-P396 VanDerWaalsContact O-CG 3.26Å; K133-P396 WeakPolarHBondContact O-CG 3.26Å; P396-V398 PolarHBondContact O-N 3.16Å; P396-Y401 HydrophobicContact CG-CD1 4.23Å; P396-Y401 HydrophobicContact CG-CE1 4.14Å; P396-Y401 WeakPolarHBondContact O-CE1 3.46Å
397H74.8Confident78.4Confident133 Ų13364.1 Ų64.162%0.61633%0.326SS*.PPolyproline II helixtrans-62.4140.9175.2-169.5-90.3000109.3A395 A399 K400A395-H397 PolarHBondContact O-N 3.37Å; H397-A399 WeakPolarHBondContact ND1-CB 3.4Å; H397-A399 PolarHBondContact ND1-N 3.13Å; H397-A399 PolarHBondContact O-N 3.44Å; H397-K400 WeakPolarHBondContact O-CA 3.45Å; H397-K400 PolarHBondContact O-N 3.05Å
398V73.1Confident77.8Confident31 Ų3165.1 Ų65.119%0.18833%0.325CS..G310 helixtrans-52.3-34.8-175.3-177.60000113P188 K189 P190 L191 P396 K400 Y401P188-V398 HydrophobicContact CB-CG2 4.18Å; K189-V398 VanDerWaalsContact O-CG1 3.27Å; K189-V398 WeakPolarHBondContact O-CG1 3.46Å; P190-V398 VanDerWaalsContact CA-CG1 3.43Å; L191-V398 HydrophobicContact CD1-CB 4.08Å; L191-V398 HydrophobicContact CD1-CG1 3.79Å; P396-V398 PolarHBondContact O-N 3.16Å; V398-K400 PolarHBondContact O-N 3.39Å; V398-Y401 HydrophobicContact CB-CE2 4.49Å; V398-Y401 HydrophobicContact CG1-CD2 4.32Å; V398-Y401 HydrophobicContact CG1-CE2 4.07Å; V398-Y401 HydrophobicContact CG2-CE2 4.47Å; V398-Y401 PolarHBondContact O-N 3.32Å
399A67.4Low77.3Confident78 Ų7874.6 Ų74.665%0.64537%0.367SS*.G310 helixtrans-65.5-15.2176.600000114.8H397H397-A399 WeakPolarHBondContact ND1-CB 3.4Å; H397-A399 PolarHBondContact ND1-N 3.13Å; H397-A399 PolarHBondContact O-N 3.44Å
400K70.1Confident76.5Confident52 Ų5274.3 Ų74.323%0.22636%0.362CS..G310 helixtrans-115.217.9-178.4-58.2-167.6-179.4-174.10112.8K4 H397 V398 D403 V406K4-K400 PolarHBondContact O-NZ 3Å; K4-K400 VanDerWaalsContact O-NZ 3.11Å; H397-K400 WeakPolarHBondContact O-CA 3.45Å; H397-K400 PolarHBondContact O-N 3.05Å; V398-K400 PolarHBondContact O-N 3.39Å; K400-D403 PolarHBondContact O-N 3.02Å; K400-V406 HydrophobicContact CB-CG2 3.79Å; K400-V406 HydrophobicContact CD-CG2 3.9Å; K400-V406 HydrophobicContact CG-CG2 4.49Å
401Y75.6Confident75.2Confident27 Ų2776.1 Ų76.111%0.10638%0.378CS..THydrogen-bonded Turntrans-60.9143.7171.8-73.6-4.4000110.6G132 K133 P188 P190 P396 V398 D403G132-Y401 CarbonylContact O-C 3.58Å; G132-Y401 WeakPolarHBondContact O-CA 3.47Å; K133-Y401 HydrophobicContact CB-CD1 4.48Å; K133-Y401 HydrophobicContact CB-CD2 4.28Å; K133-Y401 HydrophobicContact CB-CE1 4.25Å; K133-Y401 HydrophobicContact CB-CE2 4.04Å; K133-Y401 HydrophobicContact CB-CG 4.48Å; K133-Y401 HydrophobicContact CD-CD2 4.46Å; K133-Y401 HydrophobicContact CD-CE2 4.23Å; K133-Y401 HydrophobicContact CG-CD2 3.78Å; K133-Y401 HydrophobicContact CG-CE2 3.84Å; K133-Y401 HydrophobicContact CG-CG 4.23Å; P188-Y401 PolarHBondContact O-OH 3.48Å; P190-Y401 HydrophobicContact CG-CD2 4.33Å; P396-Y401 HydrophobicContact CG-CD1 4.23Å; P396-Y401 HydrophobicContact CG-CE1 4.14Å; P396-Y401 WeakPolarHBondContact O-CE1 3.46Å; V398-Y401 HydrophobicContact CB-CE2 4.49Å; V398-Y401 HydrophobicContact CG1-CD2 4.32Å; V398-Y401 HydrophobicContact CG1-CE2 4.07Å; V398-Y401 HydrophobicContact CG2-CE2 4.47Å; V398-Y401 PolarHBondContact O-N 3.32Å; Y401-D403 VanDerWaalsContact C-N 3.29Å; Y401-D403 PolarHBondContact O-N 3.12Å
402F73.5Confident74.2Confident47 Ų4773.9 Ų73.921%0.20637%0.371CS..THydrogen-bonded Turntrans60.931.2-178.1-47.7-83.3000114.4F69 R71 H72 L131 G132 K133F69-F402 HydrophobicContact CD1-CD1 4.13Å; F69-F402 HydrophobicContact CD1-CG 4.44Å; F69-F402 AromaticContact CD2-CD1 3.8Å; F69-F402 HydrophobicContact CD2-CD1 3.8Å; F69-F402 HydrophobicContact CD2-CE1 4.14Å; F69-F402 HydrophobicContact CE1-CD1 4.17Å; F69-F402 HydrophobicContact CE1-CE1 4.24Å; F69-F402 AromaticContact CE2-CD1 3.84Å; F69-F402 HydrophobicContact CE2-CD1 3.84Å; F69-F402 AromaticContact CE2-CE1 3.69Å; F69-F402 HydrophobicContact CE2-CE1 3.69Å; F69-F402 AromaticContact CG-CD1 3.95Å; F69-F402 HydrophobicContact CG-CD1 3.95Å; F69-F402 HydrophobicContact CZ-CD1 4.03Å; F69-F402 AromaticContact CZ-CE1 3.75Å; F69-F402 HydrophobicContact CZ-CE1 3.75Å; F69-F402 HydrophobicContact CZ-CZ 4.36Å; R71-F402 CarbonylContact C-O 3.43Å; R71-F402 WeakPolarHBondContact CB-O 3.41Å; H72-F402 HydrophobicContact CB-CB 4.31Å; L131-F402 VanDerWaalsContact O-CE1 3.23Å; L131-F402 WeakPolarHBondContact O-CE1 3.14Å; G132-F402 PolarHBondContact O-N 2.63Å; K133-F402 HydrophobicContact CG-CZ 4.22Å
403D77.1Confident73Confident28 Ų2873.1 Ų73.115%0.1537%0.367CS..  trans-122.5109.5178.5-166-11.5000112.6R71 K400 Y401 Q405 V406R71-D403 CarbonylContact O-C 3.55Å; R71-D403 WeakPolarHBondContact O-CA 3.29Å; K400-D403 PolarHBondContact O-N 3.02Å; Y401-D403 VanDerWaalsContact C-N 3.29Å; Y401-D403 PolarHBondContact O-N 3.12Å; D403-Q405 PolarHBondContact O-N 3.33Å; D403-Q405 VanDerWaalsContact OD1-CB 3.32Å; D403-Q405 WeakPolarHBondContact OD1-CB 3.48Å; D403-Q405 WeakPolarHBondContact OD1-CG 3.46Å; D403-Q405 PolarHBondContact OD1-N 2.99Å; D403-V406 HydrophobicContact CB-CG2 4.45Å; D403-V406 WeakPolarHBondContact O-CB 3.37Å; D403-V406 WeakPolarHBondContact O-CG2 3.46Å; D403-V406 PolarHBondContact O-N 3.32Å
404D80.5Confident71.7Confident4 Ų472.1 Ų72.12%0.02137%0.373CS..G310 helixtrans-62.5-24.3178.4-81-29.1000111.6R71 H72 S73 W74 S75 V406 F407 W408 F410R71-D404 WeakPolarHBondContact O-CA 3.37Å; R71-D404 WeakPolarHBondContact O-CB 3.37Å; R71-D404 PolarHBondContact O-N 3.36Å; H72-D404 VanDerWaalsContact CA-CG 3.43Å; H72-D404 WeakPolarHBondContact CA-OD1 3.41Å; H72-D404 WeakPolarHBondContact CA-OD2 3.36Å; H72-D404 IonicContact CD2-OD1 3.21Å; H72-D404 PolarHBondContact N-OD2 3.21Å; S73-D404 PolarHBondContact N-OD2 3.3Å; S73-D404 VanDerWaalsContact N-OD2 3.14Å; W74-D404 WeakPolarHBondContact CB-OD2 3.42Å; W74-D404 PolarHBondContact N-OD2 2.92Å; S75-D404 WeakPolarHBondContact CB-OD1 3.49Å; S75-D404 PolarHBondContact N-OD1 3.5Å; S75-D404 PolarHBondContact OG-OD1 2.95Å; D404-V406 PolarHBondContact O-N 2.95Å; D404-F407 PolarHBondContact O-N 3.12Å; D404-W408 PolarHBondContact O-N 2.9Å; D404-F410 HydrophobicContact CB-CE2 3.78Å; D404-F410 HydrophobicContact CB-CZ 3.65Å
405Q79.6Confident70Confident31 Ų3171.5 Ų71.515%0.14538%0.38CS..G310 helixtrans-62.3-16.3178.9-64.6-173.812.500112.9Y5 D403 F407 F410Y5-Q405 HydrophobicContact CE1-CB 4.21Å; Y5-Q405 WeakPolarHBondContact CE1-O 3.32Å; Y5-Q405 VanDerWaalsContact OH-CB 3.31Å; Y5-Q405 WeakPolarHBondContact OH-CB 3.21Å; Y5-Q405 PolarHBondContact OH-OE1 3.27Å; D403-Q405 PolarHBondContact O-N 3.33Å; D403-Q405 VanDerWaalsContact OD1-CB 3.32Å; D403-Q405 WeakPolarHBondContact OD1-CB 3.48Å; D403-Q405 WeakPolarHBondContact OD1-CG 3.46Å; D403-Q405 PolarHBondContact OD1-N 2.99Å; Q405-F407 VanDerWaalsContact C-N 3.3Å; Q405-F410 HydrophobicContact CB-CD2 4.34Å; Q405-F410 HydrophobicContact CB-CE2 4.46Å; Q405-F410 HydrophobicContact CG-CD2 3.7Å; Q405-F410 HydrophobicContact CG-CE2 3.93Å; Q405-F410 HydrophobicContact CG-CG 4.47Å
406V74.7Confident68.7Low35 Ų3572 Ų7221%0.21239%0.39CS..G310 helixtrans-67.2-33.1173.1-178.80000111.5K400 D403 D404K400-V406 HydrophobicContact CB-CG2 3.79Å; K400-V406 HydrophobicContact CD-CG2 3.9Å; K400-V406 HydrophobicContact CG-CG2 4.49Å; D403-V406 HydrophobicContact CB-CG2 4.45Å; D403-V406 WeakPolarHBondContact O-CB 3.37Å; D403-V406 WeakPolarHBondContact O-CG2 3.46Å; D403-V406 PolarHBondContact O-N 3.32Å; D404-V406 PolarHBondContact O-N 2.95Å
407F78Confident66.8Low58 Ų5880.6 Ų80.625%0.25443%0.426SS..THydrogen-bonded Turntrans-116.1-30.1-170.8-53.8-64.4000113.6F79 N135 D404 Q405F79-F407 HydrophobicContact CE2-CD2 4.12Å; F79-F407 HydrophobicContact CE2-CE2 4.24Å; F79-F407 HydrophobicContact CZ-CB 4.23Å; F79-F407 HydrophobicContact CZ-CD1 4.42Å; F79-F407 AromaticContact CZ-CD2 3.99Å; F79-F407 HydrophobicContact CZ-CD2 3.99Å; F79-F407 HydrophobicContact CZ-CE2 4.49Å; F79-F407 AromaticContact CZ-CG 3.95Å; F79-F407 HydrophobicContact CZ-CG 3.95Å; N135-F407 HydrophobicContact CB-CE1 3.71Å; N135-F407 HydrophobicContact CB-CZ 3.81Å; D404-F407 PolarHBondContact O-N 3.12Å; Q405-F407 VanDerWaalsContact C-N 3.3Å
408W80.9Confident66.4Low83 Ų8378 Ų7831%0.31442%0.417SS..SBendtrans-109.5146.9-171.1-60.391.1000112.2W74 S75 A78 D404 F410W74-W408 HydrophobicContact CB-CD2 4.15Å; W74-W408 HydrophobicContact CB-CG 4.27Å; W74-W408 HydrophobicContact CB-CZ2 4.45Å; W74-W408 HydrophobicContact CE3-CD2 4.08Å; W74-W408 AromaticContact CE3-CE3 3.74Å; W74-W408 HydrophobicContact CE3-CE3 3.74Å; W74-W408 HydrophobicContact CE3-CZ3 4.15Å; W74-W408 HydrophobicContact CZ3-CE3 4.32Å; S75-W408 PolarHBondContact OG-NE1 3.41Å; A78-W408 HydrophobicContact CB-CH2 3.58Å; A78-W408 HydrophobicContact CB-CZ2 3.51Å; D404-W408 PolarHBondContact O-N 2.9Å; W408-F410 HydrophobicContact CB-CD2 4.32Å; W408-F410 HydrophobicContact CB-CE2 3.68Å; W408-F410 HydrophobicContact CB-CZ 4.18Å; W408-F410 WeakPolarHBondContact O-CD2 3.39Å
409K78.3Confident66.1Low199 Ų19980.4 Ų80.487%0.86543%0.429SS*.  trans-83.5117173.2-176.9-178.5174.6-173.10108.9
410F72.1Confident66Low70 Ų7080.6 Ų80.631%0.30742%0.417SS..  trans-101.4140.2171.8-69.9-89.6000110.9D404 Q405 W408 H412D404-F410 HydrophobicContact CB-CE2 3.78Å; D404-F410 HydrophobicContact CB-CZ 3.65Å; Q405-F410 HydrophobicContact CB-CD2 4.34Å; Q405-F410 HydrophobicContact CB-CE2 4.46Å; Q405-F410 HydrophobicContact CG-CD2 3.7Å; Q405-F410 HydrophobicContact CG-CE2 3.93Å; Q405-F410 HydrophobicContact CG-CG 4.47Å; W408-F410 HydrophobicContact CB-CD2 4.32Å; W408-F410 HydrophobicContact CB-CE2 3.68Å; W408-F410 HydrophobicContact CB-CZ 4.18Å; W408-F410 WeakPolarHBondContact O-CD2 3.39Å; F410-H412 VanDerWaalsContact C-N 3.25Å; F410-H412 PolarHBondContact O-N 3.37Å
411P59.1Low65.8Low116 Ų11682.2 Ų82.275%0.75343%0.428SS*.SBendtrans-65.2-27.2-18021.3-29.2000113.2
412H58.6Low65.2Low157 Ų15785.7 Ų85.773%0.72745%0.448SS*.SBendtrans-129.5132.8169.2-56-65.6000108.6F410 A414F410-H412 VanDerWaalsContact C-N 3.25Å; F410-H412 PolarHBondContact O-N 3.37Å; H412-A414 PolarHBondContact O-N 2.94Å; H412-A414 VanDerWaalsContact O-N 3.1Å
413L54.3Low64.6Low117 Ų11788.3 Ų88.361%0.61346%0.464SS*.  trans-59.2116.5167.7-75.7161.6000106.2Y5 V415Y5-L413 HydrophobicContact CE2-CD2 4.1Å; L413-V415 HydrophobicContact CB-CG2 4.24Å; L413-V415 PolarHBondContact O-N 2.96Å
414A50.6Low63.7Low44 Ų4492.6 Ų92.636%0.36449%0.487SS..  trans-70.679.8175.500000108.5H412 G416H412-A414 PolarHBondContact O-N 2.94Å; H412-A414 VanDerWaalsContact O-N 3.1Å; A414-G416 PolarHBondContact O-N 3.37Å
415V43.1Very low62.4Low125 Ų12599.4 Ų99.476%0.75852%0.523SS*.  trans-78.4105.2163-176.30000104.8L413L413-V415 HydrophobicContact CB-CG2 4.24Å; L413-V415 PolarHBondContact O-N 2.96Å
416G47.9Very low61Low60 Ų60105.1 Ų105.162%0.61955%0.554SS**  trans62.484.117000000116.2A414A414-G416 PolarHBondContact O-N 3.37Å
417F34.5Very low59.8Low197 Ų197111.5 Ų111.586%0.86459%0.585SS**  trans-153.70154.2-78.2-71000110.7R70 R71R70-F417 PolarHBondContact NH1-OXT 3.04Å; R70-F417 PolarHBondContact NH2-OXT 3.23Å; R70-F417 VanDerWaalsContact NH2-OXT 3.16Å; R71-F417 PolarHBondContact NH2-O 3.43Å

Retrieved 417 of 417 residues in 563.7 ms (Link to these results)

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