QOX1_STAA8 Loading...

Probable quinol oxidase subunit 1

Catalyzes quinol oxidation with the concomitant reduction of oxygen to water.

AlphaFold DB , UniProt , Accession Q2FZK0, Species STAA8 (Staphylococcus aureus (strain NCTC 8325 / PS 47)), Gene qoxB, Length 662 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
1M61.9Low77Confident153 Ų153100 Ų10075%0.75448%0.483SS*.  0114.10-80175.5-173.300106.8F3 P610M1-F3 PolarHBondContact O-N 3.45Å; M1-P610 HydrophobicContact CE-CG 3.58Å; M1-P610 HydrophobicContact SD-CG 3.68Å
2N71Confident76.3Confident167 Ų16797.7 Ų97.789%0.89350%0.504SS*.  trans-81.266.4176.5-69.7-8000109.1
3F80.6Confident76.3Confident21 Ų2191.5 Ų91.59%0.09247%0.473CS..  trans-78130.2177.3-171.2-91.1000109.3M1 W5 L8 F601 F602 F605 T607M1-F3 PolarHBondContact O-N 3.45Å; F3-W5 VanDerWaalsContact C-N 3.29Å; F3-W5 AromaticContact CD1-CD2 3.84Å; F3-W5 HydrophobicContact CD1-CD2 3.84Å; F3-W5 AromaticContact CD1-CE2 3.89Å; F3-W5 HydrophobicContact CD1-CE3 4.15Å; F3-W5 HydrophobicContact CD1-CG 4.2Å; F3-W5 HydrophobicContact CD1-CH2 4.45Å; F3-W5 HydrophobicContact CD1-CZ2 4.21Å; F3-W5 HydrophobicContact CD1-CZ3 4.42Å; F3-W5 HydrophobicContact CE1-CE3 4.43Å; F3-W5 PolarHBondContact O-N 2.96Å; F3-L8 HydrophobicContact CE1-CD1 3.94Å; F3-L8 HydrophobicContact CE1-CD2 3.75Å; F3-L8 HydrophobicContact CE1-CG 3.86Å; F3-L8 HydrophobicContact CZ-CD2 3.99Å; F3-F601 HydrophobicContact CE2-CE1 4.19Å; F3-F601 AromaticContact CZ-CE1 3.86Å; F3-F601 HydrophobicContact CZ-CE1 3.86Å; F3-F601 HydrophobicContact CZ-CZ 4.28Å; F3-F602 HydrophobicContact CD2-CD1 4.13Å; F3-F602 HydrophobicContact CD2-CE1 4.24Å; F3-F602 AromaticContact CE2-CD1 3.98Å; F3-F602 HydrophobicContact CE2-CD1 3.98Å; F3-F602 HydrophobicContact CE2-CE1 4.22Å; F3-F605 HydrophobicContact CD2-CB 4.33Å; F3-F605 HydrophobicContact CE2-CB 3.61Å; F3-F605 HydrophobicContact CE2-CD2 4.04Å; F3-F605 AromaticContact CE2-CG 3.9Å; F3-F605 HydrophobicContact CE2-CG 3.9Å; F3-F605 HydrophobicContact CZ-CB 3.94Å; F3-F605 HydrophobicContact CZ-CD1 4.28Å; F3-F605 AromaticContact CZ-CD2 3.74Å; F3-F605 HydrophobicContact CZ-CD2 3.74Å; F3-F605 HydrophobicContact CZ-CE2 4.35Å; F3-F605 AromaticContact CZ-CG 3.71Å; F3-F605 HydrophobicContact CZ-CG 3.71Å; F3-T607 WeakPolarHBondContact CD2-OG1 3.5Å
4P82.8Confident76.7Confident25 Ų2597 Ų9716%0.16249%0.485CS..  trans-77.575-176.132.8-37000111.4D6 Q7 F605P4-D6 PolarHBondContact O-N 2.96Å; P4-D6 VanDerWaalsContact O-N 3.13Å; P4-Q7 HydrophobicContact CB-CB 4.37Å; P4-Q7 HydrophobicContact CB-CG 4.04Å; P4-Q7 PolarHBondContact O-N 3.33Å; P4-F605 HydrophobicContact CG-CB 3.99Å; P4-F605 HydrophobicContact CG-CD1 3.79Å; P4-F605 HydrophobicContact CG-CG 4.33Å
5W82.9Confident77.1Confident187 Ų18792.9 Ų92.971%0.70846%0.464SS*.G310 helixtrans-57.7-26.5-178.1-65.9100.5000113.7F3 Q7 L8F3-W5 VanDerWaalsContact C-N 3.29Å; F3-W5 AromaticContact CD1-CD2 3.84Å; F3-W5 HydrophobicContact CD1-CD2 3.84Å; F3-W5 AromaticContact CD1-CE2 3.89Å; F3-W5 HydrophobicContact CD1-CE3 4.15Å; F3-W5 HydrophobicContact CD1-CG 4.2Å; F3-W5 HydrophobicContact CD1-CH2 4.45Å; F3-W5 HydrophobicContact CD1-CZ2 4.21Å; F3-W5 HydrophobicContact CD1-CZ3 4.42Å; F3-W5 HydrophobicContact CE1-CE3 4.43Å; F3-W5 PolarHBondContact O-N 2.96Å; W5-Q7 VanDerWaalsContact C-N 3.3Å; W5-L8 HydrophobicContact CD2-CD1 4.39Å; W5-L8 HydrophobicContact CE3-CD1 3.39Å; W5-L8 HydrophobicContact CZ3-CD1 3.8Å; W5-L8 PolarHBondContact O-N 3.46Å
6D81.6Confident77.3Confident122 Ų12287.5 Ų87.565%0.65244%0.437SS*.G310 helixtrans-69.9-25.5178.362.9-55.8000113.3P4P4-D6 PolarHBondContact O-N 2.96Å; P4-D6 VanDerWaalsContact O-N 3.13Å
7Q80.1Confident77.6Confident80 Ų8085.8 Ų85.837%0.37443%0.432SS..G310 helixtrans-83.7-12.6178.1-62.5-176.88.300113.1P4 W5 L9 G159 F605P4-Q7 HydrophobicContact CB-CB 4.37Å; P4-Q7 HydrophobicContact CB-CG 4.04Å; P4-Q7 PolarHBondContact O-N 3.33Å; W5-Q7 VanDerWaalsContact C-N 3.3Å; Q7-L9 PolarHBondContact O-N 3.08Å; Q7-G159 VanDerWaalsContact O-CA 3.23Å; Q7-G159 WeakPolarHBondContact O-CA 3.36Å; Q7-G159 PolarHBondContact O-N 2.89Å; Q7-F605 HydrophobicContact CB-CD1 4.47Å; Q7-F605 HydrophobicContact CB-CE1 4.08Å
8L79.6Confident78Confident33 Ų3387.8 Ų87.817%0.17344%0.442CS..SBendtrans-63.6-40.3-176.2-76.3175.2000112.8F3 W5 I158 G159 F601 F605F3-L8 HydrophobicContact CE1-CD1 3.94Å; F3-L8 HydrophobicContact CE1-CD2 3.75Å; F3-L8 HydrophobicContact CE1-CG 3.86Å; F3-L8 HydrophobicContact CZ-CD2 3.99Å; W5-L8 HydrophobicContact CD2-CD1 4.39Å; W5-L8 HydrophobicContact CE3-CD1 3.39Å; W5-L8 HydrophobicContact CZ3-CD1 3.8Å; W5-L8 PolarHBondContact O-N 3.46Å; L8-I158 HydrophobicContact CD2-CG2 3.51Å; L8-I158 VanDerWaalsContact O-CA 3.28Å; L8-I158 WeakPolarHBondContact O-CA 3.47Å; L8-G159 PolarHBondContact O-N 2.98Å; L8-F601 HydrophobicContact CD2-CZ 4.15Å; L8-F605 HydrophobicContact CD2-CE1 4.4Å; L8-F605 HydrophobicContact CD2-CE2 4.3Å; L8-F605 HydrophobicContact CD2-CZ 3.99Å
9L79.4Confident78.3Confident111 Ų11184.4 Ų84.458%0.58143%0.429SS*.BIsolated β-bridgetrans-99.2112.6-176.9-65.5176.7000110.2Q7 K11Q7-L9 PolarHBondContact O-N 3.08Å; L9-K11 PolarHBondContact O-N 2.77Å
10V74.7Confident78.4Confident27 Ų2781.6 Ų81.616%0.16441%0.414CS..  trans-65.9117.8166.6-173.50000108.6I16 Q20 G160V10-I16 HydrophobicContact CB-CG2 3.84Å; V10-I16 HydrophobicContact CG1-CD1 3.92Å; V10-I16 HydrophobicContact CG1-CG2 3.96Å; V10-Q20 PolarHBondContact O-NE2 2.94Å; V10-Q20 PolarHBondContact O-OE1 3.1Å; V10-G160 VanDerWaalsContact CG2-N 3.32Å
11K72.5Confident78.7Confident174 Ų17482.4 Ų82.476%0.75742%0.418SS*.  trans-102.6156.7-179.8-64.3176.2-174.9171.70110.4L9L9-K11 PolarHBondContact O-N 2.77Å
12G68.3Low79.8Confident72 Ų7276.4 Ų76.474%0.74240%0.396SS*.SBendtrans104.8-8164.500000116.4
13N76.3Confident80.5Confident18 Ų1869.8 Ų69.810%0.09637%0.365CS..  trans-130123.8176.9-167.8-63.2000112M15 I16 T17 H94N13-M15 VanDerWaalsContact C-N 3.28Å; N13-M15 PolarHBondContact O-N 3.42Å; N13-M15 WeakPolarHBondContact OD1-CA 3.33Å; N13-M15 VanDerWaalsContact OD1-CB 3.24Å; N13-M15 WeakPolarHBondContact OD1-CB 3.23Å; N13-M15 PolarHBondContact OD1-N 2.96Å; N13-I16 HydrophobicContact CB-CB 4.18Å; N13-I16 HydrophobicContact CB-CD1 3.82Å; N13-I16 HydrophobicContact CB-CG1 3.88Å; N13-I16 PolarHBondContact O-N 3.16Å; N13-I16 VanDerWaalsContact O-N 3.16Å; N13-T17 PolarHBondContact O-N 3.21Å; N13-T17 PolarHBondContact O-OG1 2.84Å; N13-H94 PolarHBondContact ND2-ND1 3.41Å
14W82.2Confident80.7Confident168 Ų16871.8 Ų71.864%0.63638%0.379SS*.Hα-helixtrans-61.3-33.5-178.369-91.9000113.1T17 M18W14-T17 PolarHBondContact O-N 2.66Å; W14-M18 HydrophobicContact CE3-CG 4.36Å; W14-M18 HydrophobicContact CE3-SD 3.52Å; W14-M18 VanDerWaalsContact CE3-SD 3.52Å; W14-M18 HydrophobicContact CZ3-SD 3.54Å; W14-M18 VanDerWaalsContact CZ3-SD 3.54Å; W14-M18 WeakPolarHBondContact O-CB 3.43Å; W14-M18 VanDerWaalsContact O-CG 3.31Å; W14-M18 WeakPolarHBondContact O-CG 3.5Å; W14-M18 PolarHBondContact O-N 3.31Å
15M82.7Confident81Confident35 Ų3577.3 Ų77.317%0.17240%0.401CS..Hα-helixtrans-67-42.6176.9-61.1173.866.900110.9N13 M18 A19 L77 F89 L90N13-M15 VanDerWaalsContact C-N 3.28Å; N13-M15 PolarHBondContact O-N 3.42Å; N13-M15 WeakPolarHBondContact OD1-CA 3.33Å; N13-M15 VanDerWaalsContact OD1-CB 3.24Å; N13-M15 WeakPolarHBondContact OD1-CB 3.23Å; N13-M15 PolarHBondContact OD1-N 2.96Å; M15-M18 PolarHBondContact O-N 3.02Å; M15-A19 WeakPolarHBondContact O-CB 3.46Å; M15-A19 PolarHBondContact O-N 3.26Å; M15-L77 HydrophobicContact CE-CD1 3.99Å; M15-L77 HydrophobicContact CE-CD2 3.56Å; M15-L77 HydrophobicContact CE-CG 4.44Å; M15-F89 HydrophobicContact CE-CZ 4.38Å; M15-F89 HydrophobicContact SD-CZ 4.36Å; M15-L90 HydrophobicContact SD-CD2 4.26Å
16I80.7Confident81.2Confident7 Ų774.9 Ų74.94%0.03640%0.401CS..Hα-helixtrans-66.2-43.9177.4-59.4178.8000109.5V10 N13 M18 A19 Q20V10-I16 HydrophobicContact CB-CG2 3.84Å; V10-I16 HydrophobicContact CG1-CD1 3.92Å; V10-I16 HydrophobicContact CG1-CG2 3.96Å; N13-I16 HydrophobicContact CB-CB 4.18Å; N13-I16 HydrophobicContact CB-CD1 3.82Å; N13-I16 HydrophobicContact CB-CG1 3.88Å; N13-I16 PolarHBondContact O-N 3.16Å; N13-I16 VanDerWaalsContact O-N 3.16Å; I16-M18 VanDerWaalsContact C-N 3.34Å; I16-M18 PolarHBondContact O-N 2.88Å; I16-A19 CarbonylContact O-C 3.5Å; I16-A19 WeakPolarHBondContact O-CB 3.21Å; I16-A19 PolarHBondContact O-N 2.95Å; I16-A19 VanDerWaalsContact O-N 3.13Å; I16-Q20 HydrophobicContact CG2-CG 4.25Å; I16-Q20 WeakPolarHBondContact O-CB 3.35Å; I16-Q20 VanDerWaalsContact O-CG 3.28Å; I16-Q20 WeakPolarHBondContact O-CG 3.34Å; I16-Q20 PolarHBondContact O-N 3.4Å
17T81.4Confident81.5Confident58 Ų5873.1 Ų73.136%0.35640%0.395SS..Hα-helixtrans-60.8-42.4175.2-560000111.9N13 W14 A19 Q20 I21N13-T17 PolarHBondContact O-N 3.21Å; N13-T17 PolarHBondContact O-OG1 2.84Å; W14-T17 PolarHBondContact O-N 2.66Å; T17-A19 VanDerWaalsContact C-N 3.32Å; T17-A19 PolarHBondContact O-N 3.45Å; T17-Q20 PolarHBondContact O-N 3.46Å; T17-I21 HydrophobicContact CG2-CD1 3.99Å; T17-I21 VanDerWaalsContact O-CG1 3.27Å; T17-I21 WeakPolarHBondContact O-CG1 3.41Å; T17-I21 PolarHBondContact O-N 3.15Å
18M85.3Confident82Confident122 Ų12274.3 Ų74.360%0.60140%0.403SS*.Hα-helixtrans-61.9-39.7174-77.7-174.671.400112.1W14 M15 I16 I21 G22W14-M18 HydrophobicContact CE3-CG 4.36Å; W14-M18 HydrophobicContact CE3-SD 3.52Å; W14-M18 VanDerWaalsContact CE3-SD 3.52Å; W14-M18 HydrophobicContact CZ3-SD 3.54Å; W14-M18 VanDerWaalsContact CZ3-SD 3.54Å; W14-M18 WeakPolarHBondContact O-CB 3.43Å; W14-M18 VanDerWaalsContact O-CG 3.31Å; W14-M18 WeakPolarHBondContact O-CG 3.5Å; W14-M18 PolarHBondContact O-N 3.31Å; M15-M18 PolarHBondContact O-N 3.02Å; I16-M18 VanDerWaalsContact C-N 3.34Å; I16-M18 PolarHBondContact O-N 2.88Å; M18-I21 PolarHBondContact O-N 3.46Å; M18-G22 PolarHBondContact O-N 3.44Å
19A83.7Confident82.7Confident24 Ų2474.3 Ų74.320%0.19841%0.411CS..Hα-helixtrans-67.6-42175.400000112.5M15 I16 T17 I21 G22 A23 F156 I157M15-A19 WeakPolarHBondContact O-CB 3.46Å; M15-A19 PolarHBondContact O-N 3.26Å; I16-A19 CarbonylContact O-C 3.5Å; I16-A19 WeakPolarHBondContact O-CB 3.21Å; I16-A19 PolarHBondContact O-N 2.95Å; I16-A19 VanDerWaalsContact O-N 3.13Å; T17-A19 VanDerWaalsContact C-N 3.32Å; T17-A19 PolarHBondContact O-N 3.45Å; A19-I21 VanDerWaalsContact C-N 3.27Å; A19-I21 PolarHBondContact O-N 2.85Å; A19-G22 PolarHBondContact O-N 2.92Å; A19-A23 WeakPolarHBondContact O-CB 3.42Å; A19-A23 PolarHBondContact O-N 3.05Å; A19-F156 HydrophobicContact CB-CD1 4.03Å; A19-F156 HydrophobicContact CB-CE1 3.38Å; A19-F156 HydrophobicContact CB-CZ 4.22Å; A19-I157 HydrophobicContact CB-CG2 4.22Å
20Q81.3Confident83.2Confident28 Ų2874.3 Ų74.313%0.13141%0.411CS..Hα-helixtrans-61.5-34.9175.5-76.2171.2-33.800112.5V10 I16 T17 P24 I157V10-Q20 PolarHBondContact O-NE2 2.94Å; V10-Q20 PolarHBondContact O-OE1 3.1Å; I16-Q20 HydrophobicContact CG2-CG 4.25Å; I16-Q20 WeakPolarHBondContact O-CB 3.35Å; I16-Q20 VanDerWaalsContact O-CG 3.28Å; I16-Q20 WeakPolarHBondContact O-CG 3.34Å; I16-Q20 PolarHBondContact O-N 3.4Å; T17-Q20 PolarHBondContact O-N 3.46Å; Q20-P24 WeakPolarHBondContact O-CD 3.3Å; Q20-P24 WeakPolarHBondContact O-CG 3.37Å; Q20-I157 HydrophobicContact CG-CB 3.92Å; Q20-I157 HydrophobicContact CG-CG2 4.13Å; Q20-I157 VanDerWaalsContact CG-O 3.31Å; Q20-I157 WeakPolarHBondContact CG-O 3.27Å; Q20-I157 PolarHBondContact NE2-O 3.18Å
21I83.6Confident84.1Confident98 Ų9876.8 Ų76.850%0.50342%0.422SS..Hα-helixtrans-76.2-49.1174.1-66166.9000110.1T17 M18 A19 P24 F25T17-I21 HydrophobicContact CG2-CD1 3.99Å; T17-I21 VanDerWaalsContact O-CG1 3.27Å; T17-I21 WeakPolarHBondContact O-CG1 3.41Å; T17-I21 PolarHBondContact O-N 3.15Å; M18-I21 PolarHBondContact O-N 3.46Å; A19-I21 VanDerWaalsContact C-N 3.27Å; A19-I21 PolarHBondContact O-N 2.85Å; I21-P24 WeakPolarHBondContact O-CD 3.26Å; I21-F25 HydrophobicContact CG2-CD2 4.16Å; I21-F25 HydrophobicContact CG2-CE2 3.88Å; I21-F25 WeakPolarHBondContact O-CD2 3.28Å
22G85.8Confident85.1Confident28 Ų2871 Ų7129%0.28941%0.407SS..Hα-helixtrans-69.5-37.2-172.900000114.4M18 A19 F25 L26M18-G22 PolarHBondContact O-N 3.44Å; A19-G22 PolarHBondContact O-N 2.92Å; G22-F25 PolarHBondContact O-N 3.15Å; G22-F25 VanDerWaalsContact O-N 3.15Å; G22-L26 WeakPolarHBondContact O-CG 3.27Å; G22-L26 PolarHBondContact O-N 3.02Å
23A84.6Confident86.4Confident28 Ų2871 Ų7123%0.23139%0.393CS..Hα-helixtrans-61.8-47.1-175.900000113.2A19 F25 L26 V27 I157A19-A23 WeakPolarHBondContact O-CB 3.42Å; A19-A23 PolarHBondContact O-N 3.05Å; A23-F25 VanDerWaalsContact C-N 3.32Å; A23-F25 PolarHBondContact O-N 3.48Å; A23-L26 PolarHBondContact O-N 3.42Å; A23-V27 WeakPolarHBondContact O-CG2 3.42Å; A23-V27 PolarHBondContact O-N 2.85Å; A23-I157 HydrophobicContact CB-CD1 4.08Å; A23-I157 HydrophobicContact CB-CG2 4.26Å
24P84.7Confident87.2Confident62 Ų6271.3 Ų71.340%0.40339%0.394SS..Hα-helixtrans-55.6-42170.8-27.534.6000113.5Q20 I21 L26 V27 I28Q20-P24 WeakPolarHBondContact O-CD 3.3Å; Q20-P24 WeakPolarHBondContact O-CG 3.37Å; I21-P24 WeakPolarHBondContact O-CD 3.26Å; P24-L26 PolarHBondContact O-N 2.74Å; P24-V27 PolarHBondContact O-N 3.11Å; P24-I28 WeakPolarHBondContact O-CB 3.42Å; P24-I28 WeakPolarHBondContact O-CD1 3.23Å; P24-I28 WeakPolarHBondContact O-CG1 3.36Å; P24-I28 PolarHBondContact O-N 2.94Å
25F89.3Confident87.8Confident142 Ų14266.8 Ų66.862%0.62339%0.385SS*.Hα-helixtrans-65.4-37.2177.1-75.1-68.7000112.7I21 G22 A23 G29I21-F25 HydrophobicContact CG2-CD2 4.16Å; I21-F25 HydrophobicContact CG2-CE2 3.88Å; I21-F25 WeakPolarHBondContact O-CD2 3.28Å; G22-F25 PolarHBondContact O-N 3.15Å; G22-F25 VanDerWaalsContact O-N 3.15Å; A23-F25 VanDerWaalsContact C-N 3.32Å; A23-F25 PolarHBondContact O-N 3.48Å; F25-G29 PolarHBondContact O-N 3.41Å
26L88.2Confident88.4Confident135 Ų13574 Ų7471%0.70741%0.412SS*.Hα-helixtrans-64-43.6173.9-72.4170.6000111.5G22 A23 P24 G29 L30G22-L26 WeakPolarHBondContact O-CG 3.27Å; G22-L26 PolarHBondContact O-N 3.02Å; A23-L26 PolarHBondContact O-N 3.42Å; P24-L26 PolarHBondContact O-N 2.74Å; L26-G29 PolarHBondContact O-N 3.22Å; L26-L30 WeakPolarHBondContact O-CB 3.3Å; L26-L30 PolarHBondContact O-N 3.37Å
27V87.4Confident89.2Confident86 Ų8679.8 Ų79.852%0.52144%0.436SS..Hα-helixtrans-64.3-46.1176.91740000111A23 P24 G29 L30 I31A23-V27 WeakPolarHBondContact O-CG2 3.42Å; A23-V27 PolarHBondContact O-N 2.85Å; P24-V27 PolarHBondContact O-N 3.11Å; V27-G29 VanDerWaalsContact C-N 3.33Å; V27-G29 PolarHBondContact O-N 3.45Å; V27-L30 PolarHBondContact O-N 2.69Å; V27-I31 HydrophobicContact CG1-CD1 3.85Å; V27-I31 VanDerWaalsContact O-CG1 3.31Å; V27-I31 WeakPolarHBondContact O-CG1 3.47Å; V27-I31 PolarHBondContact O-N 2.69Å
28I90.9Very high89.8Confident104 Ų10485.5 Ų85.553%0.53346%0.457SS..Hα-helixtrans-61-43.8176-69164.8000110.4P24 L30 I31 A32P24-I28 WeakPolarHBondContact O-CB 3.42Å; P24-I28 WeakPolarHBondContact O-CD1 3.23Å; P24-I28 WeakPolarHBondContact O-CG1 3.36Å; P24-I28 PolarHBondContact O-N 2.94Å; I28-L30 PolarHBondContact O-N 2.85Å; I28-I31 PolarHBondContact O-N 3.03Å; I28-A32 VanDerWaalsContact O-CB 3.29Å; I28-A32 WeakPolarHBondContact O-CB 3.47Å; I28-A32 PolarHBondContact O-N 3.02Å
29G93Very high90.2Very high34 Ų3483 Ų8335%0.35145%0.445SS..Hα-helixtrans-59.7-45176.500000112.3F25 L26 V27 A32 V33F25-G29 PolarHBondContact O-N 3.41Å; L26-G29 PolarHBondContact O-N 3.22Å; V27-G29 VanDerWaalsContact C-N 3.33Å; V27-G29 PolarHBondContact O-N 3.45Å; G29-A32 PolarHBondContact O-N 3.24Å; G29-V33 VanDerWaalsContact O-CG2 3.32Å; G29-V33 WeakPolarHBondContact O-CG2 3.24Å; G29-V33 PolarHBondContact O-N 3.22Å
30L91.1Very high90.7Very high110 Ų11087.2 Ų87.258%0.57646%0.456SS*.Hα-helixtrans-62.6-46.3176.1-177.365.6000111.7L26 V27 I28 A32 V33 I34L26-L30 WeakPolarHBondContact O-CB 3.3Å; L26-L30 PolarHBondContact O-N 3.37Å; V27-L30 PolarHBondContact O-N 2.69Å; I28-L30 PolarHBondContact O-N 2.85Å; L30-A32 VanDerWaalsContact C-N 3.3Å; L30-A32 PolarHBondContact O-N 3.4Å; L30-V33 PolarHBondContact O-N 3.02Å; L30-I34 HydrophobicContact CD1-CD1 4.13Å; L30-I34 HydrophobicContact CD1-CG1 4.46Å; L30-I34 HydrophobicContact CG-CD1 3.9Å; L30-I34 VanDerWaalsContact O-CG1 3.26Å; L30-I34 WeakPolarHBondContact O-CG1 3.49Å; L30-I34 PolarHBondContact O-N 3.14Å
31I93.2Very high91.4Very high79 Ų7993.1 Ų93.141%0.40548%0.481SS..Hα-helixtrans-60-42.5176-71.1169000110.6V27 I28 I34 T35 W40V27-I31 HydrophobicContact CG1-CD1 3.85Å; V27-I31 VanDerWaalsContact O-CG1 3.31Å; V27-I31 WeakPolarHBondContact O-CG1 3.47Å; V27-I31 PolarHBondContact O-N 2.69Å; I28-I31 PolarHBondContact O-N 3.03Å; I31-I34 PolarHBondContact O-N 3.44Å; I31-T35 VanDerWaalsContact O-CB 3.24Å; I31-T35 WeakPolarHBondContact O-CB 3.17Å; I31-T35 PolarHBondContact O-N 3.33Å; I31-T35 PolarHBondContact O-OG1 3.35Å; I31-W40 HydrophobicContact CG2-CZ2 4.27Å
32A94.3Very high92Very high53 Ų5394.1 Ų94.144%0.43848%0.48SS..Hα-helixtrans-63.3-45.2178.100000111.4I28 G29 L30 T35 Y36I28-A32 VanDerWaalsContact O-CB 3.29Å; I28-A32 WeakPolarHBondContact O-CB 3.47Å; I28-A32 PolarHBondContact O-N 3.02Å; G29-A32 PolarHBondContact O-N 3.24Å; L30-A32 VanDerWaalsContact C-N 3.3Å; L30-A32 PolarHBondContact O-N 3.4Å; A32-T35 PolarHBondContact O-N 2.79Å; A32-Y36 WeakPolarHBondContact O-CB 3.17Å; A32-Y36 PolarHBondContact O-N 3.19Å
33V94.4Very high92.4Very high73 Ų7394.6 Ų94.644%0.44248%0.475SS..Hα-helixtrans-61-49.9176.3168.90000111.1G29 L30 T35 Y36 F37G29-V33 VanDerWaalsContact O-CG2 3.32Å; G29-V33 WeakPolarHBondContact O-CG2 3.24Å; G29-V33 PolarHBondContact O-N 3.22Å; L30-V33 PolarHBondContact O-N 3.02Å; V33-T35 VanDerWaalsContact C-N 3.27Å; V33-T35 PolarHBondContact O-N 3.34Å; V33-Y36 PolarHBondContact O-N 3.01Å; V33-F37 HydrophobicContact CG1-CD2 3.82Å; V33-F37 HydrophobicContact CG1-CE2 3.99Å; V33-F37 VanDerWaalsContact O-CD2 3.23Å; V33-F37 WeakPolarHBondContact O-CD2 3.28Å; V33-F37 PolarHBondContact O-N 3.5Å
34I93.7Very high92.9Very high24 Ų2497.5 Ų97.512%0.12348%0.481CS..Hα-helixtrans-60.1-40.9179.2-67.2169.7000110.9L30 I31 K38 L39 W40 L43L30-I34 HydrophobicContact CD1-CD1 4.13Å; L30-I34 HydrophobicContact CD1-CG1 4.46Å; L30-I34 HydrophobicContact CG-CD1 3.9Å; L30-I34 VanDerWaalsContact O-CG1 3.26Å; L30-I34 WeakPolarHBondContact O-CG1 3.49Å; L30-I34 PolarHBondContact O-N 3.14Å; I31-I34 PolarHBondContact O-N 3.44Å; I34-K38 PolarHBondContact O-N 2.68Å; I34-K38 VanDerWaalsContact O-N 3.14Å; I34-L39 HydrophobicContact CG2-CB 4.11Å; I34-L39 PolarHBondContact O-N 3.03Å; I34-W40 HydrophobicContact CB-CZ2 4.36Å; I34-W40 HydrophobicContact CG2-CD2 3.59Å; I34-W40 VanDerWaalsContact CG2-CE2 3.47Å; I34-W40 HydrophobicContact CG2-CE3 4.12Å; I34-W40 HydrophobicContact CG2-CG 3.89Å; I34-W40 HydrophobicContact CG2-CH2 4.38Å; I34-W40 HydrophobicContact CG2-CZ2 3.89Å; I34-W40 HydrophobicContact CG2-CZ3 4.48Å; I34-L43 HydrophobicContact CD1-CD1 4.1Å; I34-L43 HydrophobicContact CG1-CD1 4.25Å; I34-L43 HydrophobicContact CG2-CD1 3.79Å
35T95.3Very high93.4Very high72 Ų72100 Ų10044%0.44249%0.485SS..Hα-helixtrans-70.4-44.7179.5-56.10000111.7I31 A32 V33 F37 K38 W40I31-T35 VanDerWaalsContact O-CB 3.24Å; I31-T35 WeakPolarHBondContact O-CB 3.17Å; I31-T35 PolarHBondContact O-N 3.33Å; I31-T35 PolarHBondContact O-OG1 3.35Å; A32-T35 PolarHBondContact O-N 2.79Å; V33-T35 VanDerWaalsContact C-N 3.27Å; V33-T35 PolarHBondContact O-N 3.34Å; T35-F37 VanDerWaalsContact C-N 3.35Å; T35-F37 PolarHBondContact O-N 3.28Å; T35-K38 PolarHBondContact O-N 2.91Å; T35-W40 PolarHBondContact OG1-NE1 2.91Å
36Y95.4Very high93.7Very high188 Ų18896.4 Ų96.474%0.73747%0.471SS*.Hα-helixtrans-58.7-45.4178.7-180-98.8000111.5A32 V33 K38A32-Y36 WeakPolarHBondContact O-CB 3.17Å; A32-Y36 PolarHBondContact O-N 3.19Å; V33-Y36 PolarHBondContact O-N 3.01Å; Y36-K38 VanDerWaalsContact C-N 3.27Å; Y36-K38 PolarHBondContact O-N 2.9Å
37F95.9Very high94.1Very high127 Ų12792.5 Ų92.556%0.55745%0.446SS*.THydrogen-bonded Turntrans-83.95.8176.4-66.4-68.1000114V33 T35 L39V33-F37 HydrophobicContact CG1-CD2 3.82Å; V33-F37 HydrophobicContact CG1-CE2 3.99Å; V33-F37 VanDerWaalsContact O-CD2 3.23Å; V33-F37 WeakPolarHBondContact O-CD2 3.28Å; V33-F37 PolarHBondContact O-N 3.5Å; T35-F37 VanDerWaalsContact C-N 3.35Å; T35-F37 PolarHBondContact O-N 3.28Å; F37-L39 HydrophobicContact CB-CD1 3.88Å; F37-L39 HydrophobicContact CB-CD2 4.28Å; F37-L39 HydrophobicContact CB-CG 3.69Å; F37-L39 PolarHBondContact O-N 3.39Å
38K94.9Very high94.5Very high179 Ų17990.5 Ų90.578%0.77843%0.431SS*.THydrogen-bonded Turntrans52.934.8179.2-58.9-178.9-178.7177.20114I34 T35 Y36 W40I34-K38 PolarHBondContact O-N 2.68Å; I34-K38 VanDerWaalsContact O-N 3.14Å; T35-K38 PolarHBondContact O-N 2.91Å; Y36-K38 VanDerWaalsContact C-N 3.27Å; Y36-K38 PolarHBondContact O-N 2.9Å; K38-W40 VanDerWaalsContact C-N 3.33Å; K38-W40 PolarHBondContact O-N 2.82Å
39L94.6Very high94.8Very high68 Ų6886.1 Ų86.136%0.35641%0.409SS..THydrogen-bonded Turntrans-80.1-11.2-172.8-61.7176.9000113.6I34 F37 K41 Y42 L43I34-L39 HydrophobicContact CG2-CB 4.11Å; I34-L39 PolarHBondContact O-N 3.03Å; F37-L39 HydrophobicContact CB-CD1 3.88Å; F37-L39 HydrophobicContact CB-CD2 4.28Å; F37-L39 HydrophobicContact CB-CG 3.69Å; F37-L39 PolarHBondContact O-N 3.39Å; L39-K41 PolarHBondContact O-N 3.07Å; L39-Y42 WeakPolarHBondContact O-CB 3.24Å; L39-Y42 PolarHBondContact O-N 3.27Å; L39-Y42 VanDerWaalsContact O-N 3.07Å; L39-L43 HydrophobicContact CB-CD1 4.23Å; L39-L43 HydrophobicContact CB-CG 4.33Å; L39-L43 WeakPolarHBondContact O-CG 3.23Å; L39-L43 PolarHBondContact O-N 3.09Å
40W93.8Very high95Very high114 Ų11484.5 Ų84.543%0.43239%0.392SS..Hα-helixtrans-51.8-47.7-178-73.1113000114.1I31 I34 T35 K38 Y42 Y44I31-W40 HydrophobicContact CG2-CZ2 4.27Å; I34-W40 HydrophobicContact CB-CZ2 4.36Å; I34-W40 HydrophobicContact CG2-CD2 3.59Å; I34-W40 VanDerWaalsContact CG2-CE2 3.47Å; I34-W40 HydrophobicContact CG2-CE3 4.12Å; I34-W40 HydrophobicContact CG2-CG 3.89Å; I34-W40 HydrophobicContact CG2-CH2 4.38Å; I34-W40 HydrophobicContact CG2-CZ2 3.89Å; I34-W40 HydrophobicContact CG2-CZ3 4.48Å; T35-W40 PolarHBondContact OG1-NE1 2.91Å; K38-W40 VanDerWaalsContact C-N 3.33Å; K38-W40 PolarHBondContact O-N 2.82Å; W40-Y42 VanDerWaalsContact C-N 3.33Å; W40-Y42 PolarHBondContact O-N 3.49Å; W40-Y44 VanDerWaalsContact O-CB 3.25Å; W40-Y44 WeakPolarHBondContact O-CB 3.42Å; W40-Y44 PolarHBondContact O-N 3.25Å
41K94.8Very high95.2Very high152 Ų15279.4 Ų79.466%0.66137%0.366SS*.Hα-helixtrans-65.5-38.6-179.9-175.7178.2178.5-178.60111.7L39 K45L39-K41 PolarHBondContact O-N 3.07Å; K41-K45 HydrophobicContact CG-CD 4.3Å; K41-K45 WeakPolarHBondContact O-CB 3.35Å; K41-K45 WeakPolarHBondContact O-CG 3.42Å; K41-K45 PolarHBondContact O-N 2.98Å; K41-K45 VanDerWaalsContact O-N 3.15Å
42Y96Very high95.4Very high119 Ų11976.8 Ų76.847%0.46735%0.353SS..Hα-helixtrans-68.5-52.3177.8171.4-102.3000110.9L39 W40 Y44 K45 E46 W47L39-Y42 WeakPolarHBondContact O-CB 3.24Å; L39-Y42 PolarHBondContact O-N 3.27Å; L39-Y42 VanDerWaalsContact O-N 3.07Å; W40-Y42 VanDerWaalsContact C-N 3.33Å; W40-Y42 PolarHBondContact O-N 3.49Å; Y42-Y44 VanDerWaalsContact C-N 3.34Å; Y42-Y44 PolarHBondContact O-N 3.37Å; Y42-K45 PolarHBondContact O-N 3.11Å; Y42-E46 HydrophobicContact CD2-CB 4.08Å; Y42-E46 HydrophobicContact CD2-CG 3.69Å; Y42-E46 HydrophobicContact CE2-CB 3.86Å; Y42-E46 HydrophobicContact CE2-CG 3.63Å; Y42-E46 VanDerWaalsContact O-CB 3.25Å; Y42-E46 WeakPolarHBondContact O-CB 3.39Å; Y42-E46 PolarHBondContact O-N 3.42Å; Y42-W47 AromaticContact CE1-CD1 3.67Å; Y42-W47 AromaticContact CE1-NE1 3.3Å; Y42-W47 VanDerWaalsContact CE1-NE1 3.3Å; Y42-W47 AromaticContact CZ-CD1 3.98Å; Y42-W47 AromaticContact CZ-NE1 3.39Å; Y42-W47 PolarHBondContact OH-NE1 3.41Å; Y42-W47 VanDerWaalsContact OH-NE1 3.09Å
43L95.6Very high95.6Very high37 Ų3774.3 Ų74.319%0.19433%0.332CS..Hα-helixtrans-57.3-47178.6-70.4173.9000111.7I34 L39 W47 F48I34-L43 HydrophobicContact CD1-CD1 4.1Å; I34-L43 HydrophobicContact CG1-CD1 4.25Å; I34-L43 HydrophobicContact CG2-CD1 3.79Å; L39-L43 HydrophobicContact CB-CD1 4.23Å; L39-L43 HydrophobicContact CB-CG 4.33Å; L39-L43 WeakPolarHBondContact O-CG 3.23Å; L39-L43 PolarHBondContact O-N 3.09Å; L43-W47 CarbonylContact O-C 3.56Å; L43-W47 WeakPolarHBondContact O-CA 3.49Å; L43-W47 WeakPolarHBondContact O-CB 3.41Å; L43-W47 PolarHBondContact O-N 2.99Å; L43-F48 HydrophobicContact CB-CE1 4.29Å; L43-F48 HydrophobicContact CB-CE2 4.11Å; L43-F48 HydrophobicContact CB-CZ 3.94Å; L43-F48 HydrophobicContact CD1-CZ 4.41Å; L43-F48 PolarHBondContact O-N 3.17Å
44Y95.6Very high95.8Very high90 Ų9071.7 Ų71.735%0.35332%0.315SS..Iπ-helixtrans-60.7-53.1179.5-172.8-101.7000111.4W40 Y42 F48 T49 F590W40-Y44 VanDerWaalsContact O-CB 3.25Å; W40-Y44 WeakPolarHBondContact O-CB 3.42Å; W40-Y44 PolarHBondContact O-N 3.25Å; Y42-Y44 VanDerWaalsContact C-N 3.34Å; Y42-Y44 PolarHBondContact O-N 3.37Å; Y44-F48 HydrophobicContact CD2-CD2 4.27Å; Y44-T49 HydrophobicContact CD1-CG2 4.41Å; Y44-T49 HydrophobicContact CE1-CG2 4.1Å; Y44-T49 HydrophobicContact CE2-CG2 4.32Å; Y44-T49 WeakPolarHBondContact O-CG2 3.4Å; Y44-T49 PolarHBondContact O-N 3.35Å; Y44-T49 VanDerWaalsContact O-N 3.13Å; Y44-T49 PolarHBondContact O-OG1 2.94Å; Y44-F590 HydrophobicContact CD2-CE1 4.49Å; Y44-F590 HydrophobicContact CE2-CD1 4.11Å; Y44-F590 HydrophobicContact CE2-CE1 4.1Å
45K94.8Very high95.9Very high114 Ų11472.4 Ų72.450%0.49632%0.317SS..Iπ-helixtrans-72.5-41-175.4-70-170.7174.2-155.60114K41 Y42 T49 N585K41-K45 HydrophobicContact CG-CD 4.3Å; K41-K45 WeakPolarHBondContact O-CB 3.35Å; K41-K45 WeakPolarHBondContact O-CG 3.42Å; K41-K45 PolarHBondContact O-N 2.98Å; K41-K45 VanDerWaalsContact O-N 3.15Å; Y42-K45 PolarHBondContact O-N 3.11Å; K45-T49 PolarHBondContact O-OG1 2.94Å; K45-N585 PolarHBondContact O-ND2 3.19Å
46E94.6Very high96Very high67 Ų6769 Ų6931%0.31330%0.296SS..Iπ-helixtrans-96-23.6-169.4-69.1-62.8143.100114Y42 S50 K55Y42-E46 HydrophobicContact CD2-CB 4.08Å; Y42-E46 HydrophobicContact CD2-CG 3.69Å; Y42-E46 HydrophobicContact CE2-CB 3.86Å; Y42-E46 HydrophobicContact CE2-CG 3.63Å; Y42-E46 VanDerWaalsContact O-CB 3.25Å; Y42-E46 WeakPolarHBondContact O-CB 3.39Å; Y42-E46 PolarHBondContact O-N 3.42Å; E46-S50 WeakPolarHBondContact O-CB 3.45Å; E46-K55 VanDerWaalsContact O-CD 3.3Å; E46-K55 WeakPolarHBondContact O-CD 3.25Å; E46-K55 PolarHBondContact O-NZ 3.39Å; E46-K55 IonicContact OE2-NZ 2.75Å; E46-K55 PolarHBondContact OE2-NZ 2.86Å
47W96.4Very high96.2Very high53 Ų5360 Ų6020%0.20126%0.26CS..Iπ-helixtrans-120.3-57.1-174.2-67.188.1000111.7Y42 L43 T49 S50 K55 I58 M59Y42-W47 AromaticContact CE1-CD1 3.67Å; Y42-W47 AromaticContact CE1-NE1 3.3Å; Y42-W47 VanDerWaalsContact CE1-NE1 3.3Å; Y42-W47 AromaticContact CZ-CD1 3.98Å; Y42-W47 AromaticContact CZ-NE1 3.39Å; Y42-W47 PolarHBondContact OH-NE1 3.41Å; Y42-W47 VanDerWaalsContact OH-NE1 3.09Å; L43-W47 CarbonylContact O-C 3.56Å; L43-W47 WeakPolarHBondContact O-CA 3.49Å; L43-W47 WeakPolarHBondContact O-CB 3.41Å; L43-W47 PolarHBondContact O-N 2.99Å; W47-T49 PolarHBondContact O-N 2.75Å; W47-S50 VanDerWaalsContact O-CB 3.25Å; W47-S50 WeakPolarHBondContact O-CB 3.25Å; W47-S50 PolarHBondContact O-N 3.01Å; W47-S50 VanDerWaalsContact O-N 3.1Å; W47-K55 HydrophobicContact CE3-CB 4.32Å; W47-K55 HydrophobicContact CZ3-CB 4.23Å; W47-K55 HydrophobicContact CZ3-CG 4.35Å; W47-I58 HydrophobicContact CH2-CG2 4.09Å; W47-I58 HydrophobicContact CZ3-CB 4.21Å; W47-I58 HydrophobicContact CZ3-CG2 3.89Å; W47-M59 HydrophobicContact CB-SD 4.36Å; W47-M59 HydrophobicContact CE3-CG 3.86Å; W47-M59 HydrophobicContact CE3-SD 4.25Å; W47-M59 HydrophobicContact CZ3-CG 4.27Å
48F96.4Very high96.2Very high44 Ų4455.2 Ų55.219%0.19324%0.24CC..Iπ-helixtrans-66.7-39.3-172.1-58.7-17.2000113L43 Y44 S50 N139 W143 F590L43-F48 HydrophobicContact CB-CE1 4.29Å; L43-F48 HydrophobicContact CB-CE2 4.11Å; L43-F48 HydrophobicContact CB-CZ 3.94Å; L43-F48 HydrophobicContact CD1-CZ 4.41Å; L43-F48 PolarHBondContact O-N 3.17Å; Y44-F48 HydrophobicContact CD2-CD2 4.27Å; F48-S50 VanDerWaalsContact C-N 3.35Å; F48-N139 PolarHBondContact O-ND2 2.81Å; F48-W143 HydrophobicContact CB-CH2 4.47Å; F48-W143 HydrophobicContact CB-CZ2 3.77Å; F48-W143 AromaticContact CD1-CH2 3.86Å; F48-W143 HydrophobicContact CD1-CH2 3.86Å; F48-W143 AromaticContact CD1-CZ2 3.78Å; F48-W143 HydrophobicContact CD1-CZ2 3.78Å; F48-W143 HydrophobicContact CE1-CH2 4.31Å; F48-W143 HydrophobicContact CG-CH2 4.18Å; F48-W143 AromaticContact CG-CZ2 3.93Å; F48-W143 HydrophobicContact CG-CZ2 3.93Å; F48-W143 PolarHBondContact O-NE1 3.18Å; F48-W143 VanDerWaalsContact O-NE1 3.08Å; F48-F590 HydrophobicContact CB-CD2 4.17Å; F48-F590 HydrophobicContact CB-CE2 4.47Å; F48-F590 HydrophobicContact CD2-CD2 4.46Å; F48-F590 AromaticContact CD2-CE2 3.94Å; F48-F590 HydrophobicContact CD2-CE2 3.94Å; F48-F590 HydrophobicContact CD2-CZ 4.18Å; F48-F590 HydrophobicContact CE2-CE2 4.43Å; F48-F590 HydrophobicContact CG-CD2 4.42Å; F48-F590 HydrophobicContact CG-CE2 4.28Å
49T97Very high96.4Very high11 Ų1147.5 Ų47.57%0.06721%0.207CC..THydrogen-bonded Turntrans-89.82.9176.163.40000113.9Y44 K45 W47 N585 T586 P587Y44-T49 HydrophobicContact CD1-CG2 4.41Å; Y44-T49 HydrophobicContact CE1-CG2 4.1Å; Y44-T49 HydrophobicContact CE2-CG2 4.32Å; Y44-T49 WeakPolarHBondContact O-CG2 3.4Å; Y44-T49 PolarHBondContact O-N 3.35Å; Y44-T49 VanDerWaalsContact O-N 3.13Å; Y44-T49 PolarHBondContact O-OG1 2.94Å; K45-T49 PolarHBondContact O-OG1 2.94Å; W47-T49 PolarHBondContact O-N 2.75Å; T49-N585 CarbonylContact O-C 3.59Å; T49-N585 WeakPolarHBondContact O-CA 3.33Å; T49-N585 WeakPolarHBondContact O-CB 3.41Å; T49-T586 WeakPolarHBondContact CA-O 3.3Å; T49-T586 WeakPolarHBondContact CB-O 3.38Å; T49-T586 PolarHBondContact O-N 2.95Å; T49-P587 HydrophobicContact CG2-CB 3.92Å
50S96.8Very high96.6Very high1 Ų144.3 Ų44.31%0.00719%0.19CC..  trans-66.2137.6-174.2-175.10000111.8E46 W47 F48 D52 K55 I56 N139E46-S50 WeakPolarHBondContact O-CB 3.45Å; W47-S50 VanDerWaalsContact O-CB 3.25Å; W47-S50 WeakPolarHBondContact O-CB 3.25Å; W47-S50 PolarHBondContact O-N 3.01Å; W47-S50 VanDerWaalsContact O-N 3.1Å; F48-S50 VanDerWaalsContact C-N 3.35Å; S50-D52 PolarHBondContact OG-N 2.84Å; S50-K55 VanDerWaalsContact OG-CD 3.32Å; S50-K55 WeakPolarHBondContact OG-CD 3.37Å; S50-I56 WeakPolarHBondContact O-CD1 3.34Å; S50-N139 PolarHBondContact O-ND2 2.86Å
51V96.9Very high96.7Very high3 Ų339.2 Ų39.22%0.01817%0.172CC..  trans-104.4-11.4170-66.30000113.1H53 P135 P583 N584 T586V51-H53 PolarHBondContact O-N 3.04Å; V51-H53 VanDerWaalsContact O-N 3.16Å; V51-P135 HydrophobicContact CB-CB 3.82Å; V51-P135 HydrophobicContact CG1-CB 4.47Å; V51-P135 HydrophobicContact CG2-CB 4.44Å; V51-P583 HydrophobicContact CG2-CB 3.99Å; V51-P583 HydrophobicContact CG2-CG 3.75Å; V51-N584 WeakPolarHBondContact CG1-O 3.45Å; V51-N584 WeakPolarHBondContact CG2-O 3.34Å; V51-T586 HydrophobicContact CG1-CG2 3.69Å
52D97Very high96.8Very high24 Ų2436.5 Ų36.513%0.12816%0.163CC..  trans-60.2115.5177.8-176.4-13.4000111S50 K54 K55 I56S50-D52 PolarHBondContact OG-N 2.84Å; D52-K54 VanDerWaalsContact CG-NZ 3.33Å; D52-K54 PolarHBondContact O-N 3.13Å; D52-K54 VanDerWaalsContact O-N 3.1Å; D52-K54 WeakPolarHBondContact OD1-CB 3.38Å; D52-K54 WeakPolarHBondContact OD1-CE 3.3Å; D52-K54 PolarHBondContact OD1-N 3.24Å; D52-K54 IonicContact OD1-NZ 3.11Å; D52-K54 PolarHBondContact OD1-NZ 3.38Å; D52-K54 WeakPolarHBondContact OD2-CE 3.37Å; D52-K54 IonicContact OD2-NZ 3.52Å; D52-K54 PolarHBondContact OD2-NZ 2.99Å; D52-K55 HydrophobicContact CB-CB 4.43Å; D52-K55 HydrophobicContact CB-CD 4.39Å; D52-K55 HydrophobicContact CB-CG 4.41Å; D52-K55 PolarHBondContact O-N 2.8Å; D52-I56 PolarHBondContact O-N 2.66Å
53H97.9Very high96.9Very high0 Ų031.1 Ų31.10%014%0.143CC..Hα-helixtrans-49.3-35177.369.699.9000113.4V51 G57 N120 P124 D131 V132 N548V51-H53 PolarHBondContact O-N 3.04Å; V51-H53 VanDerWaalsContact O-N 3.16Å; H53-G57 PolarHBondContact O-N 3.5Å; H53-N120 PolarHBondContact ND1-O 2.86Å; H53-N120 WeakPolarHBondContact O-CB 3.45Å; H53-P124 HydrophobicContact CB-CG 4.35Å; H53-D131 WeakPolarHBondContact CB-OD1 3.4Å; H53-D131 IonicContact CD2-OD1 3.7Å; H53-D131 PolarHBondContact CD2-OD1 3Å; H53-D131 VanDerWaalsContact CD2-OD1 3.29Å; H53-D131 IonicContact CG-OD1 4Å; H53-D131 PolarHBondContact N-OD1 3.47Å; H53-V132 HydrophobicContact CB-CG1 4.1Å; H53-N548 PolarHBondContact NE2-ND2 2.92Å; H53-N548 PolarHBondContact NE2-OD1 2.95Å
54K97.6Very high97Very high19 Ų1929.4 Ų29.48%0.08313%0.134CC..Hα-helixtrans-63.6-47.6178.7-63176.6-67.5-59.40111D52 G57 I58 P544 K546 N548D52-K54 VanDerWaalsContact CG-NZ 3.33Å; D52-K54 PolarHBondContact O-N 3.13Å; D52-K54 VanDerWaalsContact O-N 3.1Å; D52-K54 WeakPolarHBondContact OD1-CB 3.38Å; D52-K54 WeakPolarHBondContact OD1-CE 3.3Å; D52-K54 PolarHBondContact OD1-N 3.24Å; D52-K54 IonicContact OD1-NZ 3.11Å; D52-K54 PolarHBondContact OD1-NZ 3.38Å; D52-K54 WeakPolarHBondContact OD2-CE 3.37Å; D52-K54 IonicContact OD2-NZ 3.52Å; D52-K54 PolarHBondContact OD2-NZ 2.99Å; K54-G57 PolarHBondContact O-N 3.04Å; K54-I58 WeakPolarHBondContact O-CG1 3.41Å; K54-I58 PolarHBondContact O-N 3.29Å; K54-P544 HydrophobicContact CD-CB 4.27Å; K54-P544 HydrophobicContact CD-CG 4.49Å; K54-K546 PolarHBondContact NZ-O 2.8Å; K54-N548 PolarHBondContact NZ-OD1 3.04Å
55K97.2Very high96.9Very high38 Ų3827 Ų2717%0.16513%0.129CC..Hα-helixtrans-69.3-42-180-70.5-179.7171.8-1780111.8E46 W47 S50 D52 G57 I58 M59E46-K55 VanDerWaalsContact O-CD 3.3Å; E46-K55 WeakPolarHBondContact O-CD 3.25Å; E46-K55 PolarHBondContact O-NZ 3.39Å; E46-K55 IonicContact OE2-NZ 2.75Å; E46-K55 PolarHBondContact OE2-NZ 2.86Å; W47-K55 HydrophobicContact CE3-CB 4.32Å; W47-K55 HydrophobicContact CZ3-CB 4.23Å; W47-K55 HydrophobicContact CZ3-CG 4.35Å; S50-K55 VanDerWaalsContact OG-CD 3.32Å; S50-K55 WeakPolarHBondContact OG-CD 3.37Å; D52-K55 HydrophobicContact CB-CB 4.43Å; D52-K55 HydrophobicContact CB-CD 4.39Å; D52-K55 HydrophobicContact CB-CG 4.41Å; D52-K55 PolarHBondContact O-N 2.8Å; K55-G57 VanDerWaalsContact C-N 3.29Å; K55-G57 PolarHBondContact O-N 3.12Å; K55-I58 PolarHBondContact O-N 3.46Å; K55-M59 WeakPolarHBondContact O-CG 3.21Å; K55-M59 PolarHBondContact O-N 3.34Å
56I97.9Very high96.9Very high0 Ų026.5 Ų26.50%013%0.131CC..Hα-helixtrans-57.2-46.1173.3-64.6-58.9000110.3S50 D52 I58 M59 Y60 N139 F142S50-I56 WeakPolarHBondContact O-CD1 3.34Å; D52-I56 PolarHBondContact O-N 2.66Å; I56-I58 PolarHBondContact O-N 3.18Å; I56-M59 HydrophobicContact CD1-CE 3.46Å; I56-M59 VanDerWaalsContact CD1-CE 3.46Å; I56-M59 PolarHBondContact O-N 2.79Å; I56-Y60 HydrophobicContact CG2-CD2 3.76Å; I56-Y60 HydrophobicContact CG2-CE2 3.7Å; I56-Y60 WeakPolarHBondContact O-CD2 3.43Å; I56-Y60 PolarHBondContact O-N 3.21Å; I56-N139 HydrophobicContact CD1-CB 4.41Å; I56-F142 HydrophobicContact CG2-CB 4.05Å
57G97.9Very high97.1Very high0 Ų024.1 Ų24.10%012%0.12CC..Hα-helixtrans-64-39.9178.500000113.6H53 K54 K55 M59 Y60 L61H53-G57 PolarHBondContact O-N 3.5Å; K54-G57 PolarHBondContact O-N 3.04Å; K55-G57 VanDerWaalsContact C-N 3.29Å; K55-G57 PolarHBondContact O-N 3.12Å; G57-M59 VanDerWaalsContact C-N 3.34Å; G57-M59 PolarHBondContact O-N 3.38Å; G57-Y60 WeakPolarHBondContact O-CB 3.12Å; G57-Y60 PolarHBondContact O-N 2.95Å; G57-L61 WeakPolarHBondContact O-CG 3.36Å; G57-L61 PolarHBondContact O-N 3.13Å
58I97.5Very high97Very high26 Ų2622.6 Ų22.613%0.13312%0.115CC..Hα-helixtrans-60.3-43.6172.8-69.8167000111W47 K54 K55 I56 Y60 L61 I62 I121 M438W47-I58 HydrophobicContact CH2-CG2 4.09Å; W47-I58 HydrophobicContact CZ3-CB 4.21Å; W47-I58 HydrophobicContact CZ3-CG2 3.89Å; K54-I58 WeakPolarHBondContact O-CG1 3.41Å; K54-I58 PolarHBondContact O-N 3.29Å; K55-I58 PolarHBondContact O-N 3.46Å; I56-I58 PolarHBondContact O-N 3.18Å; I58-Y60 PolarHBondContact O-N 2.85Å; I58-L61 PolarHBondContact O-N 3.48Å; I58-I62 HydrophobicContact CG2-CD1 3.82Å; I58-I62 HydrophobicContact CG2-CG1 4.37Å; I58-I62 WeakPolarHBondContact O-CG1 3.43Å; I58-I62 PolarHBondContact O-N 2.97Å; I58-I121 HydrophobicContact CG1-CD1 4.2Å; I58-M438 HydrophobicContact CD1-CB 4.36Å; I58-M438 HydrophobicContact CG1-CB 4.33Å; I58-M438 HydrophobicContact CG1-CG 4.34Å
59M97.9Very high97Very high17 Ų1723.3 Ų23.38%0.08412%0.123CC..Hα-helixtrans-63.3-41177.6-66.4-170-63.800112.1W47 K55 I56 G57 I62 C63 F142W47-M59 HydrophobicContact CB-SD 4.36Å; W47-M59 HydrophobicContact CE3-CG 3.86Å; W47-M59 HydrophobicContact CE3-SD 4.25Å; W47-M59 HydrophobicContact CZ3-CG 4.27Å; K55-M59 WeakPolarHBondContact O-CG 3.21Å; K55-M59 PolarHBondContact O-N 3.34Å; I56-M59 HydrophobicContact CD1-CE 3.46Å; I56-M59 VanDerWaalsContact CD1-CE 3.46Å; I56-M59 PolarHBondContact O-N 2.79Å; G57-M59 VanDerWaalsContact C-N 3.34Å; G57-M59 PolarHBondContact O-N 3.38Å; M59-I62 PolarHBondContact O-N 3.27Å; M59-C63 PolarHBondContact O-N 2.98Å; M59-C63 PolarHBondContact O-SG 2.94Å; M59-F142 HydrophobicContact CB-CD2 4.23Å; M59-F142 HydrophobicContact CB-CE1 4.11Å; M59-F142 HydrophobicContact CB-CE2 3.51Å; M59-F142 HydrophobicContact CB-CZ 3.45Å; M59-F142 VanDerWaalsContact CB-CZ 3.45Å; M59-F142 HydrophobicContact CE-CD1 3.84Å; M59-F142 HydrophobicContact CE-CE1 3.81Å; M59-F142 HydrophobicContact CE-CG 4.34Å; M59-F142 HydrophobicContact CE-CZ 4.31Å; M59-F142 HydrophobicContact CG-CZ 4.36Å; M59-F142 HydrophobicContact SD-CE1 3.95Å; M59-F142 HydrophobicContact SD-CZ 4.19Å
60Y98.3Very high96.8Very high1 Ų124.6 Ų24.60%0.00413%0.126CC..Hα-helixtrans-57.6-47172-91.5-65.5000112.1I56 G57 I58 C63 A64 P113 S141 F142 F145I56-Y60 HydrophobicContact CG2-CD2 3.76Å; I56-Y60 HydrophobicContact CG2-CE2 3.7Å; I56-Y60 WeakPolarHBondContact O-CD2 3.43Å; I56-Y60 PolarHBondContact O-N 3.21Å; G57-Y60 WeakPolarHBondContact O-CB 3.12Å; G57-Y60 PolarHBondContact O-N 2.95Å; I58-Y60 PolarHBondContact O-N 2.85Å; Y60-C63 PolarHBondContact O-N 3.2Å; Y60-A64 WeakPolarHBondContact O-CB 3.2Å; Y60-A64 PolarHBondContact O-N 3.08Å; Y60-P113 HydrophobicContact CD1-CB 3.63Å; Y60-P113 HydrophobicContact CE1-CB 4.27Å; Y60-S141 VanDerWaalsContact OH-C 3.3Å; Y60-S141 PolarHBondContact OH-O 3.4Å; Y60-F142 AromaticContact CD1-CD2 3.95Å; Y60-F142 HydrophobicContact CD1-CD2 3.95Å; Y60-F142 HydrophobicContact CD1-CE2 4.41Å; Y60-F142 HydrophobicContact CD2-CB 4.49Å; Y60-F142 AromaticContact CD2-CD2 3.73Å; Y60-F142 HydrophobicContact CD2-CD2 3.73Å; Y60-F142 HydrophobicContact CE1-CD2 4.01Å; Y60-F142 HydrophobicContact CE2-CB 3.79Å; Y60-F142 AromaticContact CE2-CD2 3.78Å; Y60-F142 HydrophobicContact CE2-CD2 3.78Å; Y60-F142 HydrophobicContact CE2-CG 4.28Å; Y60-F142 AromaticContact CG-CD2 3.82Å; Y60-F142 HydrophobicContact CG-CD2 3.82Å; Y60-F142 HydrophobicContact CG-CE2 4.32Å; Y60-F142 AromaticContact CZ-CD2 3.93Å; Y60-F142 VanDerWaalsContact OH-CA 3.26Å; Y60-F142 WeakPolarHBondContact OH-CA 3.24Å; Y60-F142 PolarHBondContact OH-N 3.27Å; Y60-F145 AromaticContact CD1-CD1 3.73Å; Y60-F145 HydrophobicContact CD1-CD1 3.73Å; Y60-F145 AromaticContact CD1-CE1 3.87Å; Y60-F145 HydrophobicContact CD1-CE1 3.87Å; Y60-F145 HydrophobicContact CD1-CG 4.34Å; Y60-F145 HydrophobicContact CE1-CB 4.01Å; Y60-F145 AromaticContact CE1-CD1 3.43Å; Y60-F145 HydrophobicContact CE1-CD1 3.43Å; Y60-F145 VanDerWaalsContact CE1-CD1 3.43Å; Y60-F145 HydrophobicContact CE1-CD2 4.5Å; Y60-F145 HydrophobicContact CE1-CE1 4.05Å; Y60-F145 AromaticContact CE1-CG 3.7Å; Y60-F145 HydrophobicContact CE1-CG 3.7Å
61L97.4Very high96.8Very high8 Ų824.6 Ų24.64%0.04213%0.126CC..Hα-helixtrans-64.9-40.4179.2-69.8178.6000112.7G57 I58 C63 A64 V65 F114 L118 I121 L431 M438G57-L61 WeakPolarHBondContact O-CG 3.36Å; G57-L61 PolarHBondContact O-N 3.13Å; I58-L61 PolarHBondContact O-N 3.48Å; L61-C63 VanDerWaalsContact C-N 3.33Å; L61-C63 PolarHBondContact O-N 3.5Å; L61-A64 PolarHBondContact O-N 2.78Å; L61-V65 WeakPolarHBondContact O-CB 3.36Å; L61-V65 VanDerWaalsContact O-CG2 3.31Å; L61-V65 WeakPolarHBondContact O-CG2 3.22Å; L61-V65 PolarHBondContact O-N 3.4Å; L61-F114 HydrophobicContact CD2-CD1 3.54Å; L61-F114 HydrophobicContact CD2-CE1 3.67Å; L61-F114 HydrophobicContact CD2-CG 4.01Å; L61-F114 HydrophobicContact CD2-CZ 4.27Å; L61-F114 WeakPolarHBondContact CD2-O 3.48Å; L61-L118 HydrophobicContact CD1-CD2 4.29Å; L61-L118 HydrophobicContact CD2-CD2 4.31Å; L61-L118 HydrophobicContact CD2-CG 4.25Å; L61-I121 HydrophobicContact CD1-CD1 3.45Å; L61-I121 VanDerWaalsContact CD1-CD1 3.45Å; L61-I121 HydrophobicContact CG-CD1 4.32Å; L61-L431 HydrophobicContact CD1-CD1 4.44Å; L61-M438 HydrophobicContact CD1-CE 4.12Å; L61-M438 HydrophobicContact CD1-SD 3.27Å; L61-M438 WeakPolarHBondContact CD1-SD 3.26Å
62I96.2Very high96.8Very high94 Ų9425.8 Ų25.848%0.48214%0.139SC..Hα-helixtrans-59-47.9174.7-69.3166.3000109.9I58 M59 A64 V65 L66I58-I62 HydrophobicContact CG2-CD1 3.82Å; I58-I62 HydrophobicContact CG2-CG1 4.37Å; I58-I62 WeakPolarHBondContact O-CG1 3.43Å; I58-I62 PolarHBondContact O-N 2.97Å; M59-I62 PolarHBondContact O-N 3.27Å; I62-A64 PolarHBondContact O-N 3.32Å; I62-V65 PolarHBondContact O-N 3.47Å; I62-L66 HydrophobicContact CG2-CD1 4.1Å; I62-L66 VanDerWaalsContact O-CG 3.31Å; I62-L66 WeakPolarHBondContact O-CG 3.48Å; I62-L66 PolarHBondContact O-N 2.86Å
63C97.4Very high96.7Very high7 Ų728.9 Ų28.95%0.04716%0.155CC..Hα-helixtrans-60.4-47177.1-640000111.2M59 Y60 L61 V65 L66 M67 F145 M149M59-C63 PolarHBondContact O-N 2.98Å; M59-C63 PolarHBondContact O-SG 2.94Å; Y60-C63 PolarHBondContact O-N 3.2Å; L61-C63 VanDerWaalsContact C-N 3.33Å; L61-C63 PolarHBondContact O-N 3.5Å; C63-V65 PolarHBondContact O-N 2.81Å; C63-L66 PolarHBondContact O-N 3.24Å; C63-M67 WeakPolarHBondContact O-CB 3.49Å; C63-M67 VanDerWaalsContact O-CG 3.28Å; C63-M67 WeakPolarHBondContact O-CG 3.48Å; C63-M67 PolarHBondContact O-N 3.44Å; C63-F145 HydrophobicContact CB-CE1 3.71Å; C63-F145 HydrophobicContact CB-CZ 3.88Å; C63-M149 HydrophobicContact CB-CE 4.3Å; C63-M149 HydrophobicContact CB-SD 3.86Å
64A97.6Very high96.6Very high0 Ų029.2 Ų29.20%016%0.156CC..Hα-helixtrans-61.3-41.218000000112.5Y60 L61 I62 M67 F68 P113 F114Y60-A64 WeakPolarHBondContact O-CB 3.2Å; Y60-A64 PolarHBondContact O-N 3.08Å; L61-A64 PolarHBondContact O-N 2.78Å; I62-A64 PolarHBondContact O-N 3.32Å; A64-M67 PolarHBondContact O-N 3.3Å; A64-F68 WeakPolarHBondContact O-CB 3.49Å; A64-F68 PolarHBondContact O-N 3.3Å; A64-P113 HydrophobicContact CB-CB 4.34Å; A64-P113 HydrophobicContact CB-CG 4.15Å; A64-F114 HydrophobicContact CB-CB 3.8Å; A64-F114 HydrophobicContact CB-CD2 3.75Å; A64-F114 HydrophobicContact CB-CG 4.11Å
65V95Very high96.6Very high40 Ų4029.7 Ų29.724%0.24216%0.164CC..Hα-helixtrans-65.3-43.1176171.20000111.2L61 I62 C63 M67 F68 V69 F114 F505L61-V65 WeakPolarHBondContact O-CB 3.36Å; L61-V65 VanDerWaalsContact O-CG2 3.31Å; L61-V65 WeakPolarHBondContact O-CG2 3.22Å; L61-V65 PolarHBondContact O-N 3.4Å; I62-V65 PolarHBondContact O-N 3.47Å; C63-V65 PolarHBondContact O-N 2.81Å; V65-M67 VanDerWaalsContact C-N 3.33Å; V65-M67 PolarHBondContact O-N 2.98Å; V65-F68 WeakPolarHBondContact O-CB 3.5Å; V65-F68 PolarHBondContact O-N 3.21Å; V65-V69 VanDerWaalsContact O-CG2 3.31Å; V65-V69 WeakPolarHBondContact O-CG2 3.29Å; V65-V69 PolarHBondContact O-N 2.75Å; V65-F114 HydrophobicContact CG2-CE2 4.21Å; V65-F505 HydrophobicContact CG1-CZ 4.41Å
66L95Very high96.6Very high103 Ų10330.5 Ų30.554%0.53917%0.17SC..Hα-helixtrans-61.9-41.7175.4-69.2172.1000111.8I62 C63 F68 V69 R70I62-L66 HydrophobicContact CG2-CD1 4.1Å; I62-L66 VanDerWaalsContact O-CG 3.31Å; I62-L66 WeakPolarHBondContact O-CG 3.48Å; I62-L66 PolarHBondContact O-N 2.86Å; C63-L66 PolarHBondContact O-N 3.24Å; L66-F68 VanDerWaalsContact C-N 3.33Å; L66-V69 PolarHBondContact O-N 2.92Å; L66-R70 PolarHBondContact O-N 2.95Å
67M97.1Very high96.5Very high18 Ų1831.9 Ų31.99%0.08918%0.177CC..Hα-helixtrans-69.4-32.1176.4-68.9-57.7102.400112.2C63 A64 V65 R70 G71 I105 F109 M110 M149 N153C63-M67 WeakPolarHBondContact O-CB 3.49Å; C63-M67 VanDerWaalsContact O-CG 3.28Å; C63-M67 WeakPolarHBondContact O-CG 3.48Å; C63-M67 PolarHBondContact O-N 3.44Å; A64-M67 PolarHBondContact O-N 3.3Å; V65-M67 VanDerWaalsContact C-N 3.33Å; V65-M67 PolarHBondContact O-N 2.98Å; M67-R70 PolarHBondContact O-N 3.48Å; M67-G71 PolarHBondContact O-N 3.43Å; M67-I105 HydrophobicContact CB-CG2 4.03Å; M67-I105 VanDerWaalsContact O-CG2 3.23Å; M67-I105 WeakPolarHBondContact O-CG2 3.4Å; M67-I105 HydrophobicContact SD-CD1 3.92Å; M67-I105 HydrophobicContact SD-CG2 4.5Å; M67-F109 HydrophobicContact CB-CB 4.46Å; M67-F109 WeakPolarHBondContact CB-O 3.2Å; M67-F109 HydrophobicContact CG-CB 4.01Å; M67-F109 VanDerWaalsContact CG-O 3.25Å; M67-F109 WeakPolarHBondContact CG-O 3.38Å; M67-F109 HydrophobicContact SD-CB 4.36Å; M67-M110 HydrophobicContact CB-CB 4.17Å; M67-M149 HydrophobicContact CE-CG 4.39Å; M67-M149 HydrophobicContact CE-SD 4.11Å; M67-M149 HydrophobicContact CG-CG 4.12Å; M67-M149 HydrophobicContact CG-SD 3.69Å; M67-M149 HydrophobicContact SD-CG 3.8Å; M67-M149 HydrophobicContact SD-SD 3.97Å; M67-N153 PolarHBondContact SD-ND2 2.82Å
68F96.2Very high96.4Very high21 Ų2132.9 Ų32.99%0.09218%0.182CC..Hα-helixtrans-63-42.3171.1-170.3-99.3000111.6A64 V65 L66 G72 M106 M110 V424 F455 F505A64-F68 WeakPolarHBondContact O-CB 3.49Å; A64-F68 PolarHBondContact O-N 3.3Å; V65-F68 WeakPolarHBondContact O-CB 3.5Å; V65-F68 PolarHBondContact O-N 3.21Å; L66-F68 VanDerWaalsContact C-N 3.33Å; F68-G72 PolarHBondContact O-N 3.43Å; F68-M106 HydrophobicContact CD2-CE 3.9Å; F68-M106 HydrophobicContact CD2-SD 4.44Å; F68-M106 HydrophobicContact CE2-CE 3.85Å; F68-M110 HydrophobicContact CB-CG 3.72Å; F68-M110 HydrophobicContact CD2-CE 3.83Å; F68-M110 HydrophobicContact CD2-CG 3.82Å; F68-M110 HydrophobicContact CD2-SD 3.81Å; F68-M110 HydrophobicContact CE2-CE 4.23Å; F68-M110 HydrophobicContact CG-CG 4.28Å; F68-V424 HydrophobicContact CE2-CG1 3.61Å; F68-V424 HydrophobicContact CE2-CG2 4.36Å; F68-V424 HydrophobicContact CZ-CG1 3.87Å; F68-F455 HydrophobicContact CZ-CE2 4.19Å; F68-F455 HydrophobicContact CZ-CZ 4.04Å; F68-F505 AromaticContact CD1-CD2 3.62Å; F68-F505 HydrophobicContact CD1-CD2 3.62Å; F68-F505 HydrophobicContact CD1-CE1 4.46Å; F68-F505 AromaticContact CD1-CE2 3.3Å; F68-F505 HydrophobicContact CD1-CE2 3.3Å; F68-F505 HydrophobicContact CD1-CG 4.3Å; F68-F505 AromaticContact CD1-CZ 3.78Å; F68-F505 HydrophobicContact CD1-CZ 3.78Å; F68-F505 AromaticContact CE1-CD2 3.32Å; F68-F505 HydrophobicContact CE1-CD2 3.32Å; F68-F505 AromaticContact CE1-CE2 3.55Å; F68-F505 HydrophobicContact CE1-CE2 3.55Å; F68-F505 AromaticContact CE1-CG 3.94Å; F68-F505 HydrophobicContact CE1-CG 3.94Å; F68-F505 HydrophobicContact CE1-CZ 4.34Å; F68-F505 HydrophobicContact CG-CE2 4.48Å
69V95.1Very high96.4Very high58 Ų5832.3 Ų32.335%0.35218%0.178SC..Hα-helixtrans-61-50.2173.9-177.30000110.7V65 L66 G72 I73 F505V65-V69 VanDerWaalsContact O-CG2 3.31Å; V65-V69 WeakPolarHBondContact O-CG2 3.29Å; V65-V69 PolarHBondContact O-N 2.75Å; L66-V69 PolarHBondContact O-N 2.92Å; V69-G72 PolarHBondContact O-N 3.49Å; V69-I73 HydrophobicContact CG1-CD1 4.08Å; V69-I73 WeakPolarHBondContact O-CG1 3.43Å; V69-I73 PolarHBondContact O-N 3.33Å; V69-F505 HydrophobicContact CG2-CE1 3.54Å; V69-F505 HydrophobicContact CG2-CZ 3.74Å
70R94.1Very high96.4Very high39 Ų3933.1 Ų33.115%0.14719%0.188CC..Hα-helixtrans-64.7-45.1-177.1179-96.4138.5123.3152.4112.1L66 M67 G72 I73 D74 T101 I105 N153L66-R70 PolarHBondContact O-N 2.95Å; M67-R70 PolarHBondContact O-N 3.48Å; R70-G72 VanDerWaalsContact C-N 3.3Å; R70-G72 PolarHBondContact O-N 3.3Å; R70-I73 PolarHBondContact O-N 3.4Å; R70-D74 IonicContact CZ-OD2 2.81Å; R70-D74 IonicContact NE-OD1 3.52Å; R70-D74 IonicContact NE-OD2 3.61Å; R70-D74 PolarHBondContact NE-OD2 3.16Å; R70-D74 IonicContact NH1-OD1 3.62Å; R70-D74 IonicContact NH1-OD2 3.81Å; R70-D74 PolarHBondContact NH1-OD2 3.04Å; R70-D74 PolarHBondContact O-N 2.97Å; R70-D74 VanDerWaalsContact O-N 3.15Å; R70-T101 VanDerWaalsContact CZ-CG2 3.49Å; R70-T101 VanDerWaalsContact NH2-CG2 3.3Å; R70-I105 VanDerWaalsContact CD-CD1 3.41Å; R70-N153 PolarHBondContact NH2-OD1 2.84Å
71G96Very high96.3Very high0 Ų033.1 Ų33.10%019%0.188CC..Hα-helixtrans-64.9-32.7173.400000113M67 D74 A75 H102M67-G71 PolarHBondContact O-N 3.43Å; G71-D74 PolarHBondContact O-N 3.38Å; G71-A75 PolarHBondContact O-N 2.82Å; G71-H102 PolarHBondContact O-CE1 3.36Å; G71-H102 PolarHBondContact O-ND1 3.09Å
72G95.8Very high96.3Very high28 Ų2832.7 Ų32.729%0.28919%0.186SC..Hα-helixtrans-66-42173.100000113F68 V69 R70 D74 A75 L76F68-G72 PolarHBondContact O-N 3.43Å; V69-G72 PolarHBondContact O-N 3.49Å; R70-G72 VanDerWaalsContact C-N 3.3Å; R70-G72 PolarHBondContact O-N 3.3Å; G72-D74 VanDerWaalsContact C-N 3.33Å; G72-D74 PolarHBondContact O-N 3.42Å; G72-A75 WeakPolarHBondContact O-CB 3.32Å; G72-A75 PolarHBondContact O-N 3.4Å; G72-L76 WeakPolarHBondContact O-CG 3.16Å; G72-L76 PolarHBondContact O-N 2.89Å
73I95.2Very high96.4Very high90 Ų9029.5 Ų29.546%0.46217%0.17SC..Hα-helixtrans-60-45.4173.5-68.5166.4000110.1V69 R70 A75 L76 L77V69-I73 HydrophobicContact CG1-CD1 4.08Å; V69-I73 WeakPolarHBondContact O-CG1 3.43Å; V69-I73 PolarHBondContact O-N 3.33Å; R70-I73 PolarHBondContact O-N 3.4Å; I73-A75 VanDerWaalsContact C-N 3.31Å; I73-A75 PolarHBondContact O-N 3.42Å; I73-L76 WeakPolarHBondContact O-CB 3.33Å; I73-L76 PolarHBondContact O-N 3.47Å; I73-L76 VanDerWaalsContact O-N 3.14Å; I73-L77 HydrophobicContact CG2-CD1 4.15Å; I73-L77 HydrophobicContact CG2-CG 4.39Å; I73-L77 WeakPolarHBondContact O-CG 3.42Å; I73-L77 PolarHBondContact O-N 2.94Å
74D95.9Very high96.3Very high6 Ų631.9 Ų31.93%0.03219%0.185CC..Hα-helixtrans-59-43.1176.5-60.1-32.5000112.2R70 G71 G72 L76 L77 I78 I98 H102R70-D74 IonicContact CZ-OD2 2.81Å; R70-D74 IonicContact NE-OD1 3.52Å; R70-D74 IonicContact NE-OD2 3.61Å; R70-D74 PolarHBondContact NE-OD2 3.16Å; R70-D74 IonicContact NH1-OD1 3.62Å; R70-D74 IonicContact NH1-OD2 3.81Å; R70-D74 PolarHBondContact NH1-OD2 3.04Å; R70-D74 PolarHBondContact O-N 2.97Å; R70-D74 VanDerWaalsContact O-N 3.15Å; G71-D74 PolarHBondContact O-N 3.38Å; G72-D74 VanDerWaalsContact C-N 3.33Å; G72-D74 PolarHBondContact O-N 3.42Å; D74-L76 VanDerWaalsContact C-N 3.3Å; D74-L76 PolarHBondContact O-N 3.23Å; D74-L77 PolarHBondContact O-N 3.08Å; D74-I78 WeakPolarHBondContact O-CD1 3.5Å; D74-I78 VanDerWaalsContact O-CG1 3.26Å; D74-I78 WeakPolarHBondContact O-CG1 3.35Å; D74-I78 PolarHBondContact O-N 3.02Å; D74-I98 HydrophobicContact CB-CG2 3.67Å; D74-H102 HydrophobicContact CB-CB 3.78Å
75A97.1Very high96.2Very high30 Ų3033.2 Ų33.225%0.24819%0.194CC..Hα-helixtrans-60.4-41.6176.900000111.5G71 G72 I73 I78 R79G71-A75 PolarHBondContact O-N 2.82Å; G72-A75 WeakPolarHBondContact O-CB 3.32Å; G72-A75 PolarHBondContact O-N 3.4Å; I73-A75 VanDerWaalsContact C-N 3.31Å; I73-A75 PolarHBondContact O-N 3.42Å; A75-I78 PolarHBondContact O-N 3.31Å; A75-R79 WeakPolarHBondContact O-CB 3.31Å; A75-R79 VanDerWaalsContact O-CG 3.32Å; A75-R79 WeakPolarHBondContact O-CG 3.26Å; A75-R79 PolarHBondContact O-N 3.19Å
76L97.3Very high96.2Very high54 Ų5435.7 Ų35.728%0.28321%0.205SC..Hα-helixtrans-64.5-40.4175.7-68176.1000112G72 I73 D74 R79 A80 A498 L499 A502G72-L76 WeakPolarHBondContact O-CG 3.16Å; G72-L76 PolarHBondContact O-N 2.89Å; I73-L76 WeakPolarHBondContact O-CB 3.33Å; I73-L76 PolarHBondContact O-N 3.47Å; I73-L76 VanDerWaalsContact O-N 3.14Å; D74-L76 VanDerWaalsContact C-N 3.3Å; D74-L76 PolarHBondContact O-N 3.23Å; L76-R79 PolarHBondContact O-N 2.77Å; L76-A80 VanDerWaalsContact O-CB 3.25Å; L76-A80 WeakPolarHBondContact O-CB 3.46Å; L76-A80 PolarHBondContact O-N 2.91Å; L76-A498 HydrophobicContact CD2-CB 4.14Å; L76-L499 HydrophobicContact CD2-CD2 4.17Å; L76-A502 HydrophobicContact CD1-CB 3.9Å; L76-A502 HydrophobicContact CD2-CB 4.17Å
77L96Very high96.2Very high29 Ų2932.7 Ų32.715%0.15219%0.19CC..Hα-helixtrans-64.9-42.8176.9-66.9174.9000112M15 I73 D74 R79 A80 Q81 F89 L90 I98M15-L77 HydrophobicContact CE-CD1 3.99Å; M15-L77 HydrophobicContact CE-CD2 3.56Å; M15-L77 HydrophobicContact CE-CG 4.44Å; I73-L77 HydrophobicContact CG2-CD1 4.15Å; I73-L77 HydrophobicContact CG2-CG 4.39Å; I73-L77 WeakPolarHBondContact O-CG 3.42Å; I73-L77 PolarHBondContact O-N 2.94Å; D74-L77 PolarHBondContact O-N 3.08Å; L77-R79 PolarHBondContact O-N 3.06Å; L77-A80 PolarHBondContact O-N 2.87Å; L77-Q81 PolarHBondContact O-N 3.1Å; L77-F89 HydrophobicContact CD2-CE1 3.78Å; L77-F89 HydrophobicContact CD2-CZ 3.9Å; L77-L90 HydrophobicContact CB-CD1 4.35Å; L77-I98 HydrophobicContact CB-CD1 4.27Å; L77-I98 HydrophobicContact CB-CG2 4.39Å; L77-I98 HydrophobicContact CD1-CD1 4.09Å
78I97.3Very high96Very high21 Ų2141.2 Ų41.211%0.10823%0.226CC..Hα-helixtrans-58.2-49.7174-67.8162.2000109.9D74 A75 Q81 L82 Y95 I98 F99 H102D74-I78 WeakPolarHBondContact O-CD1 3.5Å; D74-I78 VanDerWaalsContact O-CG1 3.26Å; D74-I78 WeakPolarHBondContact O-CG1 3.35Å; D74-I78 PolarHBondContact O-N 3.02Å; A75-I78 PolarHBondContact O-N 3.31Å; I78-Q81 PolarHBondContact O-N 2.97Å; I78-L82 HydrophobicContact CG2-CD1 4.07Å; I78-L82 WeakPolarHBondContact O-CG 3.34Å; I78-L82 PolarHBondContact O-N 3.02Å; I78-L82 VanDerWaalsContact O-N 3.1Å; I78-Y95 HydrophobicContact CB-CE2 4.44Å; I78-Y95 HydrophobicContact CG2-CE2 3.87Å; I78-I98 HydrophobicContact CD1-CG2 4.07Å; I78-I98 HydrophobicContact CG1-CG2 3.72Å; I78-F99 HydrophobicContact CD1-CB 3.73Å; I78-F99 HydrophobicContact CG1-CB 4.29Å; I78-H102 HydrophobicContact CD1-CB 4.26Å
79R97.6Very high95.8Very high14 Ų1444 Ų445%0.05324%0.239CC..Hα-helixtrans-67.1-38.6-179.2-69.4-54.3-47139.613.5112.2A75 L76 L77 Q81 L82 T83 N491 S494 T495 A498A75-R79 WeakPolarHBondContact O-CB 3.31Å; A75-R79 VanDerWaalsContact O-CG 3.32Å; A75-R79 WeakPolarHBondContact O-CG 3.26Å; A75-R79 PolarHBondContact O-N 3.19Å; L76-R79 PolarHBondContact O-N 2.77Å; L77-R79 PolarHBondContact O-N 3.06Å; R79-Q81 VanDerWaalsContact C-N 3.34Å; R79-Q81 PolarHBondContact O-N 2.87Å; R79-L82 CarbonylContact O-C 3.59Å; R79-L82 PolarHBondContact O-N 3.49Å; R79-L82 VanDerWaalsContact O-N 3.17Å; R79-T83 PolarHBondContact O-N 3.43Å; R79-T83 VanDerWaalsContact O-N 3.11Å; R79-T83 PolarHBondContact O-OG1 3.42Å; R79-N491 PolarHBondContact NH1-OD1 3.33Å; R79-N491 PolarHBondContact NH2-O 3.33Å; R79-N491 PolarHBondContact NH2-OD1 2.8Å; R79-S494 PolarHBondContact NE-OG 3.5Å; R79-T495 HydrophobicContact CB-CG2 4.28Å; R79-T495 PolarHBondContact NH2-OG1 3.15Å; R79-T495 PolarHBondContact O-OG1 2.84Å; R79-T495 VanDerWaalsContact O-OG1 3.08Å; R79-A498 HydrophobicContact CB-CB 4.23Å; R79-A498 HydrophobicContact CG-CB 3.84Å
80A96.8Very high95.7Very high34 Ų3441.4 Ų41.428%0.28122%0.223SC..Hα-helixtrans-57.9-46.6174.600000111.2L76 L77 L82 T83 N87 F89L76-A80 VanDerWaalsContact O-CB 3.25Å; L76-A80 WeakPolarHBondContact O-CB 3.46Å; L76-A80 PolarHBondContact O-N 2.91Å; L77-A80 PolarHBondContact O-N 2.87Å; A80-L82 VanDerWaalsContact C-N 3.35Å; A80-L82 PolarHBondContact O-N 3.07Å; A80-T83 WeakPolarHBondContact O-CB 3.13Å; A80-T83 PolarHBondContact O-N 3.41Å; A80-T83 PolarHBondContact O-OG1 3.27Å; A80-N87 PolarHBondContact O-ND2 3.31Å; A80-F89 HydrophobicContact CB-CD1 4.04Å; A80-F89 HydrophobicContact CB-CE1 3.92Å
81Q96.7Very high95.6Very high1 Ų145.7 Ų45.71%0.00525%0.245CC..Hα-helixtrans-58.9-45.1174.1172.456.722.900111.7L77 I78 R79 T83 N87 F89 L90 Y95 Y479L77-Q81 PolarHBondContact O-N 3.1Å; I78-Q81 PolarHBondContact O-N 2.97Å; R79-Q81 VanDerWaalsContact C-N 3.34Å; R79-Q81 PolarHBondContact O-N 2.87Å; Q81-T83 VanDerWaalsContact C-N 3.26Å; Q81-T83 PolarHBondContact O-N 3.33Å; Q81-N87 PolarHBondContact NE2-O 3.25Å; Q81-N87 WeakPolarHBondContact O-CB 3.25Å; Q81-N87 PolarHBondContact O-ND2 3.17Å; Q81-F89 HydrophobicContact CB-CD1 4.44Å; Q81-L90 HydrophobicContact CB-CB 4.15Å; Q81-L90 HydrophobicContact CB-CD1 3.89Å; Q81-L90 HydrophobicContact CB-CG 4.12Å; Q81-L90 HydrophobicContact CG-CB 4.06Å; Q81-Y95 HydrophobicContact CB-CD2 4.36Å; Q81-Y95 HydrophobicContact CG-CD2 3.99Å; Q81-Y95 HydrophobicContact CG-CE2 4.41Å; Q81-Y479 VanDerWaalsContact CG-O 3.27Å; Q81-Y479 WeakPolarHBondContact CG-O 2.9Å; Q81-Y479 PolarHBondContact NE2-O 3.48Å
82L97.4Very high95.4Very high0 Ų048.4 Ų48.40%026%0.263CS..THydrogen-bonded Turntrans-80.55.9-176.6-64175.5000115.3I78 R79 A80 Y95 Y409 L478 Y481 N491I78-L82 HydrophobicContact CG2-CD1 4.07Å; I78-L82 WeakPolarHBondContact O-CG 3.34Å; I78-L82 PolarHBondContact O-N 3.02Å; I78-L82 VanDerWaalsContact O-N 3.1Å; R79-L82 CarbonylContact O-C 3.59Å; R79-L82 PolarHBondContact O-N 3.49Å; R79-L82 VanDerWaalsContact O-N 3.17Å; A80-L82 VanDerWaalsContact C-N 3.35Å; A80-L82 PolarHBondContact O-N 3.07Å; L82-Y95 HydrophobicContact CD1-CE2 4.36Å; L82-Y95 HydrophobicContact CD2-CE2 4.4Å; L82-Y95 HydrophobicContact CG-CE2 4.22Å; L82-Y409 WeakPolarHBondContact CD1-OH 3.37Å; L82-L478 WeakPolarHBondContact CD2-O 3.21Å; L82-Y481 VanDerWaalsContact O-CE1 3.32Å; L82-Y481 WeakPolarHBondContact O-CE1 3.43Å; L82-Y481 PolarHBondContact O-OH 2.87Å; L82-Y481 VanDerWaalsContact O-OH 3.07Å; L82-N491 WeakPolarHBondContact O-CB 3.29Å
83T97Very high95.1Very high26 Ų2651 Ų5116%0.1627%0.271CS..THydrogen-bonded Turntrans-70.1-37.5-172.3-60.20000113.1R79 A80 Q81 Y481 F488 L492 T495R79-T83 PolarHBondContact O-N 3.43Å; R79-T83 VanDerWaalsContact O-N 3.11Å; R79-T83 PolarHBondContact O-OG1 3.42Å; A80-T83 WeakPolarHBondContact O-CB 3.13Å; A80-T83 PolarHBondContact O-N 3.41Å; A80-T83 PolarHBondContact O-OG1 3.27Å; Q81-T83 VanDerWaalsContact C-N 3.26Å; Q81-T83 PolarHBondContact O-N 3.33Å; T83-Y481 PolarHBondContact O-OH 2.83Å; T83-F488 WeakPolarHBondContact O-CE2 3.34Å; T83-L492 HydrophobicContact CG2-CD1 3.57Å; T83-T495 HydrophobicContact CG2-CG2 4.29Å; T83-T495 WeakPolarHBondContact OG1-CG2 3.47Å; T83-T495 PolarHBondContact OG1-OG1 3.47Å
84V96.7Very high94.9Very high57 Ų5747.1 Ų47.135%0.34525%0.251SS..SBendtrans-126.7151.6178.8-63.80000109.5N87 F488V84-N87 HydrophobicContact CG2-CB 3.69Å; V84-N87 WeakPolarHBondContact O-CB 3.32Å; V84-F488 HydrophobicContact CB-CE2 4.36Å; V84-F488 HydrophobicContact CG1-CE2 3.78Å
85P95.9Very high94.8Very high29 Ų2947 Ų4719%0.18825%0.25CC..THydrogen-bonded Turntrans-62152.417126.5-34.5000111.1N87 Y481 P483P85-N87 PolarHBondContact O-N 3.08Å; P85-Y481 VanDerWaalsContact CA-O 3.27Å; P85-Y481 WeakPolarHBondContact CA-O 3.4Å; P85-Y481 HydrophobicContact CB-CD2 3.84Å; P85-Y481 HydrophobicContact CB-CE2 3.68Å; P85-Y481 WeakPolarHBondContact CB-O 3.19Å; P85-Y481 HydrophobicContact CG-CE2 4.24Å; P85-P483 HydrophobicContact CB-CG 3.85Å; P85-P483 HydrophobicContact CG-CB 4.26Å; P85-P483 HydrophobicContact CG-CG 3.81Å
86D94.8Very high94.7Very high91 Ų9147.9 Ų47.949%0.48725%0.25SS..THydrogen-bonded Turntrans51.627.8179.4-60.5-46.4000115.2T480 Y481 P483D86-T480 VanDerWaalsContact CA-OG1 3.28Å; D86-T480 WeakPolarHBondContact CA-OG1 3.4Å; D86-T480 PolarHBondContact N-OG1 3.2Å; D86-Y481 PolarHBondContact N-O 3.44Å; D86-Y481 VanDerWaalsContact N-O 3.14Å; D86-P483 WeakPolarHBondContact OD2-CD 3.49Å
87N95.2Very high94.6Very high41 Ų4146.3 Ų46.322%0.21924%0.241CC..  trans-64.7144.1178.5-160.20.9000111.2A80 Q81 V84 P85 F89A80-N87 PolarHBondContact O-ND2 3.31Å; Q81-N87 PolarHBondContact NE2-O 3.25Å; Q81-N87 WeakPolarHBondContact O-CB 3.25Å; Q81-N87 PolarHBondContact O-ND2 3.17Å; V84-N87 HydrophobicContact CG2-CB 3.69Å; V84-N87 WeakPolarHBondContact O-CB 3.32Å; P85-N87 PolarHBondContact O-N 3.08Å; N87-F89 PolarHBondContact OD1-N 2.85Å
88K92.9Very high94.5Very high196 Ų19645.1 Ų45.185%0.85224%0.235SC*.  trans-116.821.9-178.2-59.7-173.4179.9-178.30112.7
89F92Very high94.4Very high80 Ų8045.7 Ų45.735%0.35124%0.237SC..SBendtrans-69.2-41.3-178.4178.1-109.3000111.9M15 L77 A80 Q81 N87M15-F89 HydrophobicContact CE-CZ 4.38Å; M15-F89 HydrophobicContact SD-CZ 4.36Å; L77-F89 HydrophobicContact CD2-CE1 3.78Å; L77-F89 HydrophobicContact CD2-CZ 3.9Å; A80-F89 HydrophobicContact CB-CD1 4.04Å; A80-F89 HydrophobicContact CB-CE1 3.92Å; Q81-F89 HydrophobicContact CB-CD1 4.44Å; N87-F89 PolarHBondContact OD1-N 2.85Å
90L92.5Very high94.4Very high3 Ų345 Ų452%0.01624%0.235CC..SBendtrans-122.6134.5172.1-63.1175.3000110.2M15 L77 Q81 Y95 I98M15-L90 HydrophobicContact SD-CD2 4.26Å; L77-L90 HydrophobicContact CB-CD1 4.35Å; Q81-L90 HydrophobicContact CB-CB 4.15Å; Q81-L90 HydrophobicContact CB-CD1 3.89Å; Q81-L90 HydrophobicContact CB-CG 4.12Å; Q81-L90 HydrophobicContact CG-CB 4.06Å; L90-Y95 HydrophobicContact CD1-CD2 4.34Å; L90-I98 HydrophobicContact CD1-CD1 3.65Å; L90-I98 HydrophobicContact CD2-CD1 3.79Å; L90-I98 HydrophobicContact CG-CD1 4.38Å
91E91.6Very high94.4Very high130 Ų13043.5 Ų43.561%0.60722%0.222SC*.  trans-73.4162.5168.1-63179.1178.600111N93 H94 Y95E91-N93 PolarHBondContact O-N 3.29Å; E91-H94 PolarHBondContact O-N 3.32Å; E91-Y95 WeakPolarHBondContact O-CB 3.38Å; E91-Y95 PolarHBondContact O-N 2.92Å
92S92Very high94.4Very high56 Ų5645 Ų4539%0.39223%0.229SC..Hα-helixtrans-56-47.8-17558.10000113.4Y95 N96S92-Y95 PolarHBondContact O-N 2.79Å; S92-N96 WeakPolarHBondContact O-CB 3.38Å; S92-N96 PolarHBondContact O-N 3.35Å; S92-N96 PolarHBondContact O-ND2 3.16Å; S92-N96 PolarHBondContact O-OD1 3.47Å
93N89.9Confident94.3Very high84 Ų8445.7 Ų45.745%0.44924%0.235SC..Hα-helixtrans-65.1-44.2-179.2-171.563.4000111.8E91 N96 E97E91-N93 PolarHBondContact O-N 3.29Å; N93-N96 WeakPolarHBondContact O-CB 3.41Å; N93-N96 PolarHBondContact O-N 3.42Å; N93-N96 VanDerWaalsContact O-N 3.13Å; N93-E97 PolarHBondContact ND2-OE1 3.14Å; N93-E97 WeakPolarHBondContact O-CG 3.36Å; N93-E97 PolarHBondContact O-N 3.07Å
94H90.4Very high94.3Very high8 Ų844.5 Ų44.54%0.03723%0.228CC..Hα-helixtrans-68.1-38.1179.9-168.2-174.5000111.8N13 E91 N96 E97 I98N13-H94 PolarHBondContact ND2-ND1 3.41Å; E91-H94 PolarHBondContact O-N 3.32Å; H94-N96 VanDerWaalsContact C-N 3.27Å; H94-N96 PolarHBondContact O-N 3.01Å; H94-E97 PolarHBondContact O-N 2.88Å; H94-I98 VanDerWaalsContact CD2-CD1 3.5Å; H94-I98 WeakPolarHBondContact CD2-CD1 3.32Å; H94-I98 WeakPolarHBondContact NE2-CD1 3.49Å; H94-I98 VanDerWaalsContact O-CG1 3.28Å; H94-I98 WeakPolarHBondContact O-CG1 3.49Å; H94-I98 PolarHBondContact O-N 3.48Å
95Y94.6Very high94.4Very high4 Ų441.8 Ų41.82%0.01621%0.212CC..Hα-helixtrans-57.8-43.7170.6177.7-91000111.1I78 Q81 L82 L90 E91 S92 I98 F99 L478 Y479I78-Y95 HydrophobicContact CB-CE2 4.44Å; I78-Y95 HydrophobicContact CG2-CE2 3.87Å; Q81-Y95 HydrophobicContact CB-CD2 4.36Å; Q81-Y95 HydrophobicContact CG-CD2 3.99Å; Q81-Y95 HydrophobicContact CG-CE2 4.41Å; L82-Y95 HydrophobicContact CD1-CE2 4.36Å; L82-Y95 HydrophobicContact CD2-CE2 4.4Å; L82-Y95 HydrophobicContact CG-CE2 4.22Å; L90-Y95 HydrophobicContact CD1-CD2 4.34Å; E91-Y95 WeakPolarHBondContact O-CB 3.38Å; E91-Y95 PolarHBondContact O-N 2.92Å; S92-Y95 PolarHBondContact O-N 2.79Å; Y95-I98 PolarHBondContact O-N 3.12Å; Y95-F99 AromaticContact CD1-CD1 3.9Å; Y95-F99 HydrophobicContact CD1-CD1 3.9Å; Y95-F99 HydrophobicContact CD1-CE1 4.42Å; Y95-F99 AromaticContact CE1-CD1 3.8Å; Y95-F99 HydrophobicContact CE1-CD1 3.8Å; Y95-F99 HydrophobicContact CE1-CE1 4.38Å; Y95-F99 VanDerWaalsContact O-CD1 3.31Å; Y95-F99 WeakPolarHBondContact O-CD1 3.45Å; Y95-F99 PolarHBondContact O-N 3.37Å; Y95-L478 WeakPolarHBondContact CE1-O 3.11Å; Y95-L478 PolarHBondContact OH-O 3.01Å; Y95-Y479 VanDerWaalsContact CG-CB 3.48Å
96N94.8Very high94.5Very high47 Ų4741.9 Ų41.925%0.25121%0.21SC..Hα-helixtrans-63.6-42.7179.6-68.8-13.3000112.9S92 N93 H94 F99 S100 A163S92-N96 WeakPolarHBondContact O-CB 3.38Å; S92-N96 PolarHBondContact O-N 3.35Å; S92-N96 PolarHBondContact O-ND2 3.16Å; S92-N96 PolarHBondContact O-OD1 3.47Å; N93-N96 WeakPolarHBondContact O-CB 3.41Å; N93-N96 PolarHBondContact O-N 3.42Å; N93-N96 VanDerWaalsContact O-N 3.13Å; H94-N96 VanDerWaalsContact C-N 3.27Å; H94-N96 PolarHBondContact O-N 3.01Å; N96-F99 VanDerWaalsContact CA-CD1 3.48Å; N96-F99 VanDerWaalsContact CA-CE1 3.4Å; N96-F99 HydrophobicContact CB-CD1 4.48Å; N96-F99 HydrophobicContact CB-CE1 3.94Å; N96-F99 WeakPolarHBondContact O-CD1 3.36Å; N96-F99 WeakPolarHBondContact OD1-CE1 3.39Å; N96-S100 VanDerWaalsContact O-CB 3.24Å; N96-S100 WeakPolarHBondContact O-CB 3.47Å; N96-S100 PolarHBondContact O-N 3.47Å; N96-S100 VanDerWaalsContact O-N 3.12Å; N96-S100 PolarHBondContact O-OG 2.98Å; N96-A163 HydrophobicContact CB-CB 4.02Å
97E93.6Very high94.5Very high22 Ų2238.7 Ų38.710%0.10319%0.193CC..Hα-helixtrans-60.7-49173.6-74.8172.7-178.700111.9N93 H94 S100 T101 P162 A163N93-E97 PolarHBondContact ND2-OE1 3.14Å; N93-E97 WeakPolarHBondContact O-CG 3.36Å; N93-E97 PolarHBondContact O-N 3.07Å; H94-E97 PolarHBondContact O-N 2.88Å; E97-S100 PolarHBondContact O-N 3.24Å; E97-T101 WeakPolarHBondContact O-CB 3.49Å; E97-T101 PolarHBondContact O-N 3.1Å; E97-T101 PolarHBondContact O-OG1 3.04Å; E97-P162 WeakPolarHBondContact CA-O 3.24Å; E97-A163 HydrophobicContact CG-CB 4Å
98I95.1Very high94.5Very high4 Ų437.4 Ų37.42%0.02119%0.186CC..Hα-helixtrans-62.5-49-177.6-69.6166.9000111D74 L77 I78 L90 H94 Y95 S100 T101 H102D74-I98 HydrophobicContact CB-CG2 3.67Å; L77-I98 HydrophobicContact CB-CD1 4.27Å; L77-I98 HydrophobicContact CB-CG2 4.39Å; L77-I98 HydrophobicContact CD1-CD1 4.09Å; I78-I98 HydrophobicContact CD1-CG2 4.07Å; I78-I98 HydrophobicContact CG1-CG2 3.72Å; L90-I98 HydrophobicContact CD1-CD1 3.65Å; L90-I98 HydrophobicContact CD2-CD1 3.79Å; L90-I98 HydrophobicContact CG-CD1 4.38Å; H94-I98 VanDerWaalsContact CD2-CD1 3.5Å; H94-I98 WeakPolarHBondContact CD2-CD1 3.32Å; H94-I98 WeakPolarHBondContact NE2-CD1 3.49Å; H94-I98 VanDerWaalsContact O-CG1 3.28Å; H94-I98 WeakPolarHBondContact O-CG1 3.49Å; H94-I98 PolarHBondContact O-N 3.48Å; Y95-I98 PolarHBondContact O-N 3.12Å; I98-S100 VanDerWaalsContact C-N 3.33Å; I98-S100 PolarHBondContact O-N 3.41Å; I98-T101 PolarHBondContact O-N 3.04Å; I98-H102 VanDerWaalsContact O-CB 3.31Å; I98-H102 WeakPolarHBondContact O-CB 3.24Å; I98-H102 PolarHBondContact O-N 3.29Å
99F95.6Very high94.8Very high32 Ų3228 Ų2814%0.1415%0.145CC..Hα-helixtrans-68.7-34.2-178.388.7-109.9000112.6I78 Y95 N96 G103 G165 R477I78-F99 HydrophobicContact CD1-CB 3.73Å; I78-F99 HydrophobicContact CG1-CB 4.29Å; Y95-F99 AromaticContact CD1-CD1 3.9Å; Y95-F99 HydrophobicContact CD1-CD1 3.9Å; Y95-F99 HydrophobicContact CD1-CE1 4.42Å; Y95-F99 AromaticContact CE1-CD1 3.8Å; Y95-F99 HydrophobicContact CE1-CD1 3.8Å; Y95-F99 HydrophobicContact CE1-CE1 4.38Å; Y95-F99 VanDerWaalsContact O-CD1 3.31Å; Y95-F99 WeakPolarHBondContact O-CD1 3.45Å; Y95-F99 PolarHBondContact O-N 3.37Å; N96-F99 VanDerWaalsContact CA-CD1 3.48Å; N96-F99 VanDerWaalsContact CA-CE1 3.4Å; N96-F99 HydrophobicContact CB-CD1 4.48Å; N96-F99 HydrophobicContact CB-CE1 3.94Å; N96-F99 WeakPolarHBondContact O-CD1 3.36Å; N96-F99 WeakPolarHBondContact OD1-CE1 3.39Å; F99-G103 PolarHBondContact O-N 3.44Å; F99-G165 VanDerWaalsContact CE2-CA 3.5Å; F99-R477 HydrophobicContact CD2-CG 4.18Å; F99-R477 HydrophobicContact CE1-CB 4.05Å; F99-R477 HydrophobicContact CE1-CG 4.02Å; F99-R477 HydrophobicContact CE2-CG 3.63Å; F99-R477 HydrophobicContact CZ-CB 4.02Å; F99-R477 HydrophobicContact CZ-CG 3.59Å
100S96.1Very high95Very high1 Ų124.4 Ų24.41%0.00713%0.129CC..Hα-helixtrans-63.3-47.8176.3-61.50000110N96 E97 I98 G103 V104 P162 G165N96-S100 VanDerWaalsContact O-CB 3.24Å; N96-S100 WeakPolarHBondContact O-CB 3.47Å; N96-S100 PolarHBondContact O-N 3.47Å; N96-S100 VanDerWaalsContact O-N 3.12Å; N96-S100 PolarHBondContact O-OG 2.98Å; E97-S100 PolarHBondContact O-N 3.24Å; I98-S100 VanDerWaalsContact C-N 3.33Å; I98-S100 PolarHBondContact O-N 3.41Å; S100-G103 PolarHBondContact O-N 3.47Å; S100-V104 WeakPolarHBondContact O-CG2 3.11Å; S100-V104 PolarHBondContact O-N 3.02Å; S100-P162 WeakPolarHBondContact CB-O 3.47Å; S100-P162 PolarHBondContact OG-O 2.92Å; S100-G165 WeakPolarHBondContact OG-CA 3.34Å; S100-G165 PolarHBondContact OG-N 3.32Å
101T96.5Very high95.2Very high1 Ų124.3 Ų24.31%0.00613%0.129CC..Hα-helixtrans-71.1-40.1-177-40.60000110.9R70 E97 I98 G103 V104 I105 F152 S161R70-T101 VanDerWaalsContact CZ-CG2 3.49Å; R70-T101 VanDerWaalsContact NH2-CG2 3.3Å; E97-T101 WeakPolarHBondContact O-CB 3.49Å; E97-T101 PolarHBondContact O-N 3.1Å; E97-T101 PolarHBondContact O-OG1 3.04Å; I98-T101 PolarHBondContact O-N 3.04Å; T101-G103 PolarHBondContact O-N 3.24Å; T101-V104 PolarHBondContact O-N 2.95Å; T101-I105 HydrophobicContact CG2-CG1 4.24Å; T101-I105 WeakPolarHBondContact O-CB 3.43Å; T101-I105 WeakPolarHBondContact O-CG1 3.49Å; T101-I105 PolarHBondContact O-N 3.46Å; T101-F152 HydrophobicContact CG2-CD1 4.1Å; T101-F152 HydrophobicContact CG2-CE1 3.27Å; T101-F152 HydrophobicContact CG2-CZ 3.62Å; T101-S161 WeakPolarHBondContact OG1-CB 3.34Å
102H97.4Very high95.4Very high33 Ų3318.3 Ų18.315%0.15310%0.101CC..Hα-helixtrans-50.8-52.1171.3171.776.9000112G71 D74 I78 I98 V104 I105 M106G71-H102 PolarHBondContact O-CE1 3.36Å; G71-H102 PolarHBondContact O-ND1 3.09Å; D74-H102 HydrophobicContact CB-CB 3.78Å; I78-H102 HydrophobicContact CD1-CB 4.26Å; I98-H102 VanDerWaalsContact O-CB 3.31Å; I98-H102 WeakPolarHBondContact O-CB 3.24Å; I98-H102 PolarHBondContact O-N 3.29Å; H102-V104 PolarHBondContact O-N 3.46Å; H102-I105 PolarHBondContact O-N 3.19Å; H102-M106 WeakPolarHBondContact O-CB 3.41Å; H102-M106 VanDerWaalsContact O-CG 3.22Å; H102-M106 WeakPolarHBondContact O-CG 3.34Å; H102-M106 PolarHBondContact O-N 2.91Å
103G96.3Very high95.7Very high14 Ų1415.7 Ų15.714%0.1448%0.083CC..Hα-helixtrans-60.2-44.4-17800000112.7F99 S100 T101 I107F99-G103 PolarHBondContact O-N 3.44Å; S100-G103 PolarHBondContact O-N 3.47Å; T101-G103 PolarHBondContact O-N 3.24Å; G103-I107 WeakPolarHBondContact O-CG1 3.4Å; G103-I107 PolarHBondContact O-N 3.2Å
104V97.2Very high96.1Very high2 Ų212 Ų121%0.0126%0.063CC..Hα-helixtrans-67.8-45.4179.1177.70000111.5S100 T101 H102 M106 I108 F109 F152 W166 Y185 I189S100-V104 WeakPolarHBondContact O-CG2 3.11Å; S100-V104 PolarHBondContact O-N 3.02Å; T101-V104 PolarHBondContact O-N 2.95Å; H102-V104 PolarHBondContact O-N 3.46Å; V104-M106 VanDerWaalsContact C-N 3.33Å; V104-M106 PolarHBondContact O-N 3.25Å; V104-I108 HydrophobicContact CG1-CB 4.47Å; V104-I108 HydrophobicContact CG1-CG1 4.35Å; V104-I108 WeakPolarHBondContact O-CB 3.47Å; V104-I108 PolarHBondContact O-N 3.28Å; V104-F109 HydrophobicContact CG1-CD2 4.11Å; V104-F109 HydrophobicContact CG1-CE2 3.79Å; V104-F152 HydrophobicContact CB-CE1 3.62Å; V104-F152 HydrophobicContact CB-CE2 4.37Å; V104-F152 HydrophobicContact CB-CZ 3.47Å; V104-F152 VanDerWaalsContact CB-CZ 3.47Å; V104-F152 HydrophobicContact CG1-CD1 4.11Å; V104-F152 HydrophobicContact CG1-CD2 4.46Å; V104-F152 HydrophobicContact CG1-CE1 3.5Å; V104-F152 VanDerWaalsContact CG1-CE1 3.5Å; V104-F152 HydrophobicContact CG1-CE2 3.94Å; V104-F152 HydrophobicContact CG1-CZ 3.43Å; V104-F152 VanDerWaalsContact CG1-CZ 3.43Å; V104-F152 HydrophobicContact CG2-CZ 3.9Å; V104-W166 HydrophobicContact CG2-CB 3.82Å; V104-Y185 HydrophobicContact CG2-CD2 3.82Å; V104-Y185 HydrophobicContact CG2-CE2 3.68Å; V104-I189 HydrophobicContact CG1-CD1 3.95Å; V104-I189 HydrophobicContact CG1-CG1 4.38Å
105I97.6Very high96.4Very high0 Ų011.7 Ų11.70%06%0.061CC..Iπ-helixtrans-55.8-50.9177.2-66.2-83.6000110M67 R70 T101 H102 I107 F109 M110 F152M67-I105 HydrophobicContact CB-CG2 4.03Å; M67-I105 VanDerWaalsContact O-CG2 3.23Å; M67-I105 WeakPolarHBondContact O-CG2 3.4Å; M67-I105 HydrophobicContact SD-CD1 3.92Å; M67-I105 HydrophobicContact SD-CG2 4.5Å; R70-I105 VanDerWaalsContact CD-CD1 3.41Å; T101-I105 HydrophobicContact CG2-CG1 4.24Å; T101-I105 WeakPolarHBondContact O-CB 3.43Å; T101-I105 WeakPolarHBondContact O-CG1 3.49Å; T101-I105 PolarHBondContact O-N 3.46Å; H102-I105 PolarHBondContact O-N 3.19Å; I105-I107 PolarHBondContact O-N 3.04Å; I105-F109 CarbonylContact O-C 3.34Å; I105-F109 VanDerWaalsContact O-C 3.27Å; I105-F109 WeakPolarHBondContact O-CA 3.08Å; I105-F109 PolarHBondContact O-N 3.23Å; I105-M110 WeakPolarHBondContact O-CB 3.27Å; I105-M110 PolarHBondContact O-N 2.99Å; I105-F152 HydrophobicContact CD1-CD1 3.99Å; I105-F152 HydrophobicContact CD1-CE1 4.2Å; I105-F152 HydrophobicContact CG1-CD1 4.37Å; I105-F152 HydrophobicContact CG1-CE1 4.08Å
106M97.7Very high96.5Very high30 Ų3011.6 Ų11.615%0.1486%0.061CC..Iπ-helixtrans-68-37.1-170.6-69-60.9-77.300112.8F68 H102 V104 M110 A111F68-M106 HydrophobicContact CD2-CE 3.9Å; F68-M106 HydrophobicContact CD2-SD 4.44Å; F68-M106 HydrophobicContact CE2-CE 3.85Å; H102-M106 WeakPolarHBondContact O-CB 3.41Å; H102-M106 VanDerWaalsContact O-CG 3.22Å; H102-M106 WeakPolarHBondContact O-CG 3.34Å; H102-M106 PolarHBondContact O-N 2.91Å; V104-M106 VanDerWaalsContact C-N 3.33Å; V104-M106 PolarHBondContact O-N 3.25Å; M106-M110 HydrophobicContact CB-CE 4.4Å; M106-M110 HydrophobicContact CE-CE 3.4Å; M106-M110 WeakPolarHBondContact O-CE 3.47Å; M106-M110 HydrophobicContact SD-CE 3.93Å; M106-M110 HydrophobicContact SD-CG 4.48Å; M106-A111 VanDerWaalsContact O-CB 3.29Å; M106-A111 WeakPolarHBondContact O-CB 3.45Å; M106-A111 PolarHBondContact O-N 3.44Å
107I95.2Very high96.7Very high25 Ų259.4 Ų9.413%0.1285%0.049CC..Iπ-helixtrans-83.1-56.3179.3-55.4-58.5000111.1G103 I105 M112 E281 L419G103-I107 WeakPolarHBondContact O-CG1 3.4Å; G103-I107 PolarHBondContact O-N 3.2Å; I105-I107 PolarHBondContact O-N 3.04Å; I107-M112 WeakPolarHBondContact O-CG 3.4Å; I107-M112 PolarHBondContact O-N 3.28Å; I107-E281 HydrophobicContact CG2-CG 4.43Å; I107-L419 HydrophobicContact CD1-CD1 4.42Å; I107-L419 HydrophobicContact CD1-CD2 3.32Å; I107-L419 HydrophobicContact CD1-CG 4.49Å
108I96.1Very high96.8Very high13 Ų138.3 Ų8.37%0.0674%0.044CC..Iπ-helixtrans-84.9-40.8-167.4-54.6-60.3000112.1V104 P113 W277V104-I108 HydrophobicContact CG1-CB 4.47Å; V104-I108 HydrophobicContact CG1-CG1 4.35Å; V104-I108 WeakPolarHBondContact O-CB 3.47Å; V104-I108 PolarHBondContact O-N 3.28Å; I108-P113 WeakPolarHBondContact O-CD 3.34Å; I108-W277 HydrophobicContact CD1-CH2 3.9Å; I108-W277 HydrophobicContact CD1-CZ2 3.87Å
109F97.7Very high97Very high0 Ų08.1 Ų8.10%04%0.043CC..Iπ-helixtrans-105.2-3-172.5-58.3-64.3000114.3M67 V104 I105 P113 F145 M149 F152 A188M67-F109 HydrophobicContact CB-CB 4.46Å; M67-F109 WeakPolarHBondContact CB-O 3.2Å; M67-F109 HydrophobicContact CG-CB 4.01Å; M67-F109 VanDerWaalsContact CG-O 3.25Å; M67-F109 WeakPolarHBondContact CG-O 3.38Å; M67-F109 HydrophobicContact SD-CB 4.36Å; V104-F109 HydrophobicContact CG1-CD2 4.11Å; V104-F109 HydrophobicContact CG1-CE2 3.79Å; I105-F109 CarbonylContact O-C 3.34Å; I105-F109 VanDerWaalsContact O-C 3.27Å; I105-F109 WeakPolarHBondContact O-CA 3.08Å; I105-F109 PolarHBondContact O-N 3.23Å; F109-P113 WeakPolarHBondContact O-CG 3.48Å; F109-F145 HydrophobicContact CD1-CD2 4.26Å; F109-F145 AromaticContact CD1-CE2 3.86Å; F109-F145 HydrophobicContact CD1-CE2 3.86Å; F109-M149 HydrophobicContact CB-CG 4.43Å; F109-M149 HydrophobicContact CD1-CB 3.71Å; F109-M149 HydrophobicContact CD1-CG 4.14Å; F109-M149 HydrophobicContact CE1-CB 4.03Å; F109-M149 HydrophobicContact CG-CB 4.44Å; F109-M149 HydrophobicContact CG-CG 4.41Å; F109-F152 HydrophobicContact CD2-CB 4.41Å; F109-F152 AromaticContact CD2-CD1 3.83Å; F109-F152 HydrophobicContact CD2-CD1 3.83Å; F109-F152 HydrophobicContact CD2-CE1 4.47Å; F109-F152 HydrophobicContact CD2-CG 4.31Å; F109-F152 HydrophobicContact CE2-CB 3.59Å; F109-F152 AromaticContact CE2-CD1 3.52Å; F109-F152 HydrophobicContact CE2-CD1 3.52Å; F109-F152 HydrophobicContact CE2-CD2 4.34Å; F109-F152 HydrophobicContact CE2-CE1 4.27Å; F109-F152 AromaticContact CE2-CG 3.55Å; F109-F152 HydrophobicContact CE2-CG 3.55Å; F109-F152 HydrophobicContact CZ-CB 3.88Å; F109-F152 HydrophobicContact CZ-CG 4.27Å; F109-A188 HydrophobicContact CZ-CB 4.49Å
110M97.7Very high97.1Very high4 Ų46.6 Ų6.62%0.024%0.036CC..Iπ-helixtrans-120.6-68.3174.8-176.4-75.1-71.400111M67 F68 I105 M106 M112 P113 F114 V424M67-M110 HydrophobicContact CB-CB 4.17Å; F68-M110 HydrophobicContact CB-CG 3.72Å; F68-M110 HydrophobicContact CD2-CE 3.83Å; F68-M110 HydrophobicContact CD2-CG 3.82Å; F68-M110 HydrophobicContact CD2-SD 3.81Å; F68-M110 HydrophobicContact CE2-CE 4.23Å; F68-M110 HydrophobicContact CG-CG 4.28Å; I105-M110 WeakPolarHBondContact O-CB 3.27Å; I105-M110 PolarHBondContact O-N 2.99Å; M106-M110 HydrophobicContact CB-CE 4.4Å; M106-M110 HydrophobicContact CE-CE 3.4Å; M106-M110 WeakPolarHBondContact O-CE 3.47Å; M106-M110 HydrophobicContact SD-CE 3.93Å; M106-M110 HydrophobicContact SD-CG 4.48Å; M110-M112 PolarHBondContact O-N 2.91Å; M110-P113 VanDerWaalsContact O-CD 3.31Å; M110-P113 WeakPolarHBondContact O-CD 3.44Å; M110-P113 WeakPolarHBondContact O-CG 3.49Å; M110-F114 VanDerWaalsContact O-CB 3.24Å; M110-F114 WeakPolarHBondContact O-CB 3.43Å; M110-F114 PolarHBondContact O-N 3.3Å; M110-V424 HydrophobicContact CE-CG2 3.96Å
111A96.9Very high97.2Very high1 Ų16.8 Ų6.81%0.0084%0.037CC..Iπ-helixtrans-61-49.9-171.400000112.2M106 F114 I115 V285 V423M106-A111 VanDerWaalsContact O-CB 3.29Å; M106-A111 WeakPolarHBondContact O-CB 3.45Å; M106-A111 PolarHBondContact O-N 3.44Å; A111-F114 PolarHBondContact O-N 3.46Å; A111-I115 WeakPolarHBondContact O-CG1 3.15Å; A111-I115 PolarHBondContact O-N 3.46Å; A111-V285 HydrophobicContact CB-CG1 4.02Å; A111-V423 HydrophobicContact CB-CG1 4.17Å
112M95.7Very high97.2Very high4 Ų46.8 Ų6.82%0.024%0.037CC..Hα-helixtrans-57.9-57.6177.9-76.1-71.2-86.500113.7I107 M110 F114 I115 F116 T196 F238 E281 I284 V285I107-M112 WeakPolarHBondContact O-CG 3.4Å; I107-M112 PolarHBondContact O-N 3.28Å; M110-M112 PolarHBondContact O-N 2.91Å; M112-F114 PolarHBondContact O-N 3.47Å; M112-I115 PolarHBondContact O-N 3.03Å; M112-F116 HydrophobicContact CE-CE1 4.24Å; M112-F116 HydrophobicContact CE-CE2 3.77Å; M112-F116 HydrophobicContact CE-CZ 3.35Å; M112-F116 WeakPolarHBondContact O-CB 3.09Å; M112-F116 WeakPolarHBondContact O-CG 3.45Å; M112-F116 PolarHBondContact O-N 3.38Å; M112-F116 HydrophobicContact SD-CE1 4.37Å; M112-F116 HydrophobicContact SD-CZ 3.99Å; M112-T196 HydrophobicContact CE-CG2 3.54Å; M112-F238 HydrophobicContact CE-CE2 4Å; M112-F238 HydrophobicContact CE-CZ 3.68Å; M112-E281 VanDerWaalsContact CE-OE1 3.27Å; M112-E281 WeakPolarHBondContact CE-OE1 3.32Å; M112-E281 WeakPolarHBondContact CG-OE1 3.25Å; M112-E281 VanDerWaalsContact SD-OE1 3.34Å; M112-I284 HydrophobicContact CE-CG2 3.86Å; M112-I284 HydrophobicContact SD-CG2 3.51Å; M112-I284 VanDerWaalsContact SD-CG2 3.51Å; M112-V285 HydrophobicContact CG-CG1 4.03Å; M112-V285 HydrophobicContact SD-CG1 3.89Å
113P97.5Very high97.2Very high1 Ų15.2 Ų5.21%0.0063%0.03CC..Hα-helixtrans-65-27.3178.524.3-34.6000112.9Y60 A64 I108 F109 M110 G117 F145Y60-P113 HydrophobicContact CD1-CB 3.63Å; Y60-P113 HydrophobicContact CE1-CB 4.27Å; A64-P113 HydrophobicContact CB-CB 4.34Å; A64-P113 HydrophobicContact CB-CG 4.15Å; I108-P113 WeakPolarHBondContact O-CD 3.34Å; F109-P113 WeakPolarHBondContact O-CG 3.48Å; M110-P113 VanDerWaalsContact O-CD 3.31Å; M110-P113 WeakPolarHBondContact O-CD 3.44Å; M110-P113 WeakPolarHBondContact O-CG 3.49Å; P113-G117 PolarHBondContact O-N 3.33Å; P113-F145 HydrophobicContact CB-CD2 4.31Å; P113-F145 HydrophobicContact CB-CE1 3.99Å; P113-F145 HydrophobicContact CB-CE2 3.61Å; P113-F145 HydrophobicContact CB-CZ 3.44Å; P113-F145 VanDerWaalsContact CB-CZ 3.44Å; P113-F145 HydrophobicContact CG-CD2 4.5Å; P113-F145 HydrophobicContact CG-CE2 3.54Å; P113-F145 HydrophobicContact CG-CZ 3.61Å
114F98.1Very high97.3Very high6 Ų64.5 Ų4.53%0.0262%0.023CC..Hα-helixtrans-63.2-51.3173.4-150.9-62.3000110.7L61 A64 V65 M110 A111 M112 G117 L118 C427 L431L61-F114 HydrophobicContact CD2-CD1 3.54Å; L61-F114 HydrophobicContact CD2-CE1 3.67Å; L61-F114 HydrophobicContact CD2-CG 4.01Å; L61-F114 HydrophobicContact CD2-CZ 4.27Å; L61-F114 WeakPolarHBondContact CD2-O 3.48Å; A64-F114 HydrophobicContact CB-CB 3.8Å; A64-F114 HydrophobicContact CB-CD2 3.75Å; A64-F114 HydrophobicContact CB-CG 4.11Å; V65-F114 HydrophobicContact CG2-CE2 4.21Å; M110-F114 VanDerWaalsContact O-CB 3.24Å; M110-F114 WeakPolarHBondContact O-CB 3.43Å; M110-F114 PolarHBondContact O-N 3.3Å; A111-F114 PolarHBondContact O-N 3.46Å; M112-F114 PolarHBondContact O-N 3.47Å; F114-G117 PolarHBondContact O-N 3.05Å; F114-L118 HydrophobicContact CD1-CD1 4.06Å; F114-L118 HydrophobicContact CD1-CG 4.24Å; F114-L118 HydrophobicContact CE1-CD1 4.13Å; F114-L118 HydrophobicContact CE1-CG 4.39Å; F114-L118 PolarHBondContact O-N 2.82Å; F114-C427 HydrophobicContact CD1-CB 3.53Å; F114-C427 HydrophobicContact CD2-CB 4.05Å; F114-C427 HydrophobicContact CE1-CB 3.54Å; F114-C427 WeakPolarHBondContact CE1-O 3.45Å; F114-C427 HydrophobicContact CE2-CB 4.05Å; F114-C427 HydrophobicContact CG-CB 3.79Å; F114-C427 HydrophobicContact CZ-CB 3.79Å; F114-C427 WeakPolarHBondContact CZ-O 3.3Å; F114-L431 HydrophobicContact CE1-CB 4.15Å; F114-L431 HydrophobicContact CZ-CB 3.84Å; F114-L431 HydrophobicContact CZ-CD1 4.37Å; F114-L431 HydrophobicContact CZ-CD2 4.23Å; F114-L431 HydrophobicContact CZ-CG 4.37Å
115I97.1Very high97.3Very high1 Ų14.6 Ų4.61%0.0052%0.023CC..Hα-helixtrans-62.3-45177.9-68.3-57.5000111A111 M112 G117 L118 W119 P288 I292A111-I115 WeakPolarHBondContact O-CG1 3.15Å; A111-I115 PolarHBondContact O-N 3.46Å; M112-I115 PolarHBondContact O-N 3.03Å; I115-G117 VanDerWaalsContact C-N 3.29Å; I115-G117 PolarHBondContact O-N 2.91Å; I115-L118 PolarHBondContact O-N 3.47Å; I115-W119 HydrophobicContact CG2-CD2 4.41Å; I115-W119 HydrophobicContact CG2-CZ2 4.12Å; I115-W119 VanDerWaalsContact O-CD1 3.24Å; I115-W119 PolarHBondContact O-N 3.26Å; I115-P288 HydrophobicContact CD1-CB 4.24Å; I115-P288 HydrophobicContact CG2-CB 3.5Å; I115-P288 HydrophobicContact CG2-CG 3.72Å; I115-I292 HydrophobicContact CD1-CD1 4.1Å
116F97Very high97.2Very high3 Ų34.6 Ų4.61%0.0132%0.023CC..Hα-helixtrans-65.8-31.4176.8-65.9-12.6000113M112 W119 N120 T196 T199M112-F116 HydrophobicContact CE-CE1 4.24Å; M112-F116 HydrophobicContact CE-CE2 3.77Å; M112-F116 HydrophobicContact CE-CZ 3.35Å; M112-F116 WeakPolarHBondContact O-CB 3.09Å; M112-F116 WeakPolarHBondContact O-CG 3.45Å; M112-F116 PolarHBondContact O-N 3.38Å; M112-F116 HydrophobicContact SD-CE1 4.37Å; M112-F116 HydrophobicContact SD-CZ 3.99Å; F116-W119 AromaticContact CD1-CD2 3.93Å; F116-W119 HydrophobicContact CD1-CD2 3.93Å; F116-W119 AromaticContact CD1-CE3 3.58Å; F116-W119 HydrophobicContact CD1-CE3 3.58Å; F116-W119 HydrophobicContact CD1-CH2 4.13Å; F116-W119 HydrophobicContact CD1-CZ2 4.44Å; F116-W119 AromaticContact CD1-CZ3 3.69Å; F116-W119 HydrophobicContact CD1-CZ3 3.69Å; F116-W119 HydrophobicContact CE1-CD2 4.46Å; F116-W119 AromaticContact CE1-CE3 3.91Å; F116-W119 HydrophobicContact CE1-CE3 3.91Å; F116-W119 AromaticContact CE1-CH2 3.68Å; F116-W119 HydrophobicContact CE1-CH2 3.68Å; F116-W119 HydrophobicContact CE1-CZ2 4.25Å; F116-W119 AromaticContact CE1-CZ3 3.48Å; F116-W119 HydrophobicContact CE1-CZ3 3.48Å; F116-W119 VanDerWaalsContact CE1-CZ3 3.48Å; F116-W119 PolarHBondContact O-N 3.35Å; F116-N120 VanDerWaalsContact O-CB 3.31Å; F116-N120 WeakPolarHBondContact O-CB 3.45Å; F116-N120 PolarHBondContact O-N 2.79Å; F116-N120 PolarHBondContact O-ND2 3.3Å; F116-T196 HydrophobicContact CE2-CG2 3.72Å; F116-T196 HydrophobicContact CZ-CG2 3.7Å; F116-T199 HydrophobicContact CB-CG2 4.49Å; F116-T199 HydrophobicContact CD1-CG2 4.18Å; F116-T199 HydrophobicContact CD2-CG2 4.05Å; F116-T199 HydrophobicContact CE1-CG2 4.41Å; F116-T199 HydrophobicContact CE2-CG2 4.28Å; F116-T199 HydrophobicContact CG-CG2 4Å; F116-T199 HydrophobicContact CZ-CG2 4.45Å
117G97.7Very high97.2Very high0 Ų03.1 Ų3.10%02%0.016CC..Hα-helixtrans-62-46.617100000111.6P113 F114 I115 N120 I121P113-G117 PolarHBondContact O-N 3.33Å; F114-G117 PolarHBondContact O-N 3.05Å; I115-G117 VanDerWaalsContact C-N 3.29Å; I115-G117 PolarHBondContact O-N 2.91Å; G117-N120 PolarHBondContact O-N 3.29Å; G117-I121 WeakPolarHBondContact O-CD1 3.21Å; G117-I121 WeakPolarHBondContact O-CG1 3.25Å; G117-I121 PolarHBondContact O-N 3.37Å
118L97.7Very high97.1Very high0 Ų02.1 Ų2.10%01%0.012CC..Hα-helixtrans-66.9-38.9175.2-66.2179.7000112.7L61 F114 I115 N120 I121 V122 F223 I292 W434L61-L118 HydrophobicContact CD1-CD2 4.29Å; L61-L118 HydrophobicContact CD2-CD2 4.31Å; L61-L118 HydrophobicContact CD2-CG 4.25Å; F114-L118 HydrophobicContact CD1-CD1 4.06Å; F114-L118 HydrophobicContact CD1-CG 4.24Å; F114-L118 HydrophobicContact CE1-CD1 4.13Å; F114-L118 HydrophobicContact CE1-CG 4.39Å; F114-L118 PolarHBondContact O-N 2.82Å; I115-L118 PolarHBondContact O-N 3.47Å; L118-N120 VanDerWaalsContact C-N 3.33Å; L118-N120 PolarHBondContact O-N 3.28Å; L118-I121 PolarHBondContact O-N 2.9Å; L118-V122 WeakPolarHBondContact O-CB 3.42Å; L118-V122 WeakPolarHBondContact O-CG2 3.43Å; L118-V122 PolarHBondContact O-N 3.13Å; L118-F223 HydrophobicContact CB-CZ 4.05Å; L118-I292 HydrophobicContact CD1-CD1 3.5Å; L118-I292 VanDerWaalsContact CD1-CD1 3.5Å; L118-I292 HydrophobicContact CD1-CG1 4.47Å; L118-W434 HydrophobicContact CD1-CE3 4.47Å; L118-W434 HydrophobicContact CD1-CZ3 4.22Å; L118-W434 HydrophobicContact CD2-CE3 3.98Å; L118-W434 HydrophobicContact CD2-CZ3 4.49Å
119W97.7Very high97.1Very high0 Ų01.9 Ų1.90%01%0.011CC..Hα-helixtrans-56.5-51.1172.5-71.32.6000110.8I115 F116 I121 V122 V123 P124 T199 F203 F223 T227 T230 T231 P288I115-W119 HydrophobicContact CG2-CD2 4.41Å; I115-W119 HydrophobicContact CG2-CZ2 4.12Å; I115-W119 VanDerWaalsContact O-CD1 3.24Å; I115-W119 PolarHBondContact O-N 3.26Å; F116-W119 AromaticContact CD1-CD2 3.93Å; F116-W119 HydrophobicContact CD1-CD2 3.93Å; F116-W119 AromaticContact CD1-CE3 3.58Å; F116-W119 HydrophobicContact CD1-CE3 3.58Å; F116-W119 HydrophobicContact CD1-CH2 4.13Å; F116-W119 HydrophobicContact CD1-CZ2 4.44Å; F116-W119 AromaticContact CD1-CZ3 3.69Å; F116-W119 HydrophobicContact CD1-CZ3 3.69Å; F116-W119 HydrophobicContact CE1-CD2 4.46Å; F116-W119 AromaticContact CE1-CE3 3.91Å; F116-W119 HydrophobicContact CE1-CE3 3.91Å; F116-W119 AromaticContact CE1-CH2 3.68Å; F116-W119 HydrophobicContact CE1-CH2 3.68Å; F116-W119 HydrophobicContact CE1-CZ2 4.25Å; F116-W119 AromaticContact CE1-CZ3 3.48Å; F116-W119 HydrophobicContact CE1-CZ3 3.48Å; F116-W119 VanDerWaalsContact CE1-CZ3 3.48Å; F116-W119 PolarHBondContact O-N 3.35Å; W119-I121 VanDerWaalsContact C-N 3.33Å; W119-I121 PolarHBondContact O-N 3Å; W119-V122 PolarHBondContact O-N 3.23Å; W119-V123 HydrophobicContact CB-CG2 4.33Å; W119-V123 VanDerWaalsContact O-CB 3.28Å; W119-V123 WeakPolarHBondContact O-CB 3.48Å; W119-V123 PolarHBondContact O-N 2.85Å; W119-P124 WeakPolarHBondContact O-CD 3.05Å; W119-T199 HydrophobicContact CE3-CG2 4.3Å; W119-T199 HydrophobicContact CZ3-CG2 4.41Å; W119-F203 HydrophobicContact CB-CD1 4.32Å; W119-F203 HydrophobicContact CB-CE1 3.89Å; W119-F203 HydrophobicContact CB-CE2 4.3Å; W119-F203 HydrophobicContact CB-CZ 3.9Å; W119-F203 HydrophobicContact CE3-CB 4.37Å; W119-F203 AromaticContact CE3-CD2 3.93Å; W119-F203 HydrophobicContact CE3-CD2 3.93Å; W119-F203 HydrophobicContact CE3-CE2 4.44Å; W119-F203 HydrophobicContact CE3-CG 4.03Å; W119-F203 WeakPolarHBondContact O-CE1 3.35Å; W119-F223 AromaticContact CD1-CZ 3.68Å; W119-T227 HydrophobicContact CD2-CG2 3.47Å; W119-T227 VanDerWaalsContact CD2-CG2 3.47Å; W119-T227 VanDerWaalsContact CE2-CG2 3.42Å; W119-T227 HydrophobicContact CE3-CG2 3.89Å; W119-T227 HydrophobicContact CG-CG2 3.81Å; W119-T227 HydrophobicContact CH2-CG2 4.21Å; W119-T227 HydrophobicContact CZ2-CG2 3.82Å; W119-T227 HydrophobicContact CZ3-CG2 4.24Å; W119-T227 PolarHBondContact NE1-OG1 2.87Å; W119-T227 VanDerWaalsContact NE1-OG1 3.13Å; W119-T230 HydrophobicContact CH2-CG2 3.7Å; W119-T230 HydrophobicContact CZ2-CG2 3.63Å; W119-T231 HydrophobicContact CH2-CG2 3.95Å; W119-T231 HydrophobicContact CZ3-CG2 3.77Å; W119-P288 HydrophobicContact CZ2-CB 4.43Å; W119-P288 HydrophobicContact CZ2-CG 3.63Å
120N98.2Very high97Very high0 Ų05.5 Ų5.50%03%0.025CC..Hα-helixtrans-56.6-45.4178-91.9-75.7000112H53 F116 G117 L118 N138 F203H53-N120 PolarHBondContact ND1-O 2.86Å; H53-N120 WeakPolarHBondContact O-CB 3.45Å; F116-N120 VanDerWaalsContact O-CB 3.31Å; F116-N120 WeakPolarHBondContact O-CB 3.45Å; F116-N120 PolarHBondContact O-N 2.79Å; F116-N120 PolarHBondContact O-ND2 3.3Å; G117-N120 PolarHBondContact O-N 3.29Å; L118-N120 VanDerWaalsContact C-N 3.33Å; L118-N120 PolarHBondContact O-N 3.28Å; N120-N138 PolarHBondContact OD1-ND2 3.47Å; N120-N138 PolarHBondContact OD1-OD1 2.99Å; N120-F203 HydrophobicContact CB-CZ 4.34Å
121I97.5Very high97Very high4 Ų46.1 Ų6.12%0.0213%0.029CC..Hα-helixtrans-73.3-45.3-177.7-70156.7000112I58 L61 G117 L118 W119 L125 M438I58-I121 HydrophobicContact CG1-CD1 4.2Å; L61-I121 HydrophobicContact CD1-CD1 3.45Å; L61-I121 VanDerWaalsContact CD1-CD1 3.45Å; L61-I121 HydrophobicContact CG-CD1 4.32Å; G117-I121 WeakPolarHBondContact O-CD1 3.21Å; G117-I121 WeakPolarHBondContact O-CG1 3.25Å; G117-I121 PolarHBondContact O-N 3.37Å; L118-I121 PolarHBondContact O-N 2.9Å; W119-I121 VanDerWaalsContact C-N 3.33Å; W119-I121 PolarHBondContact O-N 3Å; I121-L125 VanDerWaalsContact O-CD1 3.24Å; I121-L125 WeakPolarHBondContact O-CD1 3.37Å; I121-L125 WeakPolarHBondContact O-CG 3.49Å; I121-M438 HydrophobicContact CD1-CG 3.72Å; I121-M438 HydrophobicContact CD1-SD 3.31Å; I121-M438 WeakPolarHBondContact CD1-SD 3.37Å; I121-M438 HydrophobicContact CG1-CG 4.4Å; I121-M438 HydrophobicContact CG2-CG 4.02Å
122V97.5Very high97Very high1 Ų16.4 Ų6.41%0.0063%0.03CC..Hα-helixtrans-100.1-38.8-161.9-178.80000113L118 W119 L125 Q126 F223 W434 E536L118-V122 WeakPolarHBondContact O-CB 3.42Å; L118-V122 WeakPolarHBondContact O-CG2 3.43Å; L118-V122 PolarHBondContact O-N 3.13Å; W119-V122 PolarHBondContact O-N 3.23Å; V122-L125 WeakPolarHBondContact O-CB 3.28Å; V122-L125 PolarHBondContact O-N 3.06Å; V122-L125 VanDerWaalsContact O-N 3.15Å; V122-Q126 HydrophobicContact CG1-CG 3.82Å; V122-Q126 WeakPolarHBondContact O-CB 3.45Å; V122-Q126 PolarHBondContact O-N 3.46Å; V122-F223 HydrophobicContact CB-CD1 4.34Å; V122-F223 HydrophobicContact CB-CE1 3.94Å; V122-F223 HydrophobicContact CG1-CD1 3.99Å; V122-F223 HydrophobicContact CG1-CE1 4.11Å; V122-W434 HydrophobicContact CG1-CZ2 3.99Å; V122-W434 HydrophobicContact CG2-CB 4.33Å; V122-W434 HydrophobicContact CG2-CD2 3.61Å; V122-W434 HydrophobicContact CG2-CE3 4.12Å; V122-W434 HydrophobicContact CG2-CG 3.69Å; V122-W434 HydrophobicContact CG2-CZ2 4.39Å; V122-E536 HydrophobicContact CG1-CG 4.47Å
123V98Very high97.1Very high0 Ų07.6 Ų7.60%04%0.04CC..Hα-helixtrans-64.3-47-170.1172.40000112.7W119 L125 Q126 I127 F203 I207 F223 T224 T227W119-V123 HydrophobicContact CB-CG2 4.33Å; W119-V123 VanDerWaalsContact O-CB 3.28Å; W119-V123 WeakPolarHBondContact O-CB 3.48Å; W119-V123 PolarHBondContact O-N 2.85Å; V123-L125 PolarHBondContact O-N 3.39Å; V123-Q126 PolarHBondContact O-N 3.43Å; V123-I127 WeakPolarHBondContact O-CG1 3.22Å; V123-I127 PolarHBondContact O-N 3.12Å; V123-I127 VanDerWaalsContact O-N 3.11Å; V123-F203 HydrophobicContact CB-CD1 4.31Å; V123-F203 HydrophobicContact CB-CE1 4.1Å; V123-F203 HydrophobicContact CG1-CD1 4.13Å; V123-F203 HydrophobicContact CG1-CE1 4.34Å; V123-I207 HydrophobicContact CG1-CD1 3.94Å; V123-I207 HydrophobicContact CG1-CG1 3.77Å; V123-F223 HydrophobicContact CG2-CD1 4.12Å; V123-F223 HydrophobicContact CG2-CE1 3.84Å; V123-T224 HydrophobicContact CG1-CG2 4.46Å; V123-T227 HydrophobicContact CG2-CG2 4.1Å
124P97.6Very high97.1Very high0 Ų011.9 Ų11.90%06%0.059CC..Hα-helixtrans-59.7-35.3175.5-26.538.1000112.7H53 W119 I127 G128 A129 V132H53-P124 HydrophobicContact CB-CG 4.35Å; W119-P124 WeakPolarHBondContact O-CD 3.05Å; P124-I127 WeakPolarHBondContact O-CG1 3.48Å; P124-G128 PolarHBondContact O-N 3.14Å; P124-A129 HydrophobicContact CB-CB 4.43Å; P124-A129 PolarHBondContact O-N 2.73Å; P124-V132 HydrophobicContact CG-CG1 3.78Å
125L96.8Very high97.1Very high3 Ų312.6 Ų12.62%0.0167%0.065CC..Hα-helixtrans-67.7-44.9175.4-60.5177.6000111.6I121 V122 V123 I127 G128 L535 E536 T539 P544 N548 F549I121-L125 VanDerWaalsContact O-CD1 3.24Å; I121-L125 WeakPolarHBondContact O-CD1 3.37Å; I121-L125 WeakPolarHBondContact O-CG 3.49Å; V122-L125 WeakPolarHBondContact O-CB 3.28Å; V122-L125 PolarHBondContact O-N 3.06Å; V122-L125 VanDerWaalsContact O-N 3.15Å; V123-L125 PolarHBondContact O-N 3.39Å; L125-I127 VanDerWaalsContact C-N 3.26Å; L125-I127 PolarHBondContact O-N 3.23Å; L125-G128 PolarHBondContact O-N 2.6Å; L125-L535 WeakPolarHBondContact O-CB 3.33Å; L125-E536 HydrophobicContact CB-CB 3.6Å; L125-E536 HydrophobicContact CD1-CB 4.13Å; L125-T539 HydrophobicContact CD2-CG2 4.18Å; L125-P544 HydrophobicContact CD1-CG 4Å; L125-P544 HydrophobicContact CD2-CB 4.25Å; L125-P544 HydrophobicContact CD2-CG 4.16Å; L125-N548 HydrophobicContact CD2-CB 3.65Å; L125-N548 VanDerWaalsContact CD2-CG 3.41Å; L125-F549 HydrophobicContact CD2-CE2 4.36Å; L125-F549 WeakPolarHBondContact O-CE2 3.49Å; L125-F549 WeakPolarHBondContact O-CZ 2.94Å
126Q96.4Very high97Very high0 Ų014.2 Ų14.20%08%0.075CC..Hα-helixtrans-63.6-27.6179.9-89-174.2-100114V122 V123 M215 P221 T224 E536V122-Q126 HydrophobicContact CG1-CG 3.82Å; V122-Q126 WeakPolarHBondContact O-CB 3.45Å; V122-Q126 PolarHBondContact O-N 3.46Å; V123-Q126 PolarHBondContact O-N 3.43Å; Q126-M215 WeakPolarHBondContact O-CE 3.17Å; Q126-P221 HydrophobicContact CB-CG 4.12Å; Q126-P221 HydrophobicContact CG-CB 4.3Å; Q126-P221 HydrophobicContact CG-CG 4.13Å; Q126-T224 WeakPolarHBondContact CB-OG1 3.39Å; Q126-T224 PolarHBondContact OE1-OG1 3.21Å; Q126-E536 VanDerWaalsContact CG-CD 3.49Å; Q126-E536 WeakPolarHBondContact CG-OE2 3.41Å; Q126-E536 PolarHBondContact NE2-OE1 3.25Å
127I96.5Very high97Very high0 Ų016.9 Ų16.90%09%0.089CC..THydrogen-bonded Turntrans-96.5-0.5177.969.8177.7000113.6V123 P124 L125 A129 T206 C210 K211 T212 M215 T224V123-I127 WeakPolarHBondContact O-CG1 3.22Å; V123-I127 PolarHBondContact O-N 3.12Å; V123-I127 VanDerWaalsContact O-N 3.11Å; P124-I127 WeakPolarHBondContact O-CG1 3.48Å; L125-I127 VanDerWaalsContact C-N 3.26Å; L125-I127 PolarHBondContact O-N 3.23Å; I127-A129 HydrophobicContact CD1-CB 3.89Å; I127-A129 HydrophobicContact CG1-CB 3.72Å; I127-T206 HydrophobicContact CD1-CG2 3.81Å; I127-C210 HydrophobicContact CD1-CB 4.39Å; I127-K211 HydrophobicContact CB-CB 3.94Å; I127-K211 CarbonylContact O-C 3.45Å; I127-K211 WeakPolarHBondContact O-CA 3.39Å; I127-T212 PolarHBondContact O-N 3.46Å; I127-M215 HydrophobicContact CB-SD 4.34Å; I127-M215 HydrophobicContact CG2-SD 4.4Å; I127-T224 HydrophobicContact CG2-CG2 3.52Å
128G94.8Very high97Very high4 Ų416.9 Ų16.94%0.0419%0.089CC..THydrogen-bonded Turntrans74.422.3-178.200000114.6P124 L125P124-G128 PolarHBondContact O-N 3.14Å; L125-G128 PolarHBondContact O-N 2.6Å
129A96.1Very high97Very high7 Ų716.9 Ų16.96%0.0589%0.089CC..  trans-89154.4179.500000112.1P124 I127 C210 N548P124-A129 HydrophobicContact CB-CB 4.43Å; P124-A129 PolarHBondContact O-N 2.73Å; I127-A129 HydrophobicContact CD1-CB 3.89Å; I127-A129 HydrophobicContact CG1-CB 3.72Å; A129-C210 HydrophobicContact CB-CB 4.1Å; A129-C210 WeakPolarHBondContact CB-O 3.35Å; A129-N548 PolarHBondContact O-ND2 2.99Å
130R95.6Very high97Very high76 Ų7617.9 Ų17.929%0.2879%0.094SC..SBendtrans-81.5-29.7176.3-62.5-172.3171.2144.7-4.3113.3Y547 N548 A550 M582R130-Y547 WeakPolarHBondContact CG-O 3.38Å; R130-N548 PolarHBondContact O-ND2 3.02Å; R130-A550 PolarHBondContact NH2-O 2.82Å; R130-M582 HydrophobicContact CB-SD 4.38Å
131D96.4Very high97Very high18 Ų1817.9 Ų17.910%0.0969%0.094CC..SBendtrans-160.9-179176.3-153.7-9.4000109.4H53 P135 P583H53-D131 WeakPolarHBondContact CB-OD1 3.4Å; H53-D131 IonicContact CD2-OD1 3.7Å; H53-D131 PolarHBondContact CD2-OD1 3Å; H53-D131 VanDerWaalsContact CD2-OD1 3.29Å; H53-D131 IonicContact CG-OD1 4Å; H53-D131 PolarHBondContact N-OD1 3.47Å; D131-P135 HydrophobicContact CB-CG 4.38Å; D131-P135 WeakPolarHBondContact OD2-CG 3.36Å; D131-P583 WeakPolarHBondContact OD2-CG 3.47Å
132V97.7Very high97.1Very high7 Ų717.9 Ų17.94%0.0429%0.094CC..  trans-73162.1170.2-63.40000112.2H53 P124 F134 P135 N138 N202 F203 T206H53-V132 HydrophobicContact CB-CG1 4.1Å; P124-V132 HydrophobicContact CG-CG1 3.78Å; V132-F134 VanDerWaalsContact C-N 3.31Å; V132-F134 PolarHBondContact O-N 3.49Å; V132-P135 HydrophobicContact CG2-CG 4.37Å; V132-P135 WeakPolarHBondContact O-CD 3.46Å; V132-P135 WeakPolarHBondContact O-CG 3.39Å; V132-N138 HydrophobicContact CG2-CB 3.96Å; V132-N202 WeakPolarHBondContact CG2-ND2 3.31Å; V132-F203 HydrophobicContact CG1-CE1 4.09Å; V132-F203 HydrophobicContact CG1-CZ 3.94Å; V132-T206 HydrophobicContact CB-CG2 4.4Å; V132-T206 HydrophobicContact CG1-CG2 4.43Å
133A97.6Very high97.1Very high28 Ų2818.5 Ų18.523%0.23110%0.097CC..SBendtrans-59.7-37.4-177.800000113.4V205 T206A133-V205 HydrophobicContact CB-CB 4.09Å; A133-V205 HydrophobicContact CB-CG1 3.76Å; A133-T206 WeakPolarHBondContact CB-OG1 3.36Å; A133-T206 PolarHBondContact N-OG1 3.18Å
134F97.3Very high97.1Very high91 Ų9119.1 Ų19.140%0.39910%0.1SC..  trans-127.780.2-179.8-49.3-69.7000111.5V132 V136 L137 N138 N202 V205V132-F134 VanDerWaalsContact C-N 3.31Å; V132-F134 PolarHBondContact O-N 3.49Å; F134-V136 VanDerWaalsContact C-N 3.32Å; F134-V136 PolarHBondContact O-N 2.9Å; F134-L137 HydrophobicContact CB-CB 3.67Å; F134-L137 HydrophobicContact CB-CD2 4.27Å; F134-L137 HydrophobicContact CD2-CD2 4.37Å; F134-L137 PolarHBondContact O-N 2.84Å; F134-L137 VanDerWaalsContact O-N 3.12Å; F134-N138 PolarHBondContact O-N 2.99Å; F134-N202 HydrophobicContact CD2-CB 4.32Å; F134-N202 WeakPolarHBondContact CD2-OD1 3Å; F134-N202 PolarHBondContact N-OD1 3.29Å; F134-N202 PolarHBondContact O-ND2 3.44Å; F134-V205 HydrophobicContact CE2-CB 3.83Å; F134-V205 HydrophobicContact CE2-CG1 3.99Å; F134-V205 HydrophobicContact CE2-CG2 3.86Å; F134-V205 HydrophobicContact CZ-CB 4.34Å; F134-V205 HydrophobicContact CZ-CG1 4.03Å; F134-V205 HydrophobicContact CZ-CG2 4.28Å
135P97Very high97.1Very high22 Ų2219.4 Ų19.414%0.14310%0.101CC..Hα-helixtrans-60.6-36.2-175.3-25.535.5000114V51 D131 V132 N138 N139 P583V51-P135 HydrophobicContact CB-CB 3.82Å; V51-P135 HydrophobicContact CG1-CB 4.47Å; V51-P135 HydrophobicContact CG2-CB 4.44Å; D131-P135 HydrophobicContact CB-CG 4.38Å; D131-P135 WeakPolarHBondContact OD2-CG 3.36Å; V132-P135 HydrophobicContact CG2-CG 4.37Å; V132-P135 WeakPolarHBondContact O-CD 3.46Å; V132-P135 WeakPolarHBondContact O-CG 3.39Å; P135-N138 WeakPolarHBondContact O-CB 2.99Å; P135-N138 PolarHBondContact O-N 3.38Å; P135-N139 PolarHBondContact O-N 2.94Å; P135-N139 VanDerWaalsContact O-N 3.14Å; P135-P583 HydrophobicContact CB-CB 4.23Å; P135-P583 HydrophobicContact CB-CG 4.01Å; P135-P583 HydrophobicContact CG-CB 4.21Å; P135-P583 HydrophobicContact CG-CG 3.92Å
136V95.9Very high97.2Very high35 Ų3522 Ų2221%0.21211%0.112CC..Hα-helixtrans-66.4-431751760000111.6F134 N138 N139 V140 T586F134-V136 VanDerWaalsContact C-N 3.32Å; F134-V136 PolarHBondContact O-N 2.9Å; V136-N138 VanDerWaalsContact C-N 3.25Å; V136-N138 PolarHBondContact O-N 3.04Å; V136-N139 WeakPolarHBondContact O-CB 3.09Å; V136-N139 PolarHBondContact O-N 3.19Å; V136-V140 WeakPolarHBondContact O-CG2 3.4Å; V136-V140 PolarHBondContact O-N 3.1Å; V136-T586 HydrophobicContact CB-CG2 4.39Å; V136-T586 HydrophobicContact CG1-CG2 4.08Å; V136-T586 HydrophobicContact CG2-CG2 4.11Å
137L96.7Very high97.3Very high59 Ų5922 Ų2231%0.30911%0.112SC..Hα-helixtrans-64.1-36.4177.6-173.364.4000110.5F134 N139 V140 S141 A198F134-L137 HydrophobicContact CB-CB 3.67Å; F134-L137 HydrophobicContact CB-CD2 4.27Å; F134-L137 HydrophobicContact CD2-CD2 4.37Å; F134-L137 PolarHBondContact O-N 2.84Å; F134-L137 VanDerWaalsContact O-N 3.12Å; L137-N139 PolarHBondContact O-N 2.69Å; L137-V140 PolarHBondContact O-N 3.07Å; L137-S141 PolarHBondContact O-N 3.28Å; L137-S141 PolarHBondContact O-OG 3.5Å; L137-S141 VanDerWaalsContact O-OG 3.08Å; L137-A198 HydrophobicContact CD1-CB 3.88Å; L137-A198 HydrophobicContact CD2-CB 4.23Å; L137-A198 HydrophobicContact CG-CB 4Å
138N98.1Very high97.3Very high0 Ų022 Ų220%011%0.112CC..Hα-helixtrans-60.9-42.3174.9-157.238.4000112.8N120 V132 F134 P135 V136 S141 F142N120-N138 PolarHBondContact OD1-ND2 3.47Å; N120-N138 PolarHBondContact OD1-OD1 2.99Å; V132-N138 HydrophobicContact CG2-CB 3.96Å; F134-N138 PolarHBondContact O-N 2.99Å; P135-N138 WeakPolarHBondContact O-CB 2.99Å; P135-N138 PolarHBondContact O-N 3.38Å; V136-N138 VanDerWaalsContact C-N 3.25Å; V136-N138 PolarHBondContact O-N 3.04Å; N138-S141 PolarHBondContact O-N 3.3Å; N138-F142 PolarHBondContact O-N 2.87Å
139N97.9Very high97.5Very high0 Ų022.4 Ų22.40%011%0.113CC..Hα-helixtrans-62.6-45.1172.8179.7-85.5000111.3F48 S50 I56 P135 V136 L137 F142 W143 T586 G589F48-N139 PolarHBondContact O-ND2 2.81Å; S50-N139 PolarHBondContact O-ND2 2.86Å; I56-N139 HydrophobicContact CD1-CB 4.41Å; P135-N139 PolarHBondContact O-N 2.94Å; P135-N139 VanDerWaalsContact O-N 3.14Å; V136-N139 WeakPolarHBondContact O-CB 3.09Å; V136-N139 PolarHBondContact O-N 3.19Å; L137-N139 PolarHBondContact O-N 2.69Å; N139-F142 PolarHBondContact O-N 3.46Å; N139-W143 PolarHBondContact O-N 3.5Å; N139-T586 HydrophobicContact CB-CG2 4.34Å; N139-G589 VanDerWaalsContact OD1-CA 3.24Å; N139-G589 WeakPolarHBondContact OD1-CA 3.32Å; N139-G589 PolarHBondContact OD1-N 3.28Å
140V97.7Very high97.5Very high20 Ų2024.8 Ų24.812%0.12112%0.124CC..Hα-helixtrans-60.5-45.9175.91750000111.3V136 L137 F142 W143 L144 V588 I592V136-V140 WeakPolarHBondContact O-CG2 3.4Å; V136-V140 PolarHBondContact O-N 3.1Å; L137-V140 PolarHBondContact O-N 3.07Å; V140-F142 VanDerWaalsContact C-N 3.31Å; V140-F142 PolarHBondContact O-N 3.31Å; V140-W143 PolarHBondContact O-N 3.47Å; V140-L144 HydrophobicContact CG1-CD1 3.84Å; V140-L144 HydrophobicContact CG1-CG 4.14Å; V140-L144 WeakPolarHBondContact O-CG 3.39Å; V140-L144 PolarHBondContact O-N 2.85Å; V140-V588 HydrophobicContact CG2-CG1 4.18Å; V140-I592 HydrophobicContact CG2-CD1 4.48Å
141S98.2Very high97.5Very high0 Ų021.1 Ų21.10%011%0.111CC..Hα-helixtrans-55.8-44.1178.4-67.80000112.7Y60 L137 N138 F145 G195 A198 T199Y60-S141 VanDerWaalsContact OH-C 3.3Å; Y60-S141 PolarHBondContact OH-O 3.4Å; L137-S141 PolarHBondContact O-N 3.28Å; L137-S141 PolarHBondContact O-OG 3.5Å; L137-S141 VanDerWaalsContact O-OG 3.08Å; N138-S141 PolarHBondContact O-N 3.3Å; S141-F145 PolarHBondContact O-N 3.35Å; S141-F145 VanDerWaalsContact O-N 3.07Å; S141-G195 WeakPolarHBondContact CB-O 3.37Å; S141-G195 PolarHBondContact OG-O 3.11Å; S141-A198 VanDerWaalsContact OG-CB 3.23Å; S141-A198 WeakPolarHBondContact OG-CB 3.39Å; S141-T199 VanDerWaalsContact CB-OG1 3.26Å; S141-T199 WeakPolarHBondContact CB-OG1 3.42Å; S141-T199 PolarHBondContact OG-N 2.95Å; S141-T199 PolarHBondContact OG-OG1 3.07Å
142F98.4Very high97.5Very high4 Ų420.3 Ų20.32%0.01811%0.106CC..Hα-helixtrans-61.8-47.6176.9172.5-98.4000111.8I56 M59 Y60 N138 N139 V140 L144 F145 F146I56-F142 HydrophobicContact CG2-CB 4.05Å; M59-F142 HydrophobicContact CB-CD2 4.23Å; M59-F142 HydrophobicContact CB-CE1 4.11Å; M59-F142 HydrophobicContact CB-CE2 3.51Å; M59-F142 HydrophobicContact CB-CZ 3.45Å; M59-F142 VanDerWaalsContact CB-CZ 3.45Å; M59-F142 HydrophobicContact CE-CD1 3.84Å; M59-F142 HydrophobicContact CE-CE1 3.81Å; M59-F142 HydrophobicContact CE-CG 4.34Å; M59-F142 HydrophobicContact CE-CZ 4.31Å; M59-F142 HydrophobicContact CG-CZ 4.36Å; M59-F142 HydrophobicContact SD-CE1 3.95Å; M59-F142 HydrophobicContact SD-CZ 4.19Å; Y60-F142 AromaticContact CD1-CD2 3.95Å; Y60-F142 HydrophobicContact CD1-CD2 3.95Å; Y60-F142 HydrophobicContact CD1-CE2 4.41Å; Y60-F142 HydrophobicContact CD2-CB 4.49Å; Y60-F142 AromaticContact CD2-CD2 3.73Å; Y60-F142 HydrophobicContact CD2-CD2 3.73Å; Y60-F142 HydrophobicContact CE1-CD2 4.01Å; Y60-F142 HydrophobicContact CE2-CB 3.79Å; Y60-F142 AromaticContact CE2-CD2 3.78Å; Y60-F142 HydrophobicContact CE2-CD2 3.78Å; Y60-F142 HydrophobicContact CE2-CG 4.28Å; Y60-F142 AromaticContact CG-CD2 3.82Å; Y60-F142 HydrophobicContact CG-CD2 3.82Å; Y60-F142 HydrophobicContact CG-CE2 4.32Å; Y60-F142 AromaticContact CZ-CD2 3.93Å; Y60-F142 VanDerWaalsContact OH-CA 3.26Å; Y60-F142 WeakPolarHBondContact OH-CA 3.24Å; Y60-F142 PolarHBondContact OH-N 3.27Å; N138-F142 PolarHBondContact O-N 2.87Å; N139-F142 PolarHBondContact O-N 3.46Å; V140-F142 VanDerWaalsContact C-N 3.31Å; V140-F142 PolarHBondContact O-N 3.31Å; F142-L144 PolarHBondContact O-N 3.31Å; F142-F145 HydrophobicContact CD2-CD1 4.28Å; F142-F145 HydrophobicContact CE2-CD1 4.31Å; F142-F145 HydrophobicContact CE2-CE1 4.41Å; F142-F145 WeakPolarHBondContact O-CB 3.43Å; F142-F145 PolarHBondContact O-N 3.5Å; F142-F146 HydrophobicContact CE1-CB 4.43Å; F142-F146 HydrophobicContact CZ-CB 4.42Å; F142-F146 HydrophobicContact CZ-CD2 4.21Å; F142-F146 WeakPolarHBondContact O-CB 3.46Å; F142-F146 PolarHBondContact O-N 2.87Å
143W98.3Very high97.3Very high15 Ų1521.8 Ų21.86%0.05711%0.114CC..Hα-helixtrans-70.6-29.6-177.6-75.8112.7000113.6F48 N139 V140 F146 A147 G589 F590F48-W143 HydrophobicContact CB-CH2 4.47Å; F48-W143 HydrophobicContact CB-CZ2 3.77Å; F48-W143 AromaticContact CD1-CH2 3.86Å; F48-W143 HydrophobicContact CD1-CH2 3.86Å; F48-W143 AromaticContact CD1-CZ2 3.78Å; F48-W143 HydrophobicContact CD1-CZ2 3.78Å; F48-W143 HydrophobicContact CE1-CH2 4.31Å; F48-W143 HydrophobicContact CG-CH2 4.18Å; F48-W143 AromaticContact CG-CZ2 3.93Å; F48-W143 HydrophobicContact CG-CZ2 3.93Å; F48-W143 PolarHBondContact O-NE1 3.18Å; F48-W143 VanDerWaalsContact O-NE1 3.08Å; N139-W143 PolarHBondContact O-N 3.5Å; V140-W143 PolarHBondContact O-N 3.47Å; W143-F146 HydrophobicContact CE3-CB 4.25Å; W143-F146 AromaticContact CE3-CD1 3.73Å; W143-F146 HydrophobicContact CE3-CD1 3.73Å; W143-F146 HydrophobicContact CE3-CE1 4.4Å; W143-F146 HydrophobicContact CE3-CG 4.22Å; W143-F146 AromaticContact CZ3-CD1 3.5Å; W143-F146 HydrophobicContact CZ3-CD1 3.5Å; W143-F146 VanDerWaalsContact CZ3-CD1 3.5Å; W143-F146 AromaticContact CZ3-CE1 3.72Å; W143-F146 HydrophobicContact CZ3-CE1 3.72Å; W143-F146 HydrophobicContact CZ3-CG 4.17Å; W143-F146 PolarHBondContact O-N 2.93Å; W143-A147 VanDerWaalsContact O-CB 3.25Å; W143-A147 WeakPolarHBondContact O-CB 3.35Å; W143-A147 PolarHBondContact O-N 3.21Å; W143-G589 WeakPolarHBondContact CB-O 3.4Å; W143-F590 VanDerWaalsContact CD1-N 3.3Å; W143-F590 HydrophobicContact CD2-CB 4.41Å; W143-F590 HydrophobicContact CD2-CD2 4.06Å; W143-F590 AromaticContact CE2-CD2 3.72Å; W143-F590 HydrophobicContact CE3-CD2 4.05Å; W143-F590 AromaticContact CH2-CD2 3.48Å; W143-F590 HydrophobicContact CH2-CD2 3.48Å; W143-F590 VanDerWaalsContact CH2-CD2 3.48Å; W143-F590 AromaticContact CH2-CE2 3.74Å; W143-F590 HydrophobicContact CH2-CE2 3.74Å; W143-F590 HydrophobicContact CZ2-CB 4.48Å; W143-F590 AromaticContact CZ2-CD2 3.45Å; W143-F590 HydrophobicContact CZ2-CD2 3.45Å; W143-F590 VanDerWaalsContact CZ2-CD2 3.45Å; W143-F590 HydrophobicContact CZ2-CE2 4.13Å; W143-F590 HydrophobicContact CZ2-CG 4.4Å; W143-F590 AromaticContact CZ3-CD2 3.77Å; W143-F590 HydrophobicContact CZ3-CD2 3.77Å; W143-F590 HydrophobicContact CZ3-CE2 4.04Å
144L98.3Very high97Very high13 Ų1322.6 Ų22.67%0.06811%0.114CC..Hα-helixtrans-66.9-46.1170.3-70176.1000111.7V140 F142 F146 A147 G148 I191 L194 I592 M596V140-L144 HydrophobicContact CG1-CD1 3.84Å; V140-L144 HydrophobicContact CG1-CG 4.14Å; V140-L144 WeakPolarHBondContact O-CG 3.39Å; V140-L144 PolarHBondContact O-N 2.85Å; F142-L144 PolarHBondContact O-N 3.31Å; L144-F146 VanDerWaalsContact C-N 3.34Å; L144-F146 PolarHBondContact O-N 3.39Å; L144-A147 PolarHBondContact O-N 3.18Å; L144-G148 PolarHBondContact O-N 3.2Å; L144-I191 HydrophobicContact CD2-CG2 4.16Å; L144-I191 WeakPolarHBondContact O-CG2 3.47Å; L144-L194 HydrophobicContact CD1-CB 4.09Å; L144-I592 HydrophobicContact CD2-CG2 3.97Å; L144-M596 HydrophobicContact CD2-CB 4.47Å; L144-M596 HydrophobicContact CD2-CE 4.09Å; L144-M596 HydrophobicContact CD2-CG 3.74Å; L144-M596 HydrophobicContact CD2-SD 4.48Å
145F98.2Very high96.8Very high5 Ų518.2 Ų18.22%0.02210%0.095CC..Hα-helixtrans-55.8-49.6171.2153.5-102.5000111.2Y60 C63 F109 P113 S141 F142 A147 G148 M149Y60-F145 AromaticContact CD1-CD1 3.73Å; Y60-F145 HydrophobicContact CD1-CD1 3.73Å; Y60-F145 AromaticContact CD1-CE1 3.87Å; Y60-F145 HydrophobicContact CD1-CE1 3.87Å; Y60-F145 HydrophobicContact CD1-CG 4.34Å; Y60-F145 HydrophobicContact CE1-CB 4.01Å; Y60-F145 AromaticContact CE1-CD1 3.43Å; Y60-F145 HydrophobicContact CE1-CD1 3.43Å; Y60-F145 VanDerWaalsContact CE1-CD1 3.43Å; Y60-F145 HydrophobicContact CE1-CD2 4.5Å; Y60-F145 HydrophobicContact CE1-CE1 4.05Å; Y60-F145 AromaticContact CE1-CG 3.7Å; Y60-F145 HydrophobicContact CE1-CG 3.7Å; C63-F145 HydrophobicContact CB-CE1 3.71Å; C63-F145 HydrophobicContact CB-CZ 3.88Å; F109-F145 HydrophobicContact CD1-CD2 4.26Å; F109-F145 AromaticContact CD1-CE2 3.86Å; F109-F145 HydrophobicContact CD1-CE2 3.86Å; P113-F145 HydrophobicContact CB-CD2 4.31Å; P113-F145 HydrophobicContact CB-CE1 3.99Å; P113-F145 HydrophobicContact CB-CE2 3.61Å; P113-F145 HydrophobicContact CB-CZ 3.44Å; P113-F145 VanDerWaalsContact CB-CZ 3.44Å; P113-F145 HydrophobicContact CG-CD2 4.5Å; P113-F145 HydrophobicContact CG-CE2 3.54Å; P113-F145 HydrophobicContact CG-CZ 3.61Å; S141-F145 PolarHBondContact O-N 3.35Å; S141-F145 VanDerWaalsContact O-N 3.07Å; F142-F145 HydrophobicContact CD2-CD1 4.28Å; F142-F145 HydrophobicContact CE2-CD1 4.31Å; F142-F145 HydrophobicContact CE2-CE1 4.41Å; F142-F145 WeakPolarHBondContact O-CB 3.43Å; F142-F145 PolarHBondContact O-N 3.5Å; F145-A147 VanDerWaalsContact C-N 3.33Å; F145-A147 PolarHBondContact O-N 2.72Å; F145-G148 PolarHBondContact O-N 2.64Å; F145-M149 HydrophobicContact CE1-SD 4.39Å; F145-M149 HydrophobicContact CE2-CB 4.39Å; F145-M149 HydrophobicContact CZ-CB 4.44Å; F145-M149 HydrophobicContact CZ-SD 3.91Å; F145-M149 WeakPolarHBondContact O-CB 3.17Å; F145-M149 PolarHBondContact O-N 3.29Å
146F98.1Very high96.1Very high58 Ų5820 Ų2025%0.25410%0.1SC..Hα-helixtrans-63.1-39.3-178.6-172.5-99.6000111.9F142 W143 L144 M149 I150F142-F146 HydrophobicContact CE1-CB 4.43Å; F142-F146 HydrophobicContact CZ-CB 4.42Å; F142-F146 HydrophobicContact CZ-CD2 4.21Å; F142-F146 WeakPolarHBondContact O-CB 3.46Å; F142-F146 PolarHBondContact O-N 2.87Å; W143-F146 HydrophobicContact CE3-CB 4.25Å; W143-F146 AromaticContact CE3-CD1 3.73Å; W143-F146 HydrophobicContact CE3-CD1 3.73Å; W143-F146 HydrophobicContact CE3-CE1 4.4Å; W143-F146 HydrophobicContact CE3-CG 4.22Å; W143-F146 AromaticContact CZ3-CD1 3.5Å; W143-F146 HydrophobicContact CZ3-CD1 3.5Å; W143-F146 VanDerWaalsContact CZ3-CD1 3.5Å; W143-F146 AromaticContact CZ3-CE1 3.72Å; W143-F146 HydrophobicContact CZ3-CE1 3.72Å; W143-F146 HydrophobicContact CZ3-CG 4.17Å; W143-F146 PolarHBondContact O-N 2.93Å; L144-F146 VanDerWaalsContact C-N 3.34Å; L144-F146 PolarHBondContact O-N 3.39Å; F146-M149 HydrophobicContact CD2-CE 3.42Å; F146-M149 VanDerWaalsContact CD2-CE 3.42Å; F146-M149 HydrophobicContact CE2-CE 3.5Å; F146-M149 VanDerWaalsContact CE2-CE 3.5Å; F146-M149 HydrophobicContact CG-CE 4.33Å; F146-M149 HydrophobicContact CZ-CE 4.48Å; F146-M149 PolarHBondContact O-N 3.23Å; F146-I150 HydrophobicContact CD1-CD1 3.68Å; F146-I150 HydrophobicContact CD1-CG1 4.31Å; F146-I150 HydrophobicContact CE1-CD1 3.13Å; F146-I150 HydrophobicContact CE1-CG1 4.03Å; F146-I150 HydrophobicContact CZ-CD1 3.61Å; F146-I150 HydrophobicContact CZ-CG1 4.23Å; F146-I150 WeakPolarHBondContact O-CG1 3.38Å; F146-I150 PolarHBondContact O-N 3.15Å
147A98.1Very high95.5Very high0 Ų019.7 Ų19.70%010%0.097CC..Hα-helixtrans-61.3-46.6174.400000111.9W143 L144 F145 I150 L151 I191 M596 T597W143-A147 VanDerWaalsContact O-CB 3.25Å; W143-A147 WeakPolarHBondContact O-CB 3.35Å; W143-A147 PolarHBondContact O-N 3.21Å; L144-A147 PolarHBondContact O-N 3.18Å; F145-A147 VanDerWaalsContact C-N 3.33Å; F145-A147 PolarHBondContact O-N 2.72Å; A147-I150 PolarHBondContact O-N 2.87Å; A147-L151 WeakPolarHBondContact O-CG 3.25Å; A147-L151 PolarHBondContact O-N 3.45Å; A147-I191 HydrophobicContact CB-CG2 4.06Å; A147-M596 HydrophobicContact CB-CB 4.28Å; A147-T597 WeakPolarHBondContact CA-OG1 3.45Å; A147-T597 WeakPolarHBondContact CB-OG1 3.24Å
148G97.9Very high95Very high0 Ų018.9 Ų18.90%09%0.093CC..Hα-helixtrans-61.7-44.917400000112.3L144 F145 I150 L151 F152 A188L144-G148 PolarHBondContact O-N 3.2Å; F145-G148 PolarHBondContact O-N 2.64Å; G148-I150 PolarHBondContact O-N 3.32Å; G148-L151 PolarHBondContact O-N 2.81Å; G148-F152 WeakPolarHBondContact O-CB 3.44Å; G148-F152 PolarHBondContact O-N 3.38Å; G148-A188 WeakPolarHBondContact CA-O 3.48Å; G148-A188 WeakPolarHBondContact O-CB 3.38Å
149M97.6Very high94.3Very high13 Ų1319.6 Ų19.66%0.06410%0.1CC..Hα-helixtrans-59.8-45.3178-177.5-169.17100111.9C63 M67 F109 F145 F146 N153C63-M149 HydrophobicContact CB-CE 4.3Å; C63-M149 HydrophobicContact CB-SD 3.86Å; M67-M149 HydrophobicContact CE-CG 4.39Å; M67-M149 HydrophobicContact CE-SD 4.11Å; M67-M149 HydrophobicContact CG-CG 4.12Å; M67-M149 HydrophobicContact CG-SD 3.69Å; M67-M149 HydrophobicContact SD-CG 3.8Å; M67-M149 HydrophobicContact SD-SD 3.97Å; F109-M149 HydrophobicContact CB-CG 4.43Å; F109-M149 HydrophobicContact CD1-CB 3.71Å; F109-M149 HydrophobicContact CD1-CG 4.14Å; F109-M149 HydrophobicContact CE1-CB 4.03Å; F109-M149 HydrophobicContact CG-CB 4.44Å; F109-M149 HydrophobicContact CG-CG 4.41Å; F145-M149 HydrophobicContact CE1-SD 4.39Å; F145-M149 HydrophobicContact CE2-CB 4.39Å; F145-M149 HydrophobicContact CZ-CB 4.44Å; F145-M149 HydrophobicContact CZ-SD 3.91Å; F145-M149 WeakPolarHBondContact O-CB 3.17Å; F145-M149 PolarHBondContact O-N 3.29Å; F146-M149 HydrophobicContact CD2-CE 3.42Å; F146-M149 VanDerWaalsContact CD2-CE 3.42Å; F146-M149 HydrophobicContact CE2-CE 3.5Å; F146-M149 VanDerWaalsContact CE2-CE 3.5Å; F146-M149 HydrophobicContact CG-CE 4.33Å; F146-M149 HydrophobicContact CZ-CE 4.48Å; F146-M149 PolarHBondContact O-N 3.23Å; M149-N153 WeakPolarHBondContact O-CB 3.45Å; M149-N153 PolarHBondContact O-N 3.5Å; M149-N153 PolarHBondContact O-ND2 2.83Å
150I96.1Very high93.8Very high56 Ų5619.9 Ų19.929%0.28710%0.104SC..Hα-helixtrans-61.6-52176-75-179000110F146 A147 G148 F152 N153 L154 T597F146-I150 HydrophobicContact CD1-CD1 3.68Å; F146-I150 HydrophobicContact CD1-CG1 4.31Å; F146-I150 HydrophobicContact CE1-CD1 3.13Å; F146-I150 HydrophobicContact CE1-CG1 4.03Å; F146-I150 HydrophobicContact CZ-CD1 3.61Å; F146-I150 HydrophobicContact CZ-CG1 4.23Å; F146-I150 WeakPolarHBondContact O-CG1 3.38Å; F146-I150 PolarHBondContact O-N 3.15Å; A147-I150 PolarHBondContact O-N 2.87Å; G148-I150 PolarHBondContact O-N 3.32Å; I150-F152 VanDerWaalsContact C-N 3.28Å; I150-F152 PolarHBondContact O-N 3.31Å; I150-N153 PolarHBondContact O-N 3.18Å; I150-N153 VanDerWaalsContact O-N 3.13Å; I150-L154 HydrophobicContact CG2-CD1 3.87Å; I150-L154 HydrophobicContact CG2-CG 4.11Å; I150-L154 VanDerWaalsContact O-CG 3.31Å; I150-L154 WeakPolarHBondContact O-CG 3.36Å; I150-L154 PolarHBondContact O-N 2.56Å; I150-T597 HydrophobicContact CG2-CG2 4.14Å
151L96.4Very high93.5Very high0 Ų019.4 Ų19.40%010%0.101CC..Hα-helixtrans-54.6-46.7-179.8-76.4173.4000111.6A147 G148 N153 L154 S155 Y184 I187 A188 I191 T597 F601 I604A147-L151 WeakPolarHBondContact O-CG 3.25Å; A147-L151 PolarHBondContact O-N 3.45Å; G148-L151 PolarHBondContact O-N 2.81Å; L151-N153 PolarHBondContact O-N 3.23Å; L151-L154 PolarHBondContact O-N 2.86Å; L151-S155 PolarHBondContact O-N 3.45Å; L151-Y184 WeakPolarHBondContact O-CD1 3.21Å; L151-Y184 VanDerWaalsContact O-CE1 3.27Å; L151-Y184 WeakPolarHBondContact O-CE1 3.37Å; L151-I187 HydrophobicContact CD1-CG2 4.41Å; L151-A188 HydrophobicContact CB-CB 4.03Å; L151-I191 HydrophobicContact CD1-CD1 3.54Å; L151-T597 HydrophobicContact CD2-CG2 4.24Å; L151-T597 WeakPolarHBondContact CD2-O 3.07Å; L151-T597 HydrophobicContact CG-CG2 4.33Å; L151-F601 HydrophobicContact CD2-CB 3.86Å; L151-I604 HydrophobicContact CB-CD1 4.49Å; L151-I604 HydrophobicContact CD2-CD1 3.97Å
152F96.7Very high93.3Very high0 Ų019.5 Ų19.50%010%0.101CC..Hα-helixtrans-65.7-38.7179.9-164-111.6000112.7T101 V104 I105 F109 G148 I150 S155 P162 A188T101-F152 HydrophobicContact CG2-CD1 4.1Å; T101-F152 HydrophobicContact CG2-CE1 3.27Å; T101-F152 HydrophobicContact CG2-CZ 3.62Å; V104-F152 HydrophobicContact CB-CE1 3.62Å; V104-F152 HydrophobicContact CB-CE2 4.37Å; V104-F152 HydrophobicContact CB-CZ 3.47Å; V104-F152 VanDerWaalsContact CB-CZ 3.47Å; V104-F152 HydrophobicContact CG1-CD1 4.11Å; V104-F152 HydrophobicContact CG1-CD2 4.46Å; V104-F152 HydrophobicContact CG1-CE1 3.5Å; V104-F152 VanDerWaalsContact CG1-CE1 3.5Å; V104-F152 HydrophobicContact CG1-CE2 3.94Å; V104-F152 HydrophobicContact CG1-CZ 3.43Å; V104-F152 VanDerWaalsContact CG1-CZ 3.43Å; V104-F152 HydrophobicContact CG2-CZ 3.9Å; I105-F152 HydrophobicContact CD1-CD1 3.99Å; I105-F152 HydrophobicContact CD1-CE1 4.2Å; I105-F152 HydrophobicContact CG1-CD1 4.37Å; I105-F152 HydrophobicContact CG1-CE1 4.08Å; F109-F152 HydrophobicContact CD2-CB 4.41Å; F109-F152 AromaticContact CD2-CD1 3.83Å; F109-F152 HydrophobicContact CD2-CD1 3.83Å; F109-F152 HydrophobicContact CD2-CE1 4.47Å; F109-F152 HydrophobicContact CD2-CG 4.31Å; F109-F152 HydrophobicContact CE2-CB 3.59Å; F109-F152 AromaticContact CE2-CD1 3.52Å; F109-F152 HydrophobicContact CE2-CD1 3.52Å; F109-F152 HydrophobicContact CE2-CD2 4.34Å; F109-F152 HydrophobicContact CE2-CE1 4.27Å; F109-F152 AromaticContact CE2-CG 3.55Å; F109-F152 HydrophobicContact CE2-CG 3.55Å; F109-F152 HydrophobicContact CZ-CB 3.88Å; F109-F152 HydrophobicContact CZ-CG 4.27Å; G148-F152 WeakPolarHBondContact O-CB 3.44Å; G148-F152 PolarHBondContact O-N 3.38Å; I150-F152 VanDerWaalsContact C-N 3.28Å; I150-F152 PolarHBondContact O-N 3.31Å; F152-S155 WeakPolarHBondContact O-CB 3.26Å; F152-S155 PolarHBondContact O-N 2.8Å; F152-S155 PolarHBondContact O-OG 3.12Å; F152-P162 HydrophobicContact CE2-CG 3.89Å; F152-P162 HydrophobicContact CZ-CG 4.06Å; F152-A188 HydrophobicContact CB-CB 3.81Å; F152-A188 HydrophobicContact CD2-CB 4.25Å
153N93.3Very high93.1Very high38 Ų3820.5 Ų20.520%0.20311%0.111CC..Hα-helixtrans-73.4-26.2176.7-79.2-81.3000113.2M67 R70 M149 I150 L151 S155 F156M67-N153 PolarHBondContact SD-ND2 2.82Å; R70-N153 PolarHBondContact NH2-OD1 2.84Å; M149-N153 WeakPolarHBondContact O-CB 3.45Å; M149-N153 PolarHBondContact O-N 3.5Å; M149-N153 PolarHBondContact O-ND2 2.83Å; I150-N153 PolarHBondContact O-N 3.18Å; I150-N153 VanDerWaalsContact O-N 3.13Å; L151-N153 PolarHBondContact O-N 3.23Å; N153-S155 PolarHBondContact O-N 3Å; N153-F156 PolarHBondContact O-N 3.28Å
154L91.9Very high92.9Very high45 Ų4520 Ų2024%0.23611%0.11CC..Hα-helixtrans-63.1-28.5172.6-71.7174000111.9I150 L151 F156 I157 I158 Y184 F601I150-L154 HydrophobicContact CG2-CD1 3.87Å; I150-L154 HydrophobicContact CG2-CG 4.11Å; I150-L154 VanDerWaalsContact O-CG 3.31Å; I150-L154 WeakPolarHBondContact O-CG 3.36Å; I150-L154 PolarHBondContact O-N 2.56Å; L151-L154 PolarHBondContact O-N 2.86Å; L154-F156 PolarHBondContact O-N 3.21Å; L154-F156 VanDerWaalsContact O-N 3.1Å; L154-I157 HydrophobicContact CD2-CD1 4.2Å; L154-I157 VanDerWaalsContact O-CG1 3.31Å; L154-I157 WeakPolarHBondContact O-CG1 3.41Å; L154-I157 PolarHBondContact O-N 3.08Å; L154-I158 HydrophobicContact CD2-CD1 4.25Å; L154-I158 PolarHBondContact O-N 3.4Å; L154-Y184 HydrophobicContact CB-CE1 4.27Å; L154-F601 HydrophobicContact CD1-CD2 4.44Å
155S91.1Very high92.7Very high0 Ų019.4 Ų19.40%011%0.106CC..THydrogen-bonded Turntrans-55.8-28.8178.373.20000113.7L151 F152 N153 I157 I158 G160 S161 Y184L151-S155 PolarHBondContact O-N 3.45Å; F152-S155 WeakPolarHBondContact O-CB 3.26Å; F152-S155 PolarHBondContact O-N 2.8Å; F152-S155 PolarHBondContact O-OG 3.12Å; N153-S155 PolarHBondContact O-N 3Å; S155-I157 VanDerWaalsContact C-N 3.29Å; S155-I157 PolarHBondContact O-N 3.39Å; S155-I158 CarbonylContact C-O 3.5Å; S155-I158 WeakPolarHBondContact CA-O 3.48Å; S155-G160 CarbonylContact O-C 3.55Å; S155-G160 WeakPolarHBondContact O-CA 3.46Å; S155-G160 PolarHBondContact O-N 2.6Å; S155-S161 PolarHBondContact O-N 3.25Å; S155-S161 PolarHBondContact OG-OG 2.9Å; S155-Y184 VanDerWaalsContact CB-CG 3.45Å
156F83.1Confident92.6Very high59 Ų5921.4 Ų21.426%0.25911%0.114SC..THydrogen-bonded Turntrans-67.7-29.5-179.9-174.1-115.9000113.3A19 N153 L154A19-F156 HydrophobicContact CB-CD1 4.03Å; A19-F156 HydrophobicContact CB-CE1 3.38Å; A19-F156 HydrophobicContact CB-CZ 4.22Å; N153-F156 PolarHBondContact O-N 3.28Å; L154-F156 PolarHBondContact O-N 3.21Å; L154-F156 VanDerWaalsContact O-N 3.1Å
157I83.2Confident92.5Very high28 Ų2818.8 Ų18.814%0.14410%0.103CC..THydrogen-bonded Turntrans-110.8-27.1-177.753.3166000112.5A19 Q20 A23 L154 S155A19-I157 HydrophobicContact CB-CG2 4.22Å; Q20-I157 HydrophobicContact CG-CB 3.92Å; Q20-I157 HydrophobicContact CG-CG2 4.13Å; Q20-I157 VanDerWaalsContact CG-O 3.31Å; Q20-I157 WeakPolarHBondContact CG-O 3.27Å; Q20-I157 PolarHBondContact NE2-O 3.18Å; A23-I157 HydrophobicContact CB-CD1 4.08Å; A23-I157 HydrophobicContact CB-CG2 4.26Å; L154-I157 HydrophobicContact CD2-CD1 4.2Å; L154-I157 VanDerWaalsContact O-CG1 3.31Å; L154-I157 WeakPolarHBondContact O-CG1 3.41Å; L154-I157 PolarHBondContact O-N 3.08Å; S155-I157 VanDerWaalsContact C-N 3.29Å; S155-I157 PolarHBondContact O-N 3.39Å
158I86.2Confident92.3Very high42 Ų4218.8 Ų18.822%0.21510%0.103CC..BIsolated β-bridgetrans-125.4126.2-173.5-63.7162.8000109L8 L154 S155 G160 Y184 F601 F605L8-I158 HydrophobicContact CD2-CG2 3.51Å; L8-I158 VanDerWaalsContact O-CA 3.28Å; L8-I158 WeakPolarHBondContact O-CA 3.47Å; L154-I158 HydrophobicContact CD2-CD1 4.25Å; L154-I158 PolarHBondContact O-N 3.4Å; S155-I158 CarbonylContact C-O 3.5Å; S155-I158 WeakPolarHBondContact CA-O 3.48Å; I158-G160 PolarHBondContact O-N 2.87Å; I158-Y184 WeakPolarHBondContact CG2-OH 3.4Å; I158-Y184 WeakPolarHBondContact O-CE2 3.45Å; I158-Y184 PolarHBondContact O-OH 2.75Å; I158-Y184 VanDerWaalsContact O-OH 3.12Å; I158-F601 HydrophobicContact CG2-CE2 4.01Å; I158-F601 HydrophobicContact CG2-CZ 4.23Å; I158-F605 HydrophobicContact CG2-CE2 4.03Å; I158-F605 HydrophobicContact CG2-CZ 3.7Å
159G83.8Confident92.1Very high15 Ų1521.9 Ų21.916%0.15512%0.115CC..THydrogen-bonded Turntrans78.1-31.7175.800000116.3Q7 L8 P180Q7-G159 VanDerWaalsContact O-CA 3.23Å; Q7-G159 WeakPolarHBondContact O-CA 3.36Å; Q7-G159 PolarHBondContact O-N 2.89Å; L8-G159 PolarHBondContact O-N 2.98Å; G159-P180 VanDerWaalsContact O-CG 3.24Å; G159-P180 WeakPolarHBondContact O-CG 3.35Å
160G87.2Confident91.9Very high7 Ų721.9 Ų21.97%0.07212%0.117CC..  trans100.7148-177.400000112.5V10 S155 I158 G181V10-G160 VanDerWaalsContact CG2-N 3.32Å; S155-G160 CarbonylContact O-C 3.55Å; S155-G160 WeakPolarHBondContact O-CA 3.46Å; S155-G160 PolarHBondContact O-N 2.6Å; I158-G160 PolarHBondContact O-N 2.87Å; G160-G181 WeakPolarHBondContact O-CA 3.43Å
161S92.3Very high91.7Very high9 Ų921.5 Ų21.56%0.06312%0.118CC..  trans-76.1158.9-178.2-67.30000112T101 S155T101-S161 WeakPolarHBondContact OG1-CB 3.34Å; S155-S161 PolarHBondContact O-N 3.25Å; S155-S161 PolarHBondContact OG-OG 2.9Å
162P93.8Very high91.5Very high2 Ų225.7 Ų25.71%0.01314%0.14CC..  trans-63.9139.217027.1-35.2000111.2E97 S100 F152 G181E97-P162 WeakPolarHBondContact CA-O 3.24Å; S100-P162 WeakPolarHBondContact CB-O 3.47Å; S100-P162 PolarHBondContact OG-O 2.92Å; F152-P162 HydrophobicContact CE2-CG 3.89Å; F152-P162 HydrophobicContact CZ-CG 4.06Å; P162-G181 WeakPolarHBondContact CB-O 3.45Å
163A93Very high91.3Very high26 Ų2625.7 Ų25.722%0.21514%0.14CC..  trans-116.29.4-17800000114.6N96 E97N96-A163 HydrophobicContact CB-CB 4.02Å; E97-A163 HydrophobicContact CG-CB 4Å
164A94.1Very high91.1Very high4 Ų424.6 Ų24.63%0.03314%0.138CC..SBendtrans-101.516.7-174.200000114.4N168 L172 A173A164-N168 VanDerWaalsContact CB-OD1 3.32Å; A164-N168 WeakPolarHBondContact CB-OD1 3.43Å; A164-L172 HydrophobicContact CB-CD2 3.91Å; A164-L172 HydrophobicContact CB-CG 3.98Å; A164-A173 HydrophobicContact CB-CB 4.47Å
165G94Very high90.6Very high0 Ų026.3 Ų26.30%014%0.144CC..THydrogen-bonded Turntrans75.2165.3-173.200000113.7F99 S100 T167 N168F99-G165 VanDerWaalsContact CE2-CA 3.5Å; S100-G165 WeakPolarHBondContact OG-CA 3.34Å; S100-G165 PolarHBondContact OG-N 3.32Å; G165-T167 PolarHBondContact O-N 3.42Å; G165-T167 VanDerWaalsContact O-N 3.11Å; G165-N168 PolarHBondContact O-N 3.49Å
166W96.6Very high90.5Very high47 Ų4732.6 Ų32.618%0.17817%0.172CC..THydrogen-bonded Turntrans-63-18.2179.986-81000114V104 Y185 F274 W275 W277V104-W166 HydrophobicContact CG2-CB 3.82Å; W166-Y185 WeakPolarHBondContact O-CE2 3.41Å; W166-Y185 PolarHBondContact O-OH 3Å; W166-F274 HydrophobicContact CD2-CZ 4.42Å; W166-F274 AromaticContact CE3-CZ 3.83Å; W166-F274 HydrophobicContact CE3-CZ 3.83Å; W166-F274 HydrophobicContact CH2-CE1 4.02Å; W166-F274 AromaticContact CH2-CZ 3.93Å; W166-F274 HydrophobicContact CH2-CZ 3.93Å; W166-F274 HydrophobicContact CZ2-CE1 4.41Å; W166-F274 HydrophobicContact CZ2-CZ 4.49Å; W166-F274 HydrophobicContact CZ3-CE1 4.15Å; W166-F274 AromaticContact CZ3-CZ 3.57Å; W166-F274 HydrophobicContact CZ3-CZ 3.57Å; W166-W275 HydrophobicContact CH2-CH2 4.23Å; W166-W275 HydrophobicContact CH2-CZ3 4.23Å; W166-W275 AromaticContact CZ2-CH2 3.75Å; W166-W275 HydrophobicContact CZ2-CH2 3.75Å; W166-W275 HydrophobicContact CZ2-CZ3 4.19Å; W166-W277 HydrophobicContact CZ3-CH2 4.22Å; W166-W277 HydrophobicContact CZ3-CZ3 4.15Å
167T95.5Very high90.8Very high3 Ų331 Ų312%0.01817%0.169CC..THydrogen-bonded Turntrans-85.5-16.6175.754.60000113.2G165 Y169 W270 F274 W275 R477G165-T167 PolarHBondContact O-N 3.42Å; G165-T167 VanDerWaalsContact O-N 3.11Å; T167-Y169 VanDerWaalsContact C-N 3.32Å; T167-Y169 HydrophobicContact CG2-CE2 4.31Å; T167-Y169 PolarHBondContact O-N 2.87Å; T167-Y169 VanDerWaalsContact O-N 3.16Å; T167-Y169 VanDerWaalsContact OG1-CD2 3.31Å; T167-Y169 WeakPolarHBondContact OG1-CD2 3.48Å; T167-Y169 VanDerWaalsContact OG1-CE2 3.32Å; T167-Y169 WeakPolarHBondContact OG1-CE2 3.21Å; T167-W270 PolarHBondContact O-NE1 2.68Å; T167-F274 HydrophobicContact CG2-CE1 3.81Å; T167-F274 HydrophobicContact CG2-CZ 4.17Å; T167-W275 HydrophobicContact CG2-CH2 4.36Å; T167-W275 HydrophobicContact CG2-CZ2 3.87Å; T167-R477 PolarHBondContact OG1-NH2 2.98Å
168N94Very high90.8Very high1 Ų135 Ų351%0.00520%0.196CC..THydrogen-bonded Turntrans42.752.9175.1-141.1-18.1000113.4A164 G165 A173 Y185 W270A164-N168 VanDerWaalsContact CB-OD1 3.32Å; A164-N168 WeakPolarHBondContact CB-OD1 3.43Å; G165-N168 PolarHBondContact O-N 3.49Å; N168-A173 HydrophobicContact CB-CB 4.34Å; N168-A173 WeakPolarHBondContact O-CB 3.33Å; N168-A173 WeakPolarHBondContact OD1-CB 3.4Å; N168-Y185 HydrophobicContact CB-CD1 4.13Å; N168-Y185 HydrophobicContact CB-CE1 3.79Å; N168-Y185 HydrophobicContact CB-CE2 4.3Å; N168-Y185 WeakPolarHBondContact ND2-CD1 3.41Å; N168-W270 HydrophobicContact CB-CZ2 4.44Å; N168-W270 PolarHBondContact O-NE1 2.94Å
169Y95Very high90.9Very high65 Ų6534.7 Ų34.726%0.25520%0.203SC..  trans-67.2136.2-171.9-74.7-58.2000112.5T167 L172 A173 W270 A271 W275T167-Y169 VanDerWaalsContact C-N 3.32Å; T167-Y169 HydrophobicContact CG2-CE2 4.31Å; T167-Y169 PolarHBondContact O-N 2.87Å; T167-Y169 VanDerWaalsContact O-N 3.16Å; T167-Y169 VanDerWaalsContact OG1-CD2 3.31Å; T167-Y169 WeakPolarHBondContact OG1-CD2 3.48Å; T167-Y169 VanDerWaalsContact OG1-CE2 3.32Å; T167-Y169 WeakPolarHBondContact OG1-CE2 3.21Å; Y169-L172 PolarHBondContact O-N 3.46Å; Y169-L172 VanDerWaalsContact O-N 3.14Å; Y169-A173 WeakPolarHBondContact O-CB 3.36Å; Y169-A173 PolarHBondContact O-N 2.89Å; Y169-W270 AromaticContact CD1-CD1 3.93Å; Y169-A271 HydrophobicContact CD1-CB 3.89Å; Y169-A271 HydrophobicContact CE1-CB 3.54Å; Y169-W275 AromaticContact CZ-NE1 3.78Å; Y169-W275 PolarHBondContact OH-NE1 3.34Å
170A92.2Very high91.3Very high13 Ų1334.3 Ų34.311%0.10720%0.198CC..THydrogen-bonded Turntrans-66.1145.5158.400000110.3M248 F259 P267 W270A170-M248 HydrophobicContact CB-CE 4.15Å; A170-F259 HydrophobicContact CB-CB 3.81Å; A170-P267 HydrophobicContact CB-CB 3.89Å; A170-W270 HydrophobicContact CB-CB 4.24Å
171P91.8Very high91.6Very high48 Ų4834.3 Ų34.331%0.31220%0.198SC..THydrogen-bonded Turncis-85.4-9.73.334.7-36.2000114.2A173 G174 E175 F176 V261P171-A173 VanDerWaalsContact C-N 3.31Å; P171-A173 PolarHBondContact O-N 2.87Å; P171-G174 PolarHBondContact O-N 3.41Å; P171-E175 PolarHBondContact O-N 2.91Å; P171-F176 HydrophobicContact CB-CD2 3.99Å; P171-F176 HydrophobicContact CB-CE2 3.77Å; P171-F176 HydrophobicContact CG-CD2 4.14Å; P171-F176 HydrophobicContact CG-CE2 3.75Å; P171-F176 WeakPolarHBondContact O-CD2 3.23Å; P171-V261 HydrophobicContact CB-CG2 4.48Å
172L93.5Very high91.7Very high88 Ų8834 Ų3446%0.46120%0.196SC..THydrogen-bonded Turntrans-55.8-43.6-175.2-179.263.1000112.8A164 Y169 G174 F176 S177A164-L172 HydrophobicContact CB-CD2 3.91Å; A164-L172 HydrophobicContact CB-CG 3.98Å; Y169-L172 PolarHBondContact O-N 3.46Å; Y169-L172 VanDerWaalsContact O-N 3.14Å; L172-G174 VanDerWaalsContact C-N 3.3Å; L172-G174 PolarHBondContact O-N 3.29Å; L172-F176 HydrophobicContact CD1-CB 4.15Å; L172-S177 WeakPolarHBondContact O-CB 3.26Å; L172-S177 PolarHBondContact O-N 3.26Å; L172-S177 PolarHBondContact O-OG 2.8Å
173A91.8Very high91.8Very high0 Ų034 Ų340%020%0.196CC..THydrogen-bonded Turntrans-70.3-21.2177.900000114.7A164 N168 Y169 P171 V182 M248 R252A164-A173 HydrophobicContact CB-CB 4.47Å; N168-A173 HydrophobicContact CB-CB 4.34Å; N168-A173 WeakPolarHBondContact O-CB 3.33Å; N168-A173 WeakPolarHBondContact OD1-CB 3.4Å; Y169-A173 WeakPolarHBondContact O-CB 3.36Å; Y169-A173 PolarHBondContact O-N 2.89Å; P171-A173 VanDerWaalsContact C-N 3.31Å; P171-A173 PolarHBondContact O-N 2.87Å; A173-V182 HydrophobicContact CB-CG1 4.48Å; A173-V182 WeakPolarHBondContact O-CG1 3.24Å; A173-M248 HydrophobicContact CB-CE 4.35Å; A173-R252 PolarHBondContact O-NH1 3.32Å
174G88.5Confident92Very high15 Ų1532.8 Ų32.816%0.15519%0.186CC..THydrogen-bonded Turntrans-96.1-105.2-179.600000109.9P171 L172 F176 S177 R252P171-G174 PolarHBondContact O-N 3.41Å; L172-G174 VanDerWaalsContact C-N 3.3Å; L172-G174 PolarHBondContact O-N 3.29Å; G174-F176 PolarHBondContact O-N 3.02Å; G174-S177 PolarHBondContact O-N 3.06Å; G174-S177 VanDerWaalsContact O-N 3.15Å; G174-R252 PolarHBondContact O-NH1 3.29Å
175E83Confident92.1Very high80 Ų8032.8 Ų32.837%0.37419%0.185SC..THydrogen-bonded Turntrans-52.9-30.1-173-61.5174.5-166.800114.5P171 T260 V261 A262P171-E175 PolarHBondContact O-N 2.91Å; E175-T260 HydrophobicContact CG-CG2 3.9Å; E175-T260 VanDerWaalsContact OE1-C 3.28Å; E175-T260 VanDerWaalsContact OE1-CA 3.31Å; E175-T260 WeakPolarHBondContact OE1-CA 3.45Å; E175-T260 WeakPolarHBondContact OE1-CG2 3.27Å; E175-V261 PolarHBondContact OE1-N 2.96Å; E175-A262 PolarHBondContact OE1-N 3.33Å
176F88.9Confident92.3Very high133 Ų13332.8 Ų32.858%0.58319%0.185SC*.THydrogen-bonded Turntrans-96.7-2.9-173.9-60.4-70.5000114.9P171 L172 G174P171-F176 HydrophobicContact CB-CD2 3.99Å; P171-F176 HydrophobicContact CB-CE2 3.77Å; P171-F176 HydrophobicContact CG-CD2 4.14Å; P171-F176 HydrophobicContact CG-CE2 3.75Å; P171-F176 WeakPolarHBondContact O-CD2 3.23Å; L172-F176 HydrophobicContact CD1-CB 4.15Å; G174-F176 PolarHBondContact O-N 3.02Å
177S88.4Confident92.3Very high26 Ų2631 Ų3118%0.18218%0.179CC..  trans-128.473.4-179-63.20000111.3L172 G174 G179 R252L172-S177 WeakPolarHBondContact O-CB 3.26Å; L172-S177 PolarHBondContact O-N 3.26Å; L172-S177 PolarHBondContact O-OG 2.8Å; G174-S177 PolarHBondContact O-N 3.06Å; G174-S177 VanDerWaalsContact O-N 3.15Å; S177-G179 VanDerWaalsContact C-N 3.26Å; S177-G179 PolarHBondContact O-N 3.36Å; S177-R252 VanDerWaalsContact O-CZ 3.25Å; S177-R252 PolarHBondContact O-NH1 3.21Å; S177-R252 PolarHBondContact O-NH2 2.79Å
178P84.5Confident92.4Very high111 Ų11130.9 Ų30.972%0.72118%0.178SC*.  trans-70.8-17-172.728.2-35.7000114.3
179G87Confident92.6Very high35 Ų3531.1 Ų31.136%0.36118%0.179SC..SBendtrans-70.3168.9-177.400000114.8S177 G181 R252S177-G179 VanDerWaalsContact C-N 3.26Å; S177-G179 PolarHBondContact O-N 3.36Å; G179-G181 PolarHBondContact O-N 3.07Å; G179-R252 PolarHBondContact O-NH2 3.46Å; G179-R252 VanDerWaalsContact O-NH2 3.08Å
180P92.6Very high92.7Very high8 Ų829.9 Ų29.95%0.05218%0.175CC..Hα-helixtrans-71.1-11-176.230.9-37.3000113.6G159 V182 N183 Y184 I604 F605G159-P180 VanDerWaalsContact O-CG 3.24Å; G159-P180 WeakPolarHBondContact O-CG 3.35Å; P180-V182 VanDerWaalsContact C-N 3.34Å; P180-V182 PolarHBondContact O-N 3.19Å; P180-N183 CarbonylContact O-C 3.58Å; P180-N183 WeakPolarHBondContact O-CA 3.44Å; P180-N183 WeakPolarHBondContact O-CB 3.47Å; P180-N183 PolarHBondContact O-N 3.41Å; P180-Y184 HydrophobicContact CB-CD2 4.47Å; P180-Y184 HydrophobicContact CB-CE2 4.37Å; P180-Y184 WeakPolarHBondContact O-CD2 3.39Å; P180-Y184 PolarHBondContact O-N 3.15Å; P180-I604 HydrophobicContact CB-CG2 4.02Å; P180-F605 HydrophobicContact CB-CD1 4.39Å; P180-F605 HydrophobicContact CB-CE1 4.17Å; P180-F605 HydrophobicContact CG-CE1 4.07Å
181G93.2Very high93Very high7 Ų729.8 Ų29.87%0.07217%0.173CC..Hα-helixtrans-57.2-40.9-177.400000114.3G160 P162 G179 Y184 Y185G160-G181 WeakPolarHBondContact O-CA 3.43Å; P162-G181 WeakPolarHBondContact CB-O 3.45Å; G179-G181 PolarHBondContact O-N 3.07Å; G181-Y184 WeakPolarHBondContact O-CB 3.43Å; G181-Y184 PolarHBondContact O-N 3.37Å; G181-Y185 PolarHBondContact O-N 2.8Å
182V95.1Very high93.3Very high3 Ų327.6 Ų27.62%0.01816%0.159CC..Hα-helixtrans-69.9-36.8173.8176.40000110.8A173 P180 Y184 Y185 L186A173-V182 HydrophobicContact CB-CG1 4.48Å; A173-V182 WeakPolarHBondContact O-CG1 3.24Å; P180-V182 VanDerWaalsContact C-N 3.34Å; P180-V182 PolarHBondContact O-N 3.19Å; V182-Y184 VanDerWaalsContact C-N 3.3Å; V182-Y184 PolarHBondContact O-N 2.92Å; V182-Y185 WeakPolarHBondContact O-CB 3.44Å; V182-Y185 PolarHBondContact O-N 3.49Å; V182-Y185 VanDerWaalsContact O-N 3.12Å; V182-L186 HydrophobicContact CG1-CD1 3.95Å; V182-L186 HydrophobicContact CG1-CG 4.14Å; V182-L186 WeakPolarHBondContact O-CG 3.43Å; V182-L186 PolarHBondContact O-N 2.96Å
183N95.7Very high93.5Very high2 Ų223.6 Ų23.61%0.01114%0.139CC..Hα-helixtrans-62.1-38.7176-61-8.8000111P180 Y185 L186 I187 R252 I604 E606P180-N183 CarbonylContact O-C 3.58Å; P180-N183 WeakPolarHBondContact O-CA 3.44Å; P180-N183 WeakPolarHBondContact O-CB 3.47Å; P180-N183 PolarHBondContact O-N 3.41Å; N183-Y185 PolarHBondContact O-N 3.5Å; N183-L186 PolarHBondContact O-N 2.89Å; N183-I187 WeakPolarHBondContact O-CB 3.42Å; N183-I187 WeakPolarHBondContact O-CG1 3.46Å; N183-I187 PolarHBondContact O-N 2.74Å; N183-R252 PolarHBondContact OD1-NE 2.99Å; N183-R252 PolarHBondContact OD1-NH2 2.83Å; N183-I604 HydrophobicContact CB-CB 4.32Å; N183-I604 HydrophobicContact CB-CG1 4.38Å; N183-I604 HydrophobicContact CB-CG2 4.11Å; N183-I604 WeakPolarHBondContact CB-O 3.5Å; N183-I604 PolarHBondContact ND2-O 3.02Å; N183-E606 PolarHBondContact ND2-OE1 3.03Å
184Y96.4Very high93.7Very high0 Ų027 Ų270%016%0.157CC..Hα-helixtrans-56-48.5171.4-85-72.1000111.9L151 L154 S155 I158 P180 G181 V182 A188 I604 F605L151-Y184 WeakPolarHBondContact O-CD1 3.21Å; L151-Y184 VanDerWaalsContact O-CE1 3.27Å; L151-Y184 WeakPolarHBondContact O-CE1 3.37Å; L154-Y184 HydrophobicContact CB-CE1 4.27Å; S155-Y184 VanDerWaalsContact CB-CG 3.45Å; I158-Y184 WeakPolarHBondContact CG2-OH 3.4Å; I158-Y184 WeakPolarHBondContact O-CE2 3.45Å; I158-Y184 PolarHBondContact O-OH 2.75Å; I158-Y184 VanDerWaalsContact O-OH 3.12Å; P180-Y184 HydrophobicContact CB-CD2 4.47Å; P180-Y184 HydrophobicContact CB-CE2 4.37Å; P180-Y184 WeakPolarHBondContact O-CD2 3.39Å; P180-Y184 PolarHBondContact O-N 3.15Å; G181-Y184 WeakPolarHBondContact O-CB 3.43Å; G181-Y184 PolarHBondContact O-N 3.37Å; V182-Y184 VanDerWaalsContact C-N 3.3Å; V182-Y184 PolarHBondContact O-N 2.92Å; Y184-A188 WeakPolarHBondContact O-CB 3.36Å; Y184-A188 PolarHBondContact O-N 3.19Å; Y184-I604 HydrophobicContact CD1-CD1 3.5Å; Y184-I604 VanDerWaalsContact CD1-CD1 3.5Å; Y184-I604 HydrophobicContact CD1-CG1 4.3Å; Y184-I604 HydrophobicContact CD1-CG2 4.03Å; Y184-I604 HydrophobicContact CD2-CG2 3.65Å; Y184-I604 HydrophobicContact CE1-CD1 3.75Å; Y184-I604 HydrophobicContact CE1-CG2 3.99Å; Y184-I604 HydrophobicContact CE2-CG2 3.6Å; Y184-I604 HydrophobicContact CG-CD1 4.17Å; Y184-I604 HydrophobicContact CG-CG2 3.84Å; Y184-F605 HydrophobicContact CE2-CZ 4.42Å; Y184-F605 WeakPolarHBondContact OH-CE2 3.45Å
185Y97.1Very high94.1Very high3 Ų326.2 Ų26.21%0.01215%0.149CC..Hα-helixtrans-57.7-50176.6172.2-83.6000111.6V104 W166 N168 G181 V182 N183 I189 L245 F274V104-Y185 HydrophobicContact CG2-CD2 3.82Å; V104-Y185 HydrophobicContact CG2-CE2 3.68Å; W166-Y185 WeakPolarHBondContact O-CE2 3.41Å; W166-Y185 PolarHBondContact O-OH 3Å; N168-Y185 HydrophobicContact CB-CD1 4.13Å; N168-Y185 HydrophobicContact CB-CE1 3.79Å; N168-Y185 HydrophobicContact CB-CE2 4.3Å; N168-Y185 WeakPolarHBondContact ND2-CD1 3.41Å; G181-Y185 PolarHBondContact O-N 2.8Å; V182-Y185 WeakPolarHBondContact O-CB 3.44Å; V182-Y185 PolarHBondContact O-N 3.49Å; V182-Y185 VanDerWaalsContact O-N 3.12Å; N183-Y185 PolarHBondContact O-N 3.5Å; Y185-I189 HydrophobicContact CD1-CD1 4.18Å; Y185-I189 HydrophobicContact CD2-CD1 3.56Å; Y185-I189 HydrophobicContact CE1-CD1 3.97Å; Y185-I189 HydrophobicContact CE2-CD1 3.31Å; Y185-I189 HydrophobicContact CG-CD1 3.98Å; Y185-I189 WeakPolarHBondContact O-CB 3.35Å; Y185-I189 VanDerWaalsContact O-CG1 3.23Å; Y185-I189 WeakPolarHBondContact O-CG1 3.32Å; Y185-I189 PolarHBondContact O-N 3.19Å; Y185-L245 HydrophobicContact CD1-CD2 4.35Å; Y185-L245 HydrophobicContact CE1-CD2 3.8Å; Y185-F274 WeakPolarHBondContact OH-CE2 3.42Å
186L97.3Very high94.8Very high1 Ų122.9 Ų22.91%0.00513%0.134CC..Hα-helixtrans-65.3-53.1-174.6-64.4173.3000111.8V182 N183 Q190 L245 M248 W270V182-L186 HydrophobicContact CG1-CD1 3.95Å; V182-L186 HydrophobicContact CG1-CG 4.14Å; V182-L186 WeakPolarHBondContact O-CG 3.43Å; V182-L186 PolarHBondContact O-N 2.96Å; N183-L186 PolarHBondContact O-N 2.89Å; L186-Q190 VanDerWaalsContact O-CB 3.22Å; L186-Q190 WeakPolarHBondContact O-CB 3.22Å; L186-Q190 PolarHBondContact O-N 2.76Å; L186-L245 HydrophobicContact CD2-CD2 3.7Å; L186-M248 HydrophobicContact CD1-CB 4.19Å; L186-M248 HydrophobicContact CD1-CG 3.66Å; L186-M248 HydrophobicContact CD2-CB 3.94Å; L186-M248 HydrophobicContact CD2-CG 3.79Å; L186-M248 HydrophobicContact CG-CG 4.36Å; L186-W270 HydrophobicContact CD2-CH2 4.06Å
187I97.2Very high95.2Very high10 Ų1018.5 Ų18.55%0.05112%0.117CC..Hα-helixtrans-71-42.1-174.5-60.3-51.4000111.6L151 N183 Q190 I191 T249 L603 I604L151-I187 HydrophobicContact CD1-CG2 4.41Å; N183-I187 WeakPolarHBondContact O-CB 3.42Å; N183-I187 WeakPolarHBondContact O-CG1 3.46Å; N183-I187 PolarHBondContact O-N 2.74Å; I187-Q190 PolarHBondContact O-N 2.84Å; I187-I191 HydrophobicContact CG2-CD1 3.8Å; I187-I191 WeakPolarHBondContact O-CG1 3.34Å; I187-I191 PolarHBondContact O-N 3.07Å; I187-T249 HydrophobicContact CD1-CG2 3.69Å; I187-L603 HydrophobicContact CD1-CD2 3.55Å; I187-L603 HydrophobicContact CD1-CG 4.07Å; I187-L603 HydrophobicContact CG1-CD2 4.3Å; I187-L603 HydrophobicContact CG1-CG 4.42Å; I187-I604 HydrophobicContact CB-CD1 4.22Å; I187-I604 HydrophobicContact CB-CG1 3.89Å; I187-I604 HydrophobicContact CG1-CG1 3.96Å; I187-I604 HydrophobicContact CG2-CD1 4.31Å; I187-I604 HydrophobicContact CG2-CG1 4.27Å
188A97.7Very high95.7Very high0 Ų018 Ų180%011%0.114CC..Hα-helixtrans-64.6-44.9-179.300000112.2F109 G148 L151 F152 Y184 S192F109-A188 HydrophobicContact CZ-CB 4.49Å; G148-A188 WeakPolarHBondContact CA-O 3.48Å; G148-A188 WeakPolarHBondContact O-CB 3.38Å; L151-A188 HydrophobicContact CB-CB 4.03Å; F152-A188 HydrophobicContact CB-CB 3.81Å; F152-A188 HydrophobicContact CD2-CB 4.25Å; Y184-A188 WeakPolarHBondContact O-CB 3.36Å; Y184-A188 PolarHBondContact O-N 3.19Å; A188-S192 WeakPolarHBondContact O-CB 3.33Å; A188-S192 PolarHBondContact O-N 3.29Å
189I97.6Very high96.3Very high6 Ų612.7 Ų12.73%0.0318%0.08CC..Hα-helixtrans-70.2-36.5178.3-61.3174.4000110.2V104 Y185 I191 S192 G193 L241 L245V104-I189 HydrophobicContact CG1-CD1 3.95Å; V104-I189 HydrophobicContact CG1-CG1 4.38Å; Y185-I189 HydrophobicContact CD1-CD1 4.18Å; Y185-I189 HydrophobicContact CD2-CD1 3.56Å; Y185-I189 HydrophobicContact CE1-CD1 3.97Å; Y185-I189 HydrophobicContact CE2-CD1 3.31Å; Y185-I189 HydrophobicContact CG-CD1 3.98Å; Y185-I189 WeakPolarHBondContact O-CB 3.35Å; Y185-I189 VanDerWaalsContact O-CG1 3.23Å; Y185-I189 WeakPolarHBondContact O-CG1 3.32Å; Y185-I189 PolarHBondContact O-N 3.19Å; I189-I191 PolarHBondContact O-N 3.03Å; I189-S192 PolarHBondContact O-N 3.07Å; I189-G193 WeakPolarHBondContact O-CA 3.09Å; I189-G193 PolarHBondContact O-N 3.42Å; I189-L241 HydrophobicContact CG2-CD2 4.02Å; I189-L245 HydrophobicContact CB-CD1 4.02Å; I189-L245 HydrophobicContact CG2-CD1 3.64Å
190Q98Very high96.8Very high38 Ų3811 Ų1118%0.1786%0.063CC..Hα-helixtrans-58.2-49.2175.8-170.971.8-1.800111.5L186 I187 G193 L194 T242 L245L186-Q190 VanDerWaalsContact O-CB 3.22Å; L186-Q190 WeakPolarHBondContact O-CB 3.22Å; L186-Q190 PolarHBondContact O-N 2.76Å; I187-Q190 PolarHBondContact O-N 2.84Å; Q190-G193 PolarHBondContact O-N 2.88Å; Q190-L194 PolarHBondContact O-N 3.37Å; Q190-T242 VanDerWaalsContact NE2-CG2 3.27Å; Q190-T242 PolarHBondContact NE2-O 3.19Å; Q190-T242 PolarHBondContact OE1-O 3.49Å; Q190-L245 HydrophobicContact CB-CD1 4.45Å
191I98Very high97.1Very high12 Ų1214 Ų146%0.0628%0.077CC..Hα-helixtrans-64.1-46.3179.4-65.7165.9000110.3L144 A147 L151 I187 I189 G193 L194 G195 M596L144-I191 HydrophobicContact CD2-CG2 4.16Å; L144-I191 WeakPolarHBondContact O-CG2 3.47Å; A147-I191 HydrophobicContact CB-CG2 4.06Å; L151-I191 HydrophobicContact CD1-CD1 3.54Å; I187-I191 HydrophobicContact CG2-CD1 3.8Å; I187-I191 WeakPolarHBondContact O-CG1 3.34Å; I187-I191 PolarHBondContact O-N 3.07Å; I189-I191 PolarHBondContact O-N 3.03Å; I191-G193 VanDerWaalsContact C-N 3.29Å; I191-G193 PolarHBondContact O-N 3.39Å; I191-L194 PolarHBondContact O-N 3.49Å; I191-G195 PolarHBondContact O-N 3.48Å; I191-M596 HydrophobicContact CD1-CB 4.43Å; I191-M596 HydrophobicContact CG1-SD 4.35Å; I191-M596 HydrophobicContact CG2-CB 4.05Å; I191-M596 HydrophobicContact CG2-CG 4.42Å
192S97.8Very high97.3Very high2 Ų213.7 Ų13.71%0.0147%0.074CC..Hα-helixtrans-63.1-36.3177.3-170.50000112.3A188 I189 L194 G195 T196A188-S192 WeakPolarHBondContact O-CB 3.33Å; A188-S192 PolarHBondContact O-N 3.29Å; I189-S192 PolarHBondContact O-N 3.07Å; S192-L194 VanDerWaalsContact C-N 3.34Å; S192-L194 PolarHBondContact O-N 2.92Å; S192-G195 PolarHBondContact O-N 3.48Å; S192-G195 VanDerWaalsContact O-N 3.13Å; S192-T196 PolarHBondContact O-N 2.83Å; S192-T196 PolarHBondContact O-OG1 3.47Å
193G97.2Very high97.5Very high4 Ų413.5 Ų13.54%0.0417%0.073CC..Hα-helixtrans-63.5-36.7179.500000112.9I189 Q190 I191 G195 T196 L197I189-G193 WeakPolarHBondContact O-CA 3.09Å; I189-G193 PolarHBondContact O-N 3.42Å; Q190-G193 PolarHBondContact O-N 2.88Å; I191-G193 VanDerWaalsContact C-N 3.29Å; I191-G193 PolarHBondContact O-N 3.39Å; G193-G195 VanDerWaalsContact C-N 3.33Å; G193-G195 PolarHBondContact O-N 2.96Å; G193-T196 PolarHBondContact O-N 2.89Å; G193-L197 WeakPolarHBondContact O-CB 3.31Å; G193-L197 PolarHBondContact O-N 3.29Å
194L96.9Very high97.6Very high70 Ų7016 Ų1637%0.3668%0.084SC..Hα-helixtrans-60.7-43.3171.5-65.8175.5000111.6L144 Q190 I191 S192 A198 M596L144-L194 HydrophobicContact CD1-CB 4.09Å; Q190-L194 PolarHBondContact O-N 3.37Å; I191-L194 PolarHBondContact O-N 3.49Å; S192-L194 VanDerWaalsContact C-N 3.34Å; S192-L194 PolarHBondContact O-N 2.92Å; L194-A198 WeakPolarHBondContact O-CB 3.16Å; L194-A198 PolarHBondContact O-N 3.24Å; L194-A198 VanDerWaalsContact O-N 3.1Å; L194-M596 HydrophobicContact CD1-CE 4.42Å
195G97.3Very high97.7Very high0 Ų018 Ų180%010%0.096CC..Hα-helixtrans-63.5-44175.500000112.3S141 I191 S192 G193 A198 T199S141-G195 WeakPolarHBondContact CB-O 3.37Å; S141-G195 PolarHBondContact OG-O 3.11Å; I191-G195 PolarHBondContact O-N 3.48Å; S192-G195 PolarHBondContact O-N 3.48Å; S192-G195 VanDerWaalsContact O-N 3.13Å; G193-G195 VanDerWaalsContact C-N 3.33Å; G193-G195 PolarHBondContact O-N 2.96Å; G195-A198 PolarHBondContact O-N 2.91Å; G195-T199 PolarHBondContact O-N 3.38Å; G195-T199 PolarHBondContact O-OG1 3.29Å; G195-T199 VanDerWaalsContact O-OG1 3.11Å
196T97.6Very high97.7Very high10 Ų1017.9 Ų17.96%0.06110%0.095CC..Hα-helixtrans-61.2-46.2176.6-65.80000112.5M112 F116 S192 G193 A198 T199 G200 V234 F238M112-T196 HydrophobicContact CE-CG2 3.54Å; F116-T196 HydrophobicContact CE2-CG2 3.72Å; F116-T196 HydrophobicContact CZ-CG2 3.7Å; S192-T196 PolarHBondContact O-N 2.83Å; S192-T196 PolarHBondContact O-OG1 3.47Å; G193-T196 PolarHBondContact O-N 2.89Å; T196-A198 VanDerWaalsContact C-N 3.32Å; T196-A198 PolarHBondContact O-N 2.67Å; T196-T199 WeakPolarHBondContact O-CB 3.46Å; T196-T199 PolarHBondContact O-N 2.88Å; T196-G200 PolarHBondContact O-N 2.87Å; T196-V234 HydrophobicContact CG2-CG1 3.93Å; T196-F238 HydrophobicContact CG2-CD1 3.92Å; T196-F238 HydrophobicContact CG2-CD2 3.97Å; T196-F238 HydrophobicContact CG2-CE1 3.45Å; T196-F238 VanDerWaalsContact CG2-CE1 3.45Å; T196-F238 HydrophobicContact CG2-CE2 3.48Å; T196-F238 VanDerWaalsContact CG2-CE2 3.48Å; T196-F238 HydrophobicContact CG2-CG 4.18Å; T196-F238 HydrophobicContact CG2-CZ 3.24Å
197L97.4Very high97.7Very high41 Ų4117.9 Ų17.922%0.21510%0.095CC..Hα-helixtrans-60.3-44.4177.7-178.662.8000111.2G193 T199 G200 I201 F238G193-L197 WeakPolarHBondContact O-CB 3.31Å; G193-L197 PolarHBondContact O-N 3.29Å; L197-T199 VanDerWaalsContact C-N 3.34Å; L197-T199 PolarHBondContact O-N 3.03Å; L197-G200 PolarHBondContact O-N 3.13Å; L197-I201 HydrophobicContact CG-CD1 4.27Å; L197-I201 WeakPolarHBondContact O-CG1 3.1Å; L197-I201 PolarHBondContact O-N 2.67Å; L197-F238 HydrophobicContact CD1-CB 4.35Å
198A97.6Very high97.6Very high15 Ų1520.3 Ų20.312%0.12411%0.108CC..Hα-helixtrans-61.6-39.8175.500000112.5L137 S141 L194 G195 T196 I201 N202L137-A198 HydrophobicContact CD1-CB 3.88Å; L137-A198 HydrophobicContact CD2-CB 4.23Å; L137-A198 HydrophobicContact CG-CB 4Å; S141-A198 VanDerWaalsContact OG-CB 3.23Å; S141-A198 WeakPolarHBondContact OG-CB 3.39Å; L194-A198 WeakPolarHBondContact O-CB 3.16Å; L194-A198 PolarHBondContact O-N 3.24Å; L194-A198 VanDerWaalsContact O-N 3.1Å; G195-A198 PolarHBondContact O-N 2.91Å; T196-A198 VanDerWaalsContact C-N 3.32Å; T196-A198 PolarHBondContact O-N 2.67Å; A198-I201 PolarHBondContact O-N 3.39Å; A198-N202 VanDerWaalsContact O-CB 3.32Å; A198-N202 WeakPolarHBondContact O-CB 2.85Å; A198-N202 PolarHBondContact O-N 3.2Å
199T98.2Very high97.6Very high0 Ų030.5 Ų30.50%015%0.147CC..Hα-helixtrans-61.3-45.5172.5-64.10000111.5F116 W119 S141 G195 T196 L197 I201 N202 F203F116-T199 HydrophobicContact CB-CG2 4.49Å; F116-T199 HydrophobicContact CD1-CG2 4.18Å; F116-T199 HydrophobicContact CD2-CG2 4.05Å; F116-T199 HydrophobicContact CE1-CG2 4.41Å; F116-T199 HydrophobicContact CE2-CG2 4.28Å; F116-T199 HydrophobicContact CG-CG2 4Å; F116-T199 HydrophobicContact CZ-CG2 4.45Å; W119-T199 HydrophobicContact CE3-CG2 4.3Å; W119-T199 HydrophobicContact CZ3-CG2 4.41Å; S141-T199 VanDerWaalsContact CB-OG1 3.26Å; S141-T199 WeakPolarHBondContact CB-OG1 3.42Å; S141-T199 PolarHBondContact OG-N 2.95Å; S141-T199 PolarHBondContact OG-OG1 3.07Å; G195-T199 PolarHBondContact O-N 3.38Å; G195-T199 PolarHBondContact O-OG1 3.29Å; G195-T199 VanDerWaalsContact O-OG1 3.11Å; T196-T199 WeakPolarHBondContact O-CB 3.46Å; T196-T199 PolarHBondContact O-N 2.88Å; L197-T199 VanDerWaalsContact C-N 3.34Å; L197-T199 PolarHBondContact O-N 3.03Å; T199-I201 PolarHBondContact O-N 2.9Å; T199-N202 PolarHBondContact O-N 3.35Å; T199-F203 HydrophobicContact CG2-CD2 3.79Å; T199-F203 HydrophobicContact CG2-CE2 3.98Å; T199-F203 WeakPolarHBondContact O-CD2 3.2Å; T199-F203 PolarHBondContact O-N 3.38Å
200G97.4Very high97.5Very high0 Ų032.4 Ų32.40%016%0.16CC..Hα-helixtrans-56-50.8176.100000112.4T196 L197 N202 F204 T231T196-G200 PolarHBondContact O-N 2.87Å; L197-G200 PolarHBondContact O-N 3.13Å; G200-N202 VanDerWaalsContact C-N 3.34Å; G200-N202 PolarHBondContact O-N 3.18Å; G200-F204 VanDerWaalsContact O-CB 3.31Å; G200-F204 WeakPolarHBondContact O-CB 3.41Å; G200-F204 PolarHBondContact O-N 3.3Å; G200-T231 WeakPolarHBondContact O-CB 3.18Å
201I98.1Very high97.3Very high70 Ų7033.1 Ų33.136%0.35916%0.162SC..Hα-helixtrans-60.6-43.4177.6-65.1168.4000111.1L197 A198 T199 F204 V205 I235L197-I201 HydrophobicContact CG-CD1 4.27Å; L197-I201 WeakPolarHBondContact O-CG1 3.1Å; L197-I201 PolarHBondContact O-N 2.67Å; A198-I201 PolarHBondContact O-N 3.39Å; T199-I201 PolarHBondContact O-N 2.9Å; I201-F204 PolarHBondContact O-N 3.44Å; I201-V205 PolarHBondContact O-N 3.48Å; I201-V205 VanDerWaalsContact O-N 3.17Å; I201-I235 HydrophobicContact CG1-CD1 4.26Å; I201-I235 HydrophobicContact CG1-CG1 3.95Å
202N98.4Very high97.1Very high0 Ų032.6 Ų32.60%016%0.16CC..Hα-helixtrans-63-50-177.7-171.220.3000112.4V132 F134 A198 T199 G200 F204 V205 T206V132-N202 WeakPolarHBondContact CG2-ND2 3.31Å; F134-N202 HydrophobicContact CD2-CB 4.32Å; F134-N202 WeakPolarHBondContact CD2-OD1 3Å; F134-N202 PolarHBondContact N-OD1 3.29Å; F134-N202 PolarHBondContact O-ND2 3.44Å; A198-N202 VanDerWaalsContact O-CB 3.32Å; A198-N202 WeakPolarHBondContact O-CB 2.85Å; A198-N202 PolarHBondContact O-N 3.2Å; T199-N202 PolarHBondContact O-N 3.35Å; G200-N202 VanDerWaalsContact C-N 3.34Å; G200-N202 PolarHBondContact O-N 3.18Å; N202-F204 PolarHBondContact O-N 2.96Å; N202-V205 PolarHBondContact O-N 3.29Å; N202-T206 WeakPolarHBondContact O-CB 3.11Å; N202-T206 PolarHBondContact O-N 3.04Å; N202-T206 PolarHBondContact O-OG1 3.17Å
203F98.3Very high96.7Very high0 Ų038.3 Ų38.30%020%0.196CC..Hα-helixtrans-69.7-32.5179.5-82.1-84.4000112.8W119 N120 V123 V132 T199 T206 I207 T231W119-F203 HydrophobicContact CB-CD1 4.32Å; W119-F203 HydrophobicContact CB-CE1 3.89Å; W119-F203 HydrophobicContact CB-CE2 4.3Å; W119-F203 HydrophobicContact CB-CZ 3.9Å; W119-F203 HydrophobicContact CE3-CB 4.37Å; W119-F203 AromaticContact CE3-CD2 3.93Å; W119-F203 HydrophobicContact CE3-CD2 3.93Å; W119-F203 HydrophobicContact CE3-CE2 4.44Å; W119-F203 HydrophobicContact CE3-CG 4.03Å; W119-F203 WeakPolarHBondContact O-CE1 3.35Å; N120-F203 HydrophobicContact CB-CZ 4.34Å; V123-F203 HydrophobicContact CB-CD1 4.31Å; V123-F203 HydrophobicContact CB-CE1 4.1Å; V123-F203 HydrophobicContact CG1-CD1 4.13Å; V123-F203 HydrophobicContact CG1-CE1 4.34Å; V132-F203 HydrophobicContact CG1-CE1 4.09Å; V132-F203 HydrophobicContact CG1-CZ 3.94Å; T199-F203 HydrophobicContact CG2-CD2 3.79Å; T199-F203 HydrophobicContact CG2-CE2 3.98Å; T199-F203 WeakPolarHBondContact O-CD2 3.2Å; T199-F203 PolarHBondContact O-N 3.38Å; F203-T206 PolarHBondContact O-N 3.31Å; F203-I207 WeakPolarHBondContact O-CG1 3.33Å; F203-I207 PolarHBondContact O-N 2.7Å; F203-T231 HydrophobicContact CB-CG2 3.54Å
204F97.9Very high96.5Very high54 Ų5440.2 Ų40.224%0.23721%0.208CC..Hα-helixtrans-57.2-51173.4-178.2-99.1000111.5G200 I201 N202 L208 F228 L232 I235G200-F204 VanDerWaalsContact O-CB 3.31Å; G200-F204 WeakPolarHBondContact O-CB 3.41Å; G200-F204 PolarHBondContact O-N 3.3Å; I201-F204 PolarHBondContact O-N 3.44Å; N202-F204 PolarHBondContact O-N 2.96Å; F204-L208 HydrophobicContact CD1-CD1 3.99Å; F204-L208 HydrophobicContact CE1-CD1 3.45Å; F204-L208 VanDerWaalsContact CE1-CD1 3.45Å; F204-L208 HydrophobicContact CE2-CD1 4.01Å; F204-L208 HydrophobicContact CG-CD1 4.5Å; F204-L208 HydrophobicContact CZ-CD1 3.47Å; F204-L208 VanDerWaalsContact CZ-CD1 3.47Å; F204-L208 WeakPolarHBondContact O-CG 3.31Å; F204-L208 PolarHBondContact O-N 3Å; F204-F228 HydrophobicContact CD2-CD2 4.11Å; F204-F228 AromaticContact CD2-CE2 3.55Å; F204-F228 HydrophobicContact CD2-CE2 3.55Å; F204-F228 HydrophobicContact CD2-CZ 4.22Å; F204-F228 HydrophobicContact CE2-CD2 4.34Å; F204-F228 AromaticContact CE2-CE2 3.37Å; F204-F228 HydrophobicContact CE2-CE2 3.37Å; F204-F228 AromaticContact CE2-CZ 3.63Å; F204-F228 HydrophobicContact CE2-CZ 3.63Å; F204-F228 HydrophobicContact CG-CE2 4.47Å; F204-F228 HydrophobicContact CZ-CE2 4.22Å; F204-F228 HydrophobicContact CZ-CZ 4.41Å; F204-L232 HydrophobicContact CD2-CD2 3.89Å; F204-L232 HydrophobicContact CD2-CG 4.03Å; F204-L232 HydrophobicContact CE2-CD1 4.35Å; F204-L232 HydrophobicContact CE2-CD2 3.27Å; F204-L232 HydrophobicContact CE2-CG 3.68Å; F204-L232 HydrophobicContact CZ-CD2 3.95Å; F204-I235 HydrophobicContact CB-CD1 3.91Å; F204-I235 HydrophobicContact CD1-CD1 4.48Å; F204-I235 HydrophobicContact CD2-CD1 4.39Å; F204-I235 HydrophobicContact CG-CD1 4.01Å
205V98.2Very high96.4Very high42 Ų4237.1 Ų37.126%0.25519%0.191SC..Hα-helixtrans-67.7-40.8178.1178.30000111.2A133 F134 I201 N202 I207 L208 R209A133-V205 HydrophobicContact CB-CB 4.09Å; A133-V205 HydrophobicContact CB-CG1 3.76Å; F134-V205 HydrophobicContact CE2-CB 3.83Å; F134-V205 HydrophobicContact CE2-CG1 3.99Å; F134-V205 HydrophobicContact CE2-CG2 3.86Å; F134-V205 HydrophobicContact CZ-CB 4.34Å; F134-V205 HydrophobicContact CZ-CG1 4.03Å; F134-V205 HydrophobicContact CZ-CG2 4.28Å; I201-V205 PolarHBondContact O-N 3.48Å; I201-V205 VanDerWaalsContact O-N 3.17Å; N202-V205 PolarHBondContact O-N 3.29Å; V205-I207 PolarHBondContact O-N 3.48Å; V205-L208 PolarHBondContact O-N 2.89Å; V205-R209 HydrophobicContact CG1-CB 4.47Å; V205-R209 HydrophobicContact CG1-CG 4.29Å; V205-R209 WeakPolarHBondContact O-CB 3.19Å; V205-R209 PolarHBondContact O-N 3.4Å
206T98.2Very high96.2Very high0 Ų043.7 Ų43.70%022%0.22CC..Hα-helixtrans-56.1-51.7179.5-58.90000111.6I127 V132 A133 N202 F203 L208 C210I127-T206 HydrophobicContact CD1-CG2 3.81Å; V132-T206 HydrophobicContact CB-CG2 4.4Å; V132-T206 HydrophobicContact CG1-CG2 4.43Å; A133-T206 WeakPolarHBondContact CB-OG1 3.36Å; A133-T206 PolarHBondContact N-OG1 3.18Å; N202-T206 WeakPolarHBondContact O-CB 3.11Å; N202-T206 PolarHBondContact O-N 3.04Å; N202-T206 PolarHBondContact O-OG1 3.17Å; F203-T206 PolarHBondContact O-N 3.31Å; T206-L208 VanDerWaalsContact C-N 3.33Å; T206-L208 PolarHBondContact O-N 3.45Å; T206-C210 HydrophobicContact CG2-CB 4.19Å; T206-C210 WeakPolarHBondContact O-CA 3.42Å; T206-C210 WeakPolarHBondContact O-CB 3.17Å; T206-C210 PolarHBondContact O-N 3.5Å
207I97.5Very high95.9Very high1 Ų146.1 Ų46.11%0.00523%0.23CC..Hα-helixtrans-68.5-34.2-177.1-63.5167.3000111.4V123 F203 V205 M220 T224 T227 F228V123-I207 HydrophobicContact CG1-CD1 3.94Å; V123-I207 HydrophobicContact CG1-CG1 3.77Å; F203-I207 WeakPolarHBondContact O-CG1 3.33Å; F203-I207 PolarHBondContact O-N 2.7Å; V205-I207 PolarHBondContact O-N 3.48Å; I207-M220 HydrophobicContact CG2-CE 3.88Å; I207-M220 HydrophobicContact CG2-SD 3.93Å; I207-T224 HydrophobicContact CD1-CG2 4.22Å; I207-T224 HydrophobicContact CG1-CG2 4.19Å; I207-T224 HydrophobicContact CG2-CG2 3.89Å; I207-T227 HydrophobicContact CD1-CG2 3.88Å; I207-F228 HydrophobicContact CB-CB 4.49Å; I207-F228 HydrophobicContact CB-CD2 4.18Å; I207-F228 HydrophobicContact CD1-CB 3.79Å; I207-F228 HydrophobicContact CG2-CB 4.04Å; I207-F228 HydrophobicContact CG2-CD2 4.08Å; I207-F228 HydrophobicContact CG2-CG 4.32Å
208L95.2Very high95.7Very high61 Ų6147 Ų4732%0.31923%0.233SC..Hα-helixtrans-72.1-44.3178.7-73.1176.9000113F204 V205 T206 K211 F228F204-L208 HydrophobicContact CD1-CD1 3.99Å; F204-L208 HydrophobicContact CE1-CD1 3.45Å; F204-L208 VanDerWaalsContact CE1-CD1 3.45Å; F204-L208 HydrophobicContact CE2-CD1 4.01Å; F204-L208 HydrophobicContact CG-CD1 4.5Å; F204-L208 HydrophobicContact CZ-CD1 3.47Å; F204-L208 VanDerWaalsContact CZ-CD1 3.47Å; F204-L208 WeakPolarHBondContact O-CG 3.31Å; F204-L208 PolarHBondContact O-N 3Å; V205-L208 PolarHBondContact O-N 2.89Å; T206-L208 VanDerWaalsContact C-N 3.33Å; T206-L208 PolarHBondContact O-N 3.45Å; L208-K211 PolarHBondContact O-NZ 2.81Å; L208-F228 HydrophobicContact CD1-CE2 3.9Å; L208-F228 HydrophobicContact CD1-CZ 4.42Å; L208-F228 HydrophobicContact CD2-CD2 4.47Å; L208-F228 HydrophobicContact CD2-CE2 3.58Å; L208-F228 HydrophobicContact CD2-CZ 3.83Å; L208-F228 HydrophobicContact CG-CD2 4.35Å; L208-F228 HydrophobicContact CG-CE2 3.55Å; L208-F228 HydrophobicContact CG-CZ 4.24Å
209R96.2Very high95.4Very high215 Ų21548 Ų4881%0.81124%0.235SC*.Hα-helixtrans-109.6-23.9-165.3-65.6-60-144.31776.9115.3V205V205-R209 HydrophobicContact CG1-CB 4.47Å; V205-R209 HydrophobicContact CG1-CG 4.29Å; V205-R209 WeakPolarHBondContact O-CB 3.19Å; V205-R209 PolarHBondContact O-N 3.4Å
210C95.8Very high95.2Very high45 Ų4548 Ų4830%0.30424%0.235SC..SBendtrans-101.7-4.3-173.3-56.50000113.9I127 A129 T206I127-C210 HydrophobicContact CD1-CB 4.39Å; A129-C210 HydrophobicContact CB-CB 4.1Å; A129-C210 WeakPolarHBondContact CB-O 3.35Å; T206-C210 HydrophobicContact CG2-CB 4.19Å; T206-C210 WeakPolarHBondContact O-CA 3.42Å; T206-C210 WeakPolarHBondContact O-CB 3.17Å; T206-C210 PolarHBondContact O-N 3.5Å
211K93.9Very high95.1Very high53 Ų5348 Ų4823%0.2324%0.235CC..SBendtrans-62.2153.6175.564.7173.8-180-78.90112.1I127 L208 M215 M220I127-K211 HydrophobicContact CB-CB 3.94Å; I127-K211 CarbonylContact O-C 3.45Å; I127-K211 WeakPolarHBondContact O-CA 3.39Å; L208-K211 PolarHBondContact O-NZ 2.81Å; K211-M215 HydrophobicContact CB-SD 4.2Å; K211-M215 HydrophobicContact CD-CB 4.32Å; K211-M215 HydrophobicContact CD-CG 4.33Å; K211-M215 WeakPolarHBondContact CD-O 3.33Å; K211-M215 WeakPolarHBondContact CE-O 3.31Å; K211-M220 HydrophobicContact CD-SD 4.19Å
212T93.4Very high95Very high2 Ų244.6 Ų44.61%0.01222%0.218CC..  trans-54.1139.7174.4-1790000111.4I127 T214 M215 T552 P553 W555I127-T212 PolarHBondContact O-N 3.46Å; T212-T214 PolarHBondContact O-N 2.9Å; T212-M215 HydrophobicContact CG2-CB 3.48Å; T212-M215 VanDerWaalsContact CG2-CB 3.48Å; T212-M215 HydrophobicContact CG2-CE 4.03Å; T212-M215 WeakPolarHBondContact O-CB 3.27Å; T212-M215 PolarHBondContact O-N 3.21Å; T212-T552 WeakPolarHBondContact OG1-CG2 3.31Å; T212-P553 VanDerWaalsContact CB-O 3.24Å; T212-P553 WeakPolarHBondContact CB-O 3.5Å; T212-P553 WeakPolarHBondContact CG2-O 3.44Å; T212-P553 PolarHBondContact OG1-O 3.31Å; T212-W555 HydrophobicContact CG2-CB 3.78Å
213P90.1Very high95Very high121 Ų12144.6 Ų44.679%0.78622%0.218SC*.THydrogen-bonded Turntrans-55.5-30-170.9-28.735.8000115.3
214T92.5Very high95Very high45 Ų4544.6 Ų44.628%0.27622%0.218SC..THydrogen-bonded Turntrans-83.3-18.2-177.666.40000113.1T212 K216 D554 W555T212-T214 PolarHBondContact O-N 2.9Å; T214-K216 PolarHBondContact O-N 3Å; T214-D554 HydrophobicContact CG2-CB 4.31Å; T214-W555 CarbonylContact C-O 3.07Å; T214-W555 VanDerWaalsContact C-O 3.27Å; T214-W555 WeakPolarHBondContact CB-O 3.28Å; T214-W555 PolarHBondContact OG1-N 2.73Å; T214-W555 PolarHBondContact OG1-O 2.79Å
215M94.3Very high94.9Very high4 Ų442 Ų422%0.0221%0.207CC..  trans-73.8110.7-173.1180178.4-75.200111.4Q126 I127 K211 T212 M220 L535 W555Q126-M215 WeakPolarHBondContact O-CE 3.17Å; I127-M215 HydrophobicContact CB-SD 4.34Å; I127-M215 HydrophobicContact CG2-SD 4.4Å; K211-M215 HydrophobicContact CB-SD 4.2Å; K211-M215 HydrophobicContact CD-CB 4.32Å; K211-M215 HydrophobicContact CD-CG 4.33Å; K211-M215 WeakPolarHBondContact CD-O 3.33Å; K211-M215 WeakPolarHBondContact CE-O 3.31Å; T212-M215 HydrophobicContact CG2-CB 3.48Å; T212-M215 VanDerWaalsContact CG2-CB 3.48Å; T212-M215 HydrophobicContact CG2-CE 4.03Å; T212-M215 WeakPolarHBondContact O-CB 3.27Å; T212-M215 PolarHBondContact O-N 3.21Å; M215-M220 HydrophobicContact CG-CG 3.74Å; M215-M220 HydrophobicContact SD-CB 4.46Å; M215-M220 HydrophobicContact SD-CG 3.67Å; M215-M220 HydrophobicContact SD-SD 4.25Å; M215-L535 HydrophobicContact CE-CD1 3.73Å; M215-W555 HydrophobicContact CB-CB 4.15Å; M215-W555 HydrophobicContact CE-CB 3.83Å; M215-W555 VanDerWaalsContact CE-CD1 3.48Å; M215-W555 HydrophobicContact CE-CD2 4.02Å; M215-W555 HydrophobicContact CE-CG 3.49Å; M215-W555 VanDerWaalsContact CE-CG 3.49Å; M215-W555 HydrophobicContact CG-CG 4.49Å
216K93.6Very high94.9Very high139 Ų13940 Ų4060%0.60420%0.195SC*.  trans-79150.3172.1-55.4177-175.8172.20110.3T214 M218 Q219 M220T214-K216 PolarHBondContact O-N 3Å; K216-M218 VanDerWaalsContact C-N 3.34Å; K216-M218 PolarHBondContact O-N 3.14Å; K216-Q219 HydrophobicContact CB-CB 4.5Å; K216-Q219 HydrophobicContact CB-CG 4.15Å; K216-Q219 VanDerWaalsContact CB-OE1 3.29Å; K216-Q219 WeakPolarHBondContact O-CB 3.31Å; K216-Q219 PolarHBondContact O-N 3Å; K216-M220 PolarHBondContact O-N 2.95Å
217F91.5Very high94.9Very high61 Ų6140 Ų4027%0.26820%0.195SC..G310 helixtrans-56.6-45-177.6-173-86.2000113Q219 M220 V225 F228 V312F217-Q219 PolarHBondContact O-N 3.47Å; F217-Q219 VanDerWaalsContact O-N 3.11Å; F217-M220 HydrophobicContact CB-CE 4.35Å; F217-M220 HydrophobicContact CD1-CE 4.33Å; F217-M220 HydrophobicContact CD2-CE 3.21Å; F217-M220 HydrophobicContact CD2-SD 4.42Å; F217-M220 HydrophobicContact CE1-CE 4.44Å; F217-M220 HydrophobicContact CE2-CE 3.36Å; F217-M220 HydrophobicContact CG-CE 3.73Å; F217-M220 HydrophobicContact CZ-CE 3.99Å; F217-M220 WeakPolarHBondContact O-CG 3.41Å; F217-M220 PolarHBondContact O-N 3.47Å; F217-V225 HydrophobicContact CE1-CG1 4.48Å; F217-F228 AromaticContact CE2-CD1 3.43Å; F217-F228 HydrophobicContact CE2-CD1 3.43Å; F217-F228 VanDerWaalsContact CE2-CD1 3.43Å; F217-F228 HydrophobicContact CE2-CD2 4.43Å; F217-F228 AromaticContact CE2-CE1 3.55Å; F217-F228 HydrophobicContact CE2-CE1 3.55Å; F217-F228 AromaticContact CE2-CG 3.88Å; F217-F228 HydrophobicContact CE2-CG 3.88Å; F217-F228 HydrophobicContact CE2-CZ 4.14Å; F217-F228 AromaticContact CZ-CD1 3.36Å; F217-F228 HydrophobicContact CZ-CD1 3.36Å; F217-F228 AromaticContact CZ-CE1 3.6Å; F217-F228 HydrophobicContact CZ-CE1 3.6Å; F217-F228 HydrophobicContact CZ-CG 4.16Å; F217-V312 HydrophobicContact CE1-CG1 4.32Å
218M92.9Very high94.9Very high59 Ų5941.1 Ų41.129%0.29120%0.199SC..G310 helixtrans-73.53.1179.3-63.5-61.4-72.100114.1K216 H308 Q309 V312K216-M218 VanDerWaalsContact C-N 3.34Å; K216-M218 PolarHBondContact O-N 3.14Å; M218-H308 PolarHBondContact O-CE1 3.47Å; M218-H308 PolarHBondContact O-ND1 3.31Å; M218-Q309 HydrophobicContact CE-CB 3.85Å; M218-Q309 HydrophobicContact CE-CG 3.84Å; M218-V312 HydrophobicContact CE-CB 4.15Å; M218-V312 HydrophobicContact CE-CG1 4.21Å; M218-V312 HydrophobicContact CE-CG2 4.43Å; M218-V312 HydrophobicContact SD-CB 4.38Å; M218-V312 HydrophobicContact SD-CG1 3.85Å
219Q91.5Very high95Very high35 Ų3538.6 Ų38.616%0.16419%0.186CC..G310 helixtrans-116.20.1178.3-60.9173.3-35.600112.2K216 F217 W555 N556K216-Q219 HydrophobicContact CB-CB 4.5Å; K216-Q219 HydrophobicContact CB-CG 4.15Å; K216-Q219 VanDerWaalsContact CB-OE1 3.29Å; K216-Q219 WeakPolarHBondContact O-CB 3.31Å; K216-Q219 PolarHBondContact O-N 3Å; F217-Q219 PolarHBondContact O-N 3.47Å; F217-Q219 VanDerWaalsContact O-N 3.11Å; Q219-W555 PolarHBondContact O-NE1 3.38Å; Q219-N556 VanDerWaalsContact CD-O 3.23Å; Q219-N556 PolarHBondContact NE2-O 3.1Å; Q219-N556 PolarHBondContact OE1-O 3.38Å
220M95Very high95.1Very high0 Ų028.4 Ų28.40%015%0.148CC..SBendtrans-69.3153.1178.4-62.4-168.6-57.300111.2I207 K211 M215 K216 F217 T224 V225 H308I207-M220 HydrophobicContact CG2-CE 3.88Å; I207-M220 HydrophobicContact CG2-SD 3.93Å; K211-M220 HydrophobicContact CD-SD 4.19Å; M215-M220 HydrophobicContact CG-CG 3.74Å; M215-M220 HydrophobicContact SD-CB 4.46Å; M215-M220 HydrophobicContact SD-CG 3.67Å; M215-M220 HydrophobicContact SD-SD 4.25Å; K216-M220 PolarHBondContact O-N 2.95Å; F217-M220 HydrophobicContact CB-CE 4.35Å; F217-M220 HydrophobicContact CD1-CE 4.33Å; F217-M220 HydrophobicContact CD2-CE 3.21Å; F217-M220 HydrophobicContact CD2-SD 4.42Å; F217-M220 HydrophobicContact CE1-CE 4.44Å; F217-M220 HydrophobicContact CE2-CE 3.36Å; F217-M220 HydrophobicContact CG-CE 3.73Å; F217-M220 HydrophobicContact CZ-CE 3.99Å; F217-M220 WeakPolarHBondContact O-CG 3.41Å; F217-M220 PolarHBondContact O-N 3.47Å; M220-T224 HydrophobicContact CB-CG2 4.37Å; M220-T224 HydrophobicContact CE-CG2 4.37Å; M220-T224 HydrophobicContact SD-CG2 4.08Å; M220-V225 HydrophobicContact CB-CG2 3.87Å; M220-V225 HydrophobicContact CE-CG2 4.08Å; M220-H308 PolarHBondContact O-NE2 3.45Å
221P95.5Very high95.1Very high0 Ų026.2 Ų26.20%013%0.133CC..  trans-50.9145.5168.6-29.638.6000112.3Q126 F223 T224 V225 T534Q126-P221 HydrophobicContact CB-CG 4.12Å; Q126-P221 HydrophobicContact CG-CB 4.3Å; Q126-P221 HydrophobicContact CG-CG 4.13Å; P221-F223 VanDerWaalsContact C-N 3.29Å; P221-F223 PolarHBondContact O-N 3.06Å; P221-T224 WeakPolarHBondContact O-CB 3.43Å; P221-T224 PolarHBondContact O-N 2.96Å; P221-T224 VanDerWaalsContact O-N 3.12Å; P221-V225 WeakPolarHBondContact O-CG2 3.41Å; P221-V225 PolarHBondContact O-N 3.37Å; P221-T534 HydrophobicContact CB-CG2 3.91Å; P221-T534 HydrophobicContact CG-CG2 3.72Å
222M95.9Very high95.3Very high0 Ų026.9 Ų26.90%014%0.139CC..Hα-helixtrans-69.5-29.6-176.4-85.7-47.4-63.300112.3T224 V225 T226 E295 L305 M311 V312M222-T224 VanDerWaalsContact C-N 3.31Å; M222-V225 HydrophobicContact CE-CB 4.31Å; M222-V225 HydrophobicContact CE-CG1 4.32Å; M222-V225 PolarHBondContact O-N 2.91Å; M222-V225 HydrophobicContact SD-CB 4.27Å; M222-V225 HydrophobicContact SD-CG2 4.44Å; M222-T226 HydrophobicContact CE-CG2 4.22Å; M222-T226 WeakPolarHBondContact O-CB 3.31Å; M222-T226 WeakPolarHBondContact O-CG2 3.45Å; M222-T226 PolarHBondContact O-N 2.78Å; M222-T226 PolarHBondContact O-OG1 3.39Å; M222-E295 PolarHBondContact N-OE1 3.02Å; M222-L305 HydrophobicContact CB-CD2 4.09Å; M222-L305 HydrophobicContact CG-CD2 3.28Å; M222-M311 HydrophobicContact CE-CB 3.79Å; M222-M311 HydrophobicContact SD-CB 4.31Å; M222-V312 HydrophobicContact CE-CG2 4.18Å; M222-V312 HydrophobicContact SD-CG2 3.66Å
223F97.4Very high95.5Very high0 Ų026.8 Ų26.80%014%0.138CC..Hα-helixtrans-62-40.4171.2-176.8-115.6000112.2L118 W119 V122 V123 P221 T226 T227 P288 I292 E295 W434L118-F223 HydrophobicContact CB-CZ 4.05Å; W119-F223 AromaticContact CD1-CZ 3.68Å; V122-F223 HydrophobicContact CB-CD1 4.34Å; V122-F223 HydrophobicContact CB-CE1 3.94Å; V122-F223 HydrophobicContact CG1-CD1 3.99Å; V122-F223 HydrophobicContact CG1-CE1 4.11Å; V123-F223 HydrophobicContact CG2-CD1 4.12Å; V123-F223 HydrophobicContact CG2-CE1 3.84Å; P221-F223 VanDerWaalsContact C-N 3.29Å; P221-F223 PolarHBondContact O-N 3.06Å; F223-T226 WeakPolarHBondContact CA-OG1 3.46Å; F223-T226 PolarHBondContact O-OG1 3.34Å; F223-T227 WeakPolarHBondContact O-CB 3.41Å; F223-T227 PolarHBondContact O-N 3.45Å; F223-T227 PolarHBondContact O-OG1 3.03Å; F223-P288 HydrophobicContact CE2-CB 4.3Å; F223-I292 HydrophobicContact CD2-CG1 3.76Å; F223-I292 HydrophobicContact CE2-CD1 4.21Å; F223-I292 HydrophobicContact CE2-CG1 3.49Å; F223-I292 VanDerWaalsContact CE2-CG1 3.49Å; F223-I292 HydrophobicContact CZ-CG1 4.36Å; F223-E295 HydrophobicContact CB-CG 3.63Å; F223-E295 PolarHBondContact N-OE1 2.86Å; F223-W434 HydrophobicContact CD1-CH2 4.45Å; F223-W434 HydrophobicContact CG-CH2 4.43Å
224T97.6Very high95.8Very high0 Ų021 Ų210%010%0.101CC..Hα-helixtrans-65.9-44.1173.9-65.20000111.9V123 Q126 I127 I207 M220 P221 M222 T227 F228V123-T224 HydrophobicContact CG1-CG2 4.46Å; Q126-T224 WeakPolarHBondContact CB-OG1 3.39Å; Q126-T224 PolarHBondContact OE1-OG1 3.21Å; I127-T224 HydrophobicContact CG2-CG2 3.52Å; I207-T224 HydrophobicContact CD1-CG2 4.22Å; I207-T224 HydrophobicContact CG1-CG2 4.19Å; I207-T224 HydrophobicContact CG2-CG2 3.89Å; M220-T224 HydrophobicContact CB-CG2 4.37Å; M220-T224 HydrophobicContact CE-CG2 4.37Å; M220-T224 HydrophobicContact SD-CG2 4.08Å; P221-T224 WeakPolarHBondContact O-CB 3.43Å; P221-T224 PolarHBondContact O-N 2.96Å; P221-T224 VanDerWaalsContact O-N 3.12Å; M222-T224 VanDerWaalsContact C-N 3.31Å; T224-T227 WeakPolarHBondContact O-CB 3.43Å; T224-T227 PolarHBondContact O-N 3.31Å; T224-F228 PolarHBondContact O-N 3.42Å
225V97.2Very high96Very high0 Ų021.1 Ų21.10%010%0.099CC..Hα-helixtrans-64.3-45.3179.5175.50000111.9F217 M220 P221 M222 T227 F228 I229 V312F217-V225 HydrophobicContact CE1-CG1 4.48Å; M220-V225 HydrophobicContact CB-CG2 3.87Å; M220-V225 HydrophobicContact CE-CG2 4.08Å; P221-V225 WeakPolarHBondContact O-CG2 3.41Å; P221-V225 PolarHBondContact O-N 3.37Å; M222-V225 HydrophobicContact CE-CB 4.31Å; M222-V225 HydrophobicContact CE-CG1 4.32Å; M222-V225 PolarHBondContact O-N 2.91Å; M222-V225 HydrophobicContact SD-CB 4.27Å; M222-V225 HydrophobicContact SD-CG2 4.44Å; V225-T227 VanDerWaalsContact C-N 3.31Å; V225-T227 PolarHBondContact O-N 3.47Å; V225-F228 PolarHBondContact O-N 3.35Å; V225-I229 HydrophobicContact CG1-CD1 3.88Å; V225-I229 WeakPolarHBondContact O-CG1 3.35Å; V225-I229 PolarHBondContact O-N 3.07Å; V225-V312 HydrophobicContact CG1-CB 4.36Å; V225-V312 HydrophobicContact CG1-CG1 3.89Å; V225-V312 HydrophobicContact CG1-CG2 3.98Å; V225-V312 HydrophobicContact CG2-CG2 4.43Å
226T97.6Very high96.1Very high0 Ų025.9 Ų25.90%012%0.124CC..Hα-helixtrans-64-38176.750.40000111.5M222 F223 I229 T230 L287 G291 T315M222-T226 HydrophobicContact CE-CG2 4.22Å; M222-T226 WeakPolarHBondContact O-CB 3.31Å; M222-T226 WeakPolarHBondContact O-CG2 3.45Å; M222-T226 PolarHBondContact O-N 2.78Å; M222-T226 PolarHBondContact O-OG1 3.39Å; F223-T226 WeakPolarHBondContact CA-OG1 3.46Å; F223-T226 PolarHBondContact O-OG1 3.34Å; T226-I229 PolarHBondContact O-N 3.02Å; T226-T230 VanDerWaalsContact O-CB 3.28Å; T226-T230 WeakPolarHBondContact O-CB 3Å; T226-T230 PolarHBondContact O-N 3.46Å; T226-T230 PolarHBondContact O-OG1 3.32Å; T226-L287 VanDerWaalsContact CB-O 3.23Å; T226-L287 WeakPolarHBondContact CB-O 3.33Å; T226-L287 WeakPolarHBondContact CG2-O 3.44Å; T226-G291 VanDerWaalsContact OG1-CA 3.32Å; T226-G291 WeakPolarHBondContact OG1-CA 3.5Å; T226-T315 HydrophobicContact CG2-CG2 3.95Å
227T97.9Very high96.3Very high0 Ų019.3 Ų19.30%010%0.095CC..Hα-helixtrans-59.9-50171.6-610000111.4W119 V123 I207 F223 T224 V225 I229 T230 T231W119-T227 HydrophobicContact CD2-CG2 3.47Å; W119-T227 VanDerWaalsContact CD2-CG2 3.47Å; W119-T227 VanDerWaalsContact CE2-CG2 3.42Å; W119-T227 HydrophobicContact CE3-CG2 3.89Å; W119-T227 HydrophobicContact CG-CG2 3.81Å; W119-T227 HydrophobicContact CH2-CG2 4.21Å; W119-T227 HydrophobicContact CZ2-CG2 3.82Å; W119-T227 HydrophobicContact CZ3-CG2 4.24Å; W119-T227 PolarHBondContact NE1-OG1 2.87Å; W119-T227 VanDerWaalsContact NE1-OG1 3.13Å; V123-T227 HydrophobicContact CG2-CG2 4.1Å; I207-T227 HydrophobicContact CD1-CG2 3.88Å; F223-T227 WeakPolarHBondContact O-CB 3.41Å; F223-T227 PolarHBondContact O-N 3.45Å; F223-T227 PolarHBondContact O-OG1 3.03Å; T224-T227 WeakPolarHBondContact O-CB 3.43Å; T224-T227 PolarHBondContact O-N 3.31Å; V225-T227 VanDerWaalsContact C-N 3.31Å; V225-T227 PolarHBondContact O-N 3.47Å; T227-I229 PolarHBondContact O-N 2.93Å; T227-T230 CarbonylContact O-C 3.52Å; T227-T230 WeakPolarHBondContact O-CA 3.43Å; T227-T230 WeakPolarHBondContact O-CB 3.42Å; T227-T230 PolarHBondContact O-N 2.85Å; T227-T230 VanDerWaalsContact O-N 3.09Å; T227-T231 HydrophobicContact CG2-CG2 4.38Å; T227-T231 WeakPolarHBondContact O-CG2 3.39Å; T227-T231 PolarHBondContact O-N 3.24Å
228F97.7Very high96.5Very high23 Ų2316.6 Ų16.610%0.1018%0.084CC..Hα-helixtrans-56.1-49.2177.9174-100.4000112.3F204 I207 L208 F217 T224 V225 T230 T231 L232F204-F228 HydrophobicContact CD2-CD2 4.11Å; F204-F228 AromaticContact CD2-CE2 3.55Å; F204-F228 HydrophobicContact CD2-CE2 3.55Å; F204-F228 HydrophobicContact CD2-CZ 4.22Å; F204-F228 HydrophobicContact CE2-CD2 4.34Å; F204-F228 AromaticContact CE2-CE2 3.37Å; F204-F228 HydrophobicContact CE2-CE2 3.37Å; F204-F228 AromaticContact CE2-CZ 3.63Å; F204-F228 HydrophobicContact CE2-CZ 3.63Å; F204-F228 HydrophobicContact CG-CE2 4.47Å; F204-F228 HydrophobicContact CZ-CE2 4.22Å; F204-F228 HydrophobicContact CZ-CZ 4.41Å; I207-F228 HydrophobicContact CB-CB 4.49Å; I207-F228 HydrophobicContact CB-CD2 4.18Å; I207-F228 HydrophobicContact CD1-CB 3.79Å; I207-F228 HydrophobicContact CG2-CB 4.04Å; I207-F228 HydrophobicContact CG2-CD2 4.08Å; I207-F228 HydrophobicContact CG2-CG 4.32Å; L208-F228 HydrophobicContact CD1-CE2 3.9Å; L208-F228 HydrophobicContact CD1-CZ 4.42Å; L208-F228 HydrophobicContact CD2-CD2 4.47Å; L208-F228 HydrophobicContact CD2-CE2 3.58Å; L208-F228 HydrophobicContact CD2-CZ 3.83Å; L208-F228 HydrophobicContact CG-CD2 4.35Å; L208-F228 HydrophobicContact CG-CE2 3.55Å; L208-F228 HydrophobicContact CG-CZ 4.24Å; F217-F228 AromaticContact CE2-CD1 3.43Å; F217-F228 HydrophobicContact CE2-CD1 3.43Å; F217-F228 VanDerWaalsContact CE2-CD1 3.43Å; F217-F228 HydrophobicContact CE2-CD2 4.43Å; F217-F228 AromaticContact CE2-CE1 3.55Å; F217-F228 HydrophobicContact CE2-CE1 3.55Å; F217-F228 AromaticContact CE2-CG 3.88Å; F217-F228 HydrophobicContact CE2-CG 3.88Å; F217-F228 HydrophobicContact CE2-CZ 4.14Å; F217-F228 AromaticContact CZ-CD1 3.36Å; F217-F228 HydrophobicContact CZ-CD1 3.36Å; F217-F228 AromaticContact CZ-CE1 3.6Å; F217-F228 HydrophobicContact CZ-CE1 3.6Å; F217-F228 HydrophobicContact CZ-CG 4.16Å; T224-F228 PolarHBondContact O-N 3.42Å; V225-F228 PolarHBondContact O-N 3.35Å; F228-T230 VanDerWaalsContact C-N 3.26Å; F228-T230 PolarHBondContact O-N 3.47Å; F228-T231 PolarHBondContact O-N 2.9Å; F228-T231 PolarHBondContact O-OG1 3.4Å; F228-L232 HydrophobicContact CE1-CD1 4.13Å; F228-L232 HydrophobicContact CZ-CD1 4.36Å; F228-L232 PolarHBondContact O-N 3.47Å
229I96.9Very high96.6Very high9 Ų916.3 Ų16.35%0.0469%0.086CC..Hα-helixtrans-63.6-37.2178.6-67.1168.4000110.7V225 T226 T227 T231 L232 I233 L287 T315 A316 A319V225-I229 HydrophobicContact CG1-CD1 3.88Å; V225-I229 WeakPolarHBondContact O-CG1 3.35Å; V225-I229 PolarHBondContact O-N 3.07Å; T226-I229 PolarHBondContact O-N 3.02Å; T227-I229 PolarHBondContact O-N 2.93Å; I229-T231 PolarHBondContact O-N 2.95Å; I229-L232 WeakPolarHBondContact O-CB 3.46Å; I229-L232 PolarHBondContact O-N 2.97Å; I229-I233 PolarHBondContact O-N 3.18Å; I229-L287 HydrophobicContact CG2-CD1 4.23Å; I229-T315 HydrophobicContact CB-CG2 4.02Å; I229-T315 HydrophobicContact CD1-CG2 3.43Å; I229-T315 VanDerWaalsContact CD1-CG2 3.43Å; I229-T315 HydrophobicContact CG1-CG2 4.31Å; I229-T315 HydrophobicContact CG2-CG2 3.98Å; I229-A316 HydrophobicContact CD1-CB 4.31Å; I229-A319 HydrophobicContact CG2-CB 3.33Å
230T97.9Very high96.9Very high0 Ų016.5 Ų16.50%09%0.091CC..Hα-helixtrans-65.1-39.3176.4-57.80000112.4W119 T226 T227 F228 L232 I233 V234 I284 L287 P288W119-T230 HydrophobicContact CH2-CG2 3.7Å; W119-T230 HydrophobicContact CZ2-CG2 3.63Å; T226-T230 VanDerWaalsContact O-CB 3.28Å; T226-T230 WeakPolarHBondContact O-CB 3Å; T226-T230 PolarHBondContact O-N 3.46Å; T226-T230 PolarHBondContact O-OG1 3.32Å; T227-T230 CarbonylContact O-C 3.52Å; T227-T230 WeakPolarHBondContact O-CA 3.43Å; T227-T230 WeakPolarHBondContact O-CB 3.42Å; T227-T230 PolarHBondContact O-N 2.85Å; T227-T230 VanDerWaalsContact O-N 3.09Å; F228-T230 VanDerWaalsContact C-N 3.26Å; F228-T230 PolarHBondContact O-N 3.47Å; T230-L232 PolarHBondContact O-N 2.83Å; T230-I233 WeakPolarHBondContact O-CA 3.46Å; T230-I233 WeakPolarHBondContact O-CB 3.46Å; T230-I233 PolarHBondContact O-N 2.85Å; T230-V234 HydrophobicContact CG2-CG2 4.35Å; T230-V234 WeakPolarHBondContact O-CG2 3.42Å; T230-V234 PolarHBondContact O-N 3.04Å; T230-I284 HydrophobicContact CG2-CB 3.97Å; T230-I284 HydrophobicContact CG2-CG1 4.05Å; T230-I284 HydrophobicContact CG2-CG2 3.71Å; T230-I284 WeakPolarHBondContact CG2-O 3.27Å; T230-L287 WeakPolarHBondContact OG1-CB 3.02Å; T230-P288 HydrophobicContact CG2-CG 3.94Å; T230-P288 WeakPolarHBondContact OG1-CD 3.35Å; T230-P288 WeakPolarHBondContact OG1-CG 3.25Å
231T97.8Very high96.9Very high0 Ų016.6 Ų16.60%09%0.091CC..Hα-helixtrans-60.9-32.5177.660.80000112.5W119 G200 F203 T227 F228 I229 V234 I235W119-T231 HydrophobicContact CH2-CG2 3.95Å; W119-T231 HydrophobicContact CZ3-CG2 3.77Å; G200-T231 WeakPolarHBondContact O-CB 3.18Å; F203-T231 HydrophobicContact CB-CG2 3.54Å; T227-T231 HydrophobicContact CG2-CG2 4.38Å; T227-T231 WeakPolarHBondContact O-CG2 3.39Å; T227-T231 PolarHBondContact O-N 3.24Å; F228-T231 PolarHBondContact O-N 2.9Å; F228-T231 PolarHBondContact O-OG1 3.4Å; I229-T231 PolarHBondContact O-N 2.95Å; T231-V234 PolarHBondContact O-N 3.48Å; T231-I235 WeakPolarHBondContact O-CD1 3.19Å; T231-I235 WeakPolarHBondContact O-CG1 3.41Å; T231-I235 PolarHBondContact O-N 2.97Å
232L96.5Very high97Very high66 Ų6617.9 Ų17.935%0.34610%0.099SC..Hα-helixtrans-63.8-44171.7-75.1168.8000111.7F204 F228 I229 T230 I235 L236F204-L232 HydrophobicContact CD2-CD2 3.89Å; F204-L232 HydrophobicContact CD2-CG 4.03Å; F204-L232 HydrophobicContact CE2-CD1 4.35Å; F204-L232 HydrophobicContact CE2-CD2 3.27Å; F204-L232 HydrophobicContact CE2-CG 3.68Å; F204-L232 HydrophobicContact CZ-CD2 3.95Å; F228-L232 HydrophobicContact CE1-CD1 4.13Å; F228-L232 HydrophobicContact CZ-CD1 4.36Å; F228-L232 PolarHBondContact O-N 3.47Å; I229-L232 WeakPolarHBondContact O-CB 3.46Å; I229-L232 PolarHBondContact O-N 2.97Å; T230-L232 PolarHBondContact O-N 2.83Å; L232-I235 PolarHBondContact O-N 2.86Å; L232-L236 VanDerWaalsContact O-CG 3.31Å; L232-L236 WeakPolarHBondContact O-CG 3.32Å; L232-L236 PolarHBondContact O-N 3.23Å; L232-L236 VanDerWaalsContact O-N 3.17Å
233I97.5Very high97.1Very high1 Ų121.7 Ų21.71%0.00512%0.122CC..Hα-helixtrans-62.8-44.8176.7-53.2176.8000109.9I229 T230 I235 L236 A237 P280 I284 L287 A319 F323I229-I233 PolarHBondContact O-N 3.18Å; T230-I233 WeakPolarHBondContact O-CA 3.46Å; T230-I233 WeakPolarHBondContact O-CB 3.46Å; T230-I233 PolarHBondContact O-N 2.85Å; I233-I235 PolarHBondContact O-N 2.9Å; I233-L236 PolarHBondContact O-N 3.11Å; I233-A237 HydrophobicContact CG2-CB 4.28Å; I233-A237 WeakPolarHBondContact O-CB 3.44Å; I233-A237 PolarHBondContact O-N 3.15Å; I233-P280 HydrophobicContact CG2-CB 3.64Å; I233-I284 HydrophobicContact CB-CD1 4.27Å; I233-I284 HydrophobicContact CB-CG1 3.9Å; I233-I284 HydrophobicContact CG2-CD1 3.82Å; I233-I284 HydrophobicContact CG2-CG1 3.65Å; I233-L287 HydrophobicContact CD1-CD1 3.66Å; I233-A319 HydrophobicContact CD1-CB 3.83Å; I233-A319 HydrophobicContact CG1-CB 3.96Å; I233-F323 HydrophobicContact CB-CZ 4.47Å; I233-F323 HydrophobicContact CG1-CE2 4.42Å; I233-F323 HydrophobicContact CG2-CE2 4.15Å; I233-F323 HydrophobicContact CG2-CZ 3.88Å
234V97.2Very high97Very high0 Ų021.7 Ų21.70%012%0.122CC..Hα-helixtrans-55.2-50.4177.2172.70000111.1T196 T230 T231 L236 F238 I284T196-V234 HydrophobicContact CG2-CG1 3.93Å; T230-V234 HydrophobicContact CG2-CG2 4.35Å; T230-V234 WeakPolarHBondContact O-CG2 3.42Å; T230-V234 PolarHBondContact O-N 3.04Å; T231-V234 PolarHBondContact O-N 3.48Å; V234-L236 VanDerWaalsContact C-N 3.27Å; V234-L236 PolarHBondContact O-N 3.29Å; V234-F238 HydrophobicContact CB-CD2 4.4Å; V234-F238 HydrophobicContact CG1-CD2 3.88Å; V234-F238 HydrophobicContact CG1-CE2 4.31Å; V234-F238 WeakPolarHBondContact O-CB 3.47Å; V234-F238 WeakPolarHBondContact O-CD2 3.46Å; V234-F238 PolarHBondContact O-N 3.09Å; V234-F238 VanDerWaalsContact O-N 3.14Å; V234-I284 HydrophobicContact CB-CD1 4.3Å; V234-I284 HydrophobicContact CG2-CD1 3.67Å; V234-I284 HydrophobicContact CG2-CG1 3.96Å; V234-I284 HydrophobicContact CG2-CG2 3.74Å
235I97.4Very high97Very high47 Ų4721.8 Ų21.824%0.24112%0.122CC..Hα-helixtrans-60.8-36.5-178.1-68.4163.2000111.8I201 F204 T231 L232 I233 P239I201-I235 HydrophobicContact CG1-CD1 4.26Å; I201-I235 HydrophobicContact CG1-CG1 3.95Å; F204-I235 HydrophobicContact CB-CD1 3.91Å; F204-I235 HydrophobicContact CD1-CD1 4.48Å; F204-I235 HydrophobicContact CD2-CD1 4.39Å; F204-I235 HydrophobicContact CG-CD1 4.01Å; T231-I235 WeakPolarHBondContact O-CD1 3.19Å; T231-I235 WeakPolarHBondContact O-CG1 3.41Å; T231-I235 PolarHBondContact O-N 2.97Å; L232-I235 PolarHBondContact O-N 2.86Å; I233-I235 PolarHBondContact O-N 2.9Å; I235-P239 VanDerWaalsContact O-CD 3.25Å; I235-P239 WeakPolarHBondContact O-CD 3.47Å; I235-P239 WeakPolarHBondContact O-CG 3.28Å
236L96.6Very high97Very high104 Ų10423.6 Ų23.655%0.54514%0.137SC..Hα-helixtrans-88.3-32.7-176.2-64.9174000113.6L232 I233 V234 P240 F323L232-L236 VanDerWaalsContact O-CG 3.31Å; L232-L236 WeakPolarHBondContact O-CG 3.32Å; L232-L236 PolarHBondContact O-N 3.23Å; L232-L236 VanDerWaalsContact O-N 3.17Å; I233-L236 PolarHBondContact O-N 3.11Å; V234-L236 VanDerWaalsContact C-N 3.27Å; V234-L236 PolarHBondContact O-N 3.29Å; L236-P240 WeakPolarHBondContact O-CD 3.5Å; L236-F323 HydrophobicContact CB-CE1 3.92Å; L236-F323 HydrophobicContact CB-CE2 4.29Å; L236-F323 HydrophobicContact CB-CZ 3.52Å; L236-F323 HydrophobicContact CD1-CE2 4.17Å; L236-F323 HydrophobicContact CD1-CZ 4.24Å
237A96.3Very high97Very high0 Ų025.1 Ų25.10%015%0.146CC..Hα-helixtrans-93.2-29.9-172.100000114.3I233 P240 W277 P280 F323I233-A237 HydrophobicContact CG2-CB 4.28Å; I233-A237 WeakPolarHBondContact O-CB 3.44Å; I233-A237 PolarHBondContact O-N 3.15Å; A237-P240 VanDerWaalsContact O-CD 3.26Å; A237-P240 WeakPolarHBondContact O-CD 3.36Å; A237-W277 WeakPolarHBondContact O-CB 3.4Å; A237-W277 VanDerWaalsContact O-CD1 3.27Å; A237-P280 HydrophobicContact CB-CB 3.58Å; A237-P280 HydrophobicContact CB-CG 4.31Å; A237-F323 HydrophobicContact CB-CE1 3.95Å; A237-F323 HydrophobicContact CB-CZ 4.14Å
238F95.8Very high96.9Very high5 Ų525.2 Ų25.22%0.02215%0.146CC..Hα-helixtrans-69.5-33.9179.7-90.6-99.3000115.2M112 T196 L197 V234 L241 T242 W277 E281 I284M112-F238 HydrophobicContact CE-CE2 4Å; M112-F238 HydrophobicContact CE-CZ 3.68Å; T196-F238 HydrophobicContact CG2-CD1 3.92Å; T196-F238 HydrophobicContact CG2-CD2 3.97Å; T196-F238 HydrophobicContact CG2-CE1 3.45Å; T196-F238 VanDerWaalsContact CG2-CE1 3.45Å; T196-F238 HydrophobicContact CG2-CE2 3.48Å; T196-F238 VanDerWaalsContact CG2-CE2 3.48Å; T196-F238 HydrophobicContact CG2-CG 4.18Å; T196-F238 HydrophobicContact CG2-CZ 3.24Å; L197-F238 HydrophobicContact CD1-CB 4.35Å; V234-F238 HydrophobicContact CB-CD2 4.4Å; V234-F238 HydrophobicContact CG1-CD2 3.88Å; V234-F238 HydrophobicContact CG1-CE2 4.31Å; V234-F238 WeakPolarHBondContact O-CB 3.47Å; V234-F238 WeakPolarHBondContact O-CD2 3.46Å; V234-F238 PolarHBondContact O-N 3.09Å; V234-F238 VanDerWaalsContact O-N 3.14Å; F238-L241 HydrophobicContact CE1-CD2 4.41Å; F238-L241 PolarHBondContact O-N 3.03Å; F238-T242 PolarHBondContact O-N 3.4Å; F238-T242 PolarHBondContact O-OG1 3.5Å; F238-W277 AromaticContact CE2-NE1 3.68Å; F238-W277 AromaticContact CZ-NE1 3.66Å; F238-E281 WeakPolarHBondContact CE2-OE2 3.14Å; F238-E281 WeakPolarHBondContact CZ-OE2 3.31Å; F238-I284 HydrophobicContact CD2-CD1 4.28Å; F238-I284 HydrophobicContact CE2-CD1 3.87Å
239P96.4Very high96.7Very high53 Ų5324.8 Ų24.834%0.34415%0.145SC..Hα-helixtrans-58.4-44.1177-23.132.5000113.8I235 L241 T242 V243I235-P239 VanDerWaalsContact O-CD 3.25Å; I235-P239 WeakPolarHBondContact O-CD 3.47Å; I235-P239 WeakPolarHBondContact O-CG 3.28Å; P239-L241 VanDerWaalsContact C-N 3.35Å; P239-L241 PolarHBondContact O-N 3.34Å; P239-T242 WeakPolarHBondContact O-CB 3.38Å; P239-T242 PolarHBondContact O-N 3.36Å; P239-T242 VanDerWaalsContact O-N 3.17Å; P239-V243 WeakPolarHBondContact O-CG2 3.44Å; P239-V243 PolarHBondContact O-N 2.94Å
240P96Very high96.7Very high39 Ų3926.2 Ų26.225%0.25315%0.154SC..Hα-helixtrans-50.8-46.8169.7-3032.8000114.6L236 A237 V243 A244 V276L236-P240 WeakPolarHBondContact O-CD 3.5Å; A237-P240 VanDerWaalsContact O-CD 3.26Å; A237-P240 WeakPolarHBondContact O-CD 3.36Å; P240-V243 PolarHBondContact O-N 3.32Å; P240-A244 WeakPolarHBondContact O-CB 3.49Å; P240-A244 PolarHBondContact O-N 3.13Å; P240-V276 HydrophobicContact CB-CG1 4.01Å; P240-V276 HydrophobicContact CG-CG1 3.98Å
241L96.3Very high96.5Very high1 Ų126.8 Ų26.81%0.00516%0.157CC..Hα-helixtrans-63.4-45.4176.6-179.668.7000111.6I189 F238 P239 V243 A244 L245 F274 W277I189-L241 HydrophobicContact CG2-CD2 4.02Å; F238-L241 HydrophobicContact CE1-CD2 4.41Å; F238-L241 PolarHBondContact O-N 3.03Å; P239-L241 VanDerWaalsContact C-N 3.35Å; P239-L241 PolarHBondContact O-N 3.34Å; L241-V243 PolarHBondContact O-N 3.31Å; L241-A244 PolarHBondContact O-N 2.93Å; L241-A244 VanDerWaalsContact O-N 3.15Å; L241-L245 HydrophobicContact CD1-CD1 3.98Å; L241-L245 HydrophobicContact CD1-CD2 4.34Å; L241-L245 HydrophobicContact CD1-CG 3.91Å; L241-L245 HydrophobicContact CD2-CD1 4.08Å; L241-L245 HydrophobicContact CG-CD1 3.66Å; L241-L245 HydrophobicContact CG-CG 4.04Å; L241-L245 WeakPolarHBondContact O-CB 3.46Å; L241-L245 VanDerWaalsContact O-CG 3.3Å; L241-L245 WeakPolarHBondContact O-CG 3.22Å; L241-L245 PolarHBondContact O-N 3.49Å; L241-F274 HydrophobicContact CD1-CD2 4.47Å; L241-W277 HydrophobicContact CB-CB 3.89Å; L241-W277 HydrophobicContact CB-CD2 3.9Å; L241-W277 HydrophobicContact CB-CE3 4.48Å; L241-W277 HydrophobicContact CB-CG 3.59Å; L241-W277 HydrophobicContact CD1-CD2 3.93Å; L241-W277 HydrophobicContact CD1-CE3 3.67Å; L241-W277 HydrophobicContact CD1-CG 4.44Å; L241-W277 HydrophobicContact CD1-CZ3 4.04Å; L241-W277 HydrophobicContact CD2-CD2 3.79Å; L241-W277 HydrophobicContact CD2-CE3 4.22Å; L241-W277 HydrophobicContact CD2-CG 4.27Å; L241-W277 HydrophobicContact CD2-CH2 4.18Å; L241-W277 HydrophobicContact CD2-CZ2 3.76Å; L241-W277 HydrophobicContact CD2-CZ3 4.4Å; L241-W277 HydrophobicContact CG-CD2 4.06Å; L241-W277 HydrophobicContact CG-CE3 4.32Å; L241-W277 HydrophobicContact CG-CG 4.29Å
242T97.4Very high96.2Very high27 Ų2728.1 Ų28.117%0.16616%0.162CC..Hα-helixtrans-56.6-41.1-179.3-55.40000111Q190 F238 P239 A246Q190-T242 VanDerWaalsContact NE2-CG2 3.27Å; Q190-T242 PolarHBondContact NE2-O 3.19Å; Q190-T242 PolarHBondContact OE1-O 3.49Å; F238-T242 PolarHBondContact O-N 3.4Å; F238-T242 PolarHBondContact O-OG1 3.5Å; P239-T242 WeakPolarHBondContact O-CB 3.38Å; P239-T242 PolarHBondContact O-N 3.36Å; P239-T242 VanDerWaalsContact O-N 3.17Å; T242-A246 VanDerWaalsContact O-CB 3.31Å; T242-A246 WeakPolarHBondContact O-CB 3.44Å; T242-A246 PolarHBondContact O-N 3.34Å
243V97.2Very high96Very high81 Ų8126.1 Ų26.149%0.49115%0.152SC..Hα-helixtrans-73.2-45.9176.3174.50000110.8P239 P240 L241 L245 A246 L247P239-V243 WeakPolarHBondContact O-CG2 3.44Å; P239-V243 PolarHBondContact O-N 2.94Å; P240-V243 PolarHBondContact O-N 3.32Å; L241-V243 PolarHBondContact O-N 3.31Å; V243-L245 PolarHBondContact O-N 3.11Å; V243-A246 PolarHBondContact O-N 3.05Å; V243-L247 HydrophobicContact CG1-CD1 3.87Å; V243-L247 HydrophobicContact CG1-CG 4.11Å; V243-L247 VanDerWaalsContact O-CG 3.28Å; V243-L247 WeakPolarHBondContact O-CG 3.47Å; V243-L247 PolarHBondContact O-N 3.18Å
244A96.6Very high95.7Very high0 Ų031.7 Ų31.70%018%0.176CC..Hα-helixtrans-55.7-53.1179.200000111.6P240 L241 A246 L247 M248 W270 F273P240-A244 WeakPolarHBondContact O-CB 3.49Å; P240-A244 PolarHBondContact O-N 3.13Å; L241-A244 PolarHBondContact O-N 2.93Å; L241-A244 VanDerWaalsContact O-N 3.15Å; A244-A246 VanDerWaalsContact C-N 3.3Å; A244-A246 PolarHBondContact O-N 2.61Å; A244-L247 PolarHBondContact O-N 2.76Å; A244-M248 PolarHBondContact O-N 2.89Å; A244-W270 HydrophobicContact CB-CE3 4.29Å; A244-W270 HydrophobicContact CB-CZ3 4Å; A244-W270 VanDerWaalsContact O-CZ3 3.29Å; A244-W270 WeakPolarHBondContact O-CZ3 3.48Å; A244-F273 HydrophobicContact CB-CB 3.94Å
245L97.2Very high95.4Very high1 Ų138.7 Ų38.71%0.00521%0.214CC..Hα-helixtrans-57.7-41.3177.3-67.5171.9000111.9Y185 L186 I189 Q190 L241 V243 M248 T249 W270Y185-L245 HydrophobicContact CD1-CD2 4.35Å; Y185-L245 HydrophobicContact CE1-CD2 3.8Å; L186-L245 HydrophobicContact CD2-CD2 3.7Å; I189-L245 HydrophobicContact CB-CD1 4.02Å; I189-L245 HydrophobicContact CG2-CD1 3.64Å; Q190-L245 HydrophobicContact CB-CD1 4.45Å; L241-L245 HydrophobicContact CD1-CD1 3.98Å; L241-L245 HydrophobicContact CD1-CD2 4.34Å; L241-L245 HydrophobicContact CD1-CG 3.91Å; L241-L245 HydrophobicContact CD2-CD1 4.08Å; L241-L245 HydrophobicContact CG-CD1 3.66Å; L241-L245 HydrophobicContact CG-CG 4.04Å; L241-L245 WeakPolarHBondContact O-CB 3.46Å; L241-L245 VanDerWaalsContact O-CG 3.3Å; L241-L245 WeakPolarHBondContact O-CG 3.22Å; L241-L245 PolarHBondContact O-N 3.49Å; V243-L245 PolarHBondContact O-N 3.11Å; L245-M248 PolarHBondContact O-N 2.92Å; L245-T249 WeakPolarHBondContact O-CB 3.48Å; L245-T249 PolarHBondContact O-N 3.1Å; L245-T249 PolarHBondContact O-OG1 2.91Å; L245-W270 HydrophobicContact CD2-CH2 4.07Å
246A97Very high95.3Very high38 Ų3838.6 Ų38.631%0.31422%0.215SC..Hα-helixtrans-63.3-46176.400000112.1T242 V243 A244 M248 T249 T250T242-A246 VanDerWaalsContact O-CB 3.31Å; T242-A246 WeakPolarHBondContact O-CB 3.44Å; T242-A246 PolarHBondContact O-N 3.34Å; V243-A246 PolarHBondContact O-N 3.05Å; A244-A246 VanDerWaalsContact C-N 3.3Å; A244-A246 PolarHBondContact O-N 2.61Å; A246-M248 PolarHBondContact O-N 3.08Å; A246-T249 WeakPolarHBondContact O-CB 3.48Å; A246-T249 PolarHBondContact O-N 3.21Å; A246-T250 WeakPolarHBondContact O-CG2 3.48Å; A246-T250 PolarHBondContact O-N 3.46Å; A246-T250 PolarHBondContact O-OG1 3.47Å
247L96.8Very high95.1Very high33 Ų3335.5 Ų35.517%0.17321%0.205CC..Hα-helixtrans-61.8-41.4177.8-65.2173.5000111.9V243 A244 T249 T250 D251 F258 F259 F273V243-L247 HydrophobicContact CG1-CD1 3.87Å; V243-L247 HydrophobicContact CG1-CG 4.11Å; V243-L247 VanDerWaalsContact O-CG 3.28Å; V243-L247 WeakPolarHBondContact O-CG 3.47Å; V243-L247 PolarHBondContact O-N 3.18Å; A244-L247 PolarHBondContact O-N 2.76Å; L247-T249 VanDerWaalsContact C-N 3.34Å; L247-T250 PolarHBondContact O-N 3.18Å; L247-T250 PolarHBondContact O-OG1 3.44Å; L247-D251 PolarHBondContact O-N 3.02Å; L247-F258 HydrophobicContact CB-CD2 3.97Å; L247-F258 HydrophobicContact CB-CE2 4.48Å; L247-F258 HydrophobicContact CB-CG 4.26Å; L247-F258 HydrophobicContact CD2-CD1 4.08Å; L247-F258 HydrophobicContact CD2-CD2 3.74Å; L247-F258 HydrophobicContact CD2-CE1 3.81Å; L247-F258 HydrophobicContact CD2-CE2 3.47Å; L247-F258 VanDerWaalsContact CD2-CE2 3.47Å; L247-F258 HydrophobicContact CD2-CG 4.06Å; L247-F258 HydrophobicContact CD2-CZ 3.51Å; L247-F258 HydrophobicContact CG-CD2 4.4Å; L247-F259 HydrophobicContact CB-CE2 3.8Å; L247-F259 HydrophobicContact CB-CZ 3.94Å; L247-F259 HydrophobicContact CD1-CZ 4.3Å; L247-F273 HydrophobicContact CD1-CD2 4.45Å; L247-F273 HydrophobicContact CD1-CE2 4.03Å
248M95.4Very high95.1Very high2 Ų239.6 Ų39.61%0.0122%0.223CC..Hα-helixtrans-70.2-34.5176.5-177.576.476.200111.3A170 A173 L186 A244 L245 A246 T250 D251 R252 F259 W270A170-M248 HydrophobicContact CB-CE 4.15Å; A173-M248 HydrophobicContact CB-CE 4.35Å; L186-M248 HydrophobicContact CD1-CB 4.19Å; L186-M248 HydrophobicContact CD1-CG 3.66Å; L186-M248 HydrophobicContact CD2-CB 3.94Å; L186-M248 HydrophobicContact CD2-CG 3.79Å; L186-M248 HydrophobicContact CG-CG 4.36Å; A244-M248 PolarHBondContact O-N 2.89Å; L245-M248 PolarHBondContact O-N 2.92Å; A246-M248 PolarHBondContact O-N 3.08Å; M248-T250 VanDerWaalsContact C-N 3.33Å; M248-D251 PolarHBondContact O-N 3.39Å; M248-R252 WeakPolarHBondContact O-CG 3.39Å; M248-R252 PolarHBondContact O-N 3.45Å; M248-R252 VanDerWaalsContact O-N 3.1Å; M248-F259 HydrophobicContact CB-CD2 4.24Å; M248-F259 HydrophobicContact CB-CE2 3.97Å; M248-F259 HydrophobicContact CE-CD2 3.83Å; M248-F259 HydrophobicContact CE-CE2 4.33Å; M248-F259 HydrophobicContact CE-CG 4.38Å; M248-F259 HydrophobicContact SD-CD2 3.94Å; M248-W270 HydrophobicContact CB-CE3 4Å; M248-W270 HydrophobicContact CB-CH2 4.13Å; M248-W270 HydrophobicContact CB-CZ3 3.44Å; M248-W270 VanDerWaalsContact CB-CZ3 3.44Å; M248-W270 HydrophobicContact CE-CB 4.41Å; M248-W270 HydrophobicContact CE-CD2 3.45Å; M248-W270 VanDerWaalsContact CE-CD2 3.45Å; M248-W270 HydrophobicContact CE-CE3 3.42Å; M248-W270 VanDerWaalsContact CE-CE3 3.42Å; M248-W270 HydrophobicContact CE-CG 3.89Å; M248-W270 HydrophobicContact CE-CH2 4.26Å; M248-W270 HydrophobicContact CE-CZ2 4.33Å; M248-W270 HydrophobicContact CE-CZ3 3.83Å; M248-W270 HydrophobicContact CG-CH2 4.44Å; M248-W270 HydrophobicContact CG-CZ3 4.1Å
249T95.4Very high95Very high13 Ų1339.6 Ų39.68%0.0822%0.223CC..Hα-helixtrans-63.9-41174.1-58.40000110.6I187 L245 A246 L247 R252 I253I187-T249 HydrophobicContact CD1-CG2 3.69Å; L245-T249 WeakPolarHBondContact O-CB 3.48Å; L245-T249 PolarHBondContact O-N 3.1Å; L245-T249 PolarHBondContact O-OG1 2.91Å; A246-T249 WeakPolarHBondContact O-CB 3.48Å; A246-T249 PolarHBondContact O-N 3.21Å; L247-T249 VanDerWaalsContact C-N 3.34Å; T249-R252 PolarHBondContact O-N 3.47Å; T249-I253 HydrophobicContact CG2-CD1 3.6Å; T249-I253 HydrophobicContact CG2-CG1 4.21Å; T249-I253 WeakPolarHBondContact O-CB 3.44Å; T249-I253 WeakPolarHBondContact O-CG1 3.43Å; T249-I253 PolarHBondContact O-N 3.42Å
250T95.1Very high94.8Very high39 Ų3938.1 Ų38.124%0.23921%0.213CC..Hα-helixtrans-69.5-34.4176.158.60000112.5A246 L247 M248 R252 F254 D255 T256A246-T250 WeakPolarHBondContact O-CG2 3.48Å; A246-T250 PolarHBondContact O-N 3.46Å; A246-T250 PolarHBondContact O-OG1 3.47Å; L247-T250 PolarHBondContact O-N 3.18Å; L247-T250 PolarHBondContact O-OG1 3.44Å; M248-T250 VanDerWaalsContact C-N 3.33Å; T250-R252 PolarHBondContact O-N 3.02Å; T250-F254 HydrophobicContact CG2-CD2 4.1Å; T250-F254 CarbonylContact O-C 3.41Å; T250-F254 WeakPolarHBondContact O-CA 3.38Å; T250-F254 PolarHBondContact O-N 3.15Å; T250-D255 PolarHBondContact O-N 3.43Å; T250-T256 WeakPolarHBondContact CB-OG1 3.31Å; T250-T256 PolarHBondContact O-N 3.46Å; T250-T256 PolarHBondContact O-OG1 2.96Å; T250-T256 PolarHBondContact OG1-OG1 2.9Å
251D94.2Very high94.4Very high12 Ų1240.2 Ų40.26%0.06422%0.224CC..Hα-helixtrans-62.1-34.6173.9-85.914.7000111.3L247 M248 T256 A257 F258 F259L247-D251 PolarHBondContact O-N 3.02Å; M248-D251 PolarHBondContact O-N 3.39Å; D251-T256 WeakPolarHBondContact CA-O 3.41Å; D251-T256 VanDerWaalsContact CA-OG1 3.28Å; D251-T256 WeakPolarHBondContact CA-OG1 3.32Å; D251-T256 VanDerWaalsContact CG-O 3.3Å; D251-T256 PolarHBondContact N-OG1 2.96Å; D251-T256 WeakPolarHBondContact OD1-CB 3.42Å; D251-T256 PolarHBondContact OD1-OG1 3.14Å; D251-A257 PolarHBondContact OD1-N 3.02Å; D251-A257 VanDerWaalsContact OD1-N 3.14Å; D251-F258 WeakPolarHBondContact OD1-CD2 3.42Å; D251-F258 PolarHBondContact OD1-N 3.43Å; D251-F258 PolarHBondContact OD2-N 3.24Å; D251-F259 WeakPolarHBondContact OD2-CD2 3.32Å; D251-F259 PolarHBondContact OD2-N 3.17Å
252R92.4Very high94Very high29 Ų2943.7 Ų43.711%0.10925%0.254CS..Hα-helixtrans-89-36.8-176.8-68.9-177.461.878.913115.1A173 G174 S177 G179 N183 M248 T249 T250A173-R252 PolarHBondContact O-NH1 3.32Å; G174-R252 PolarHBondContact O-NH1 3.29Å; S177-R252 VanDerWaalsContact O-CZ 3.25Å; S177-R252 PolarHBondContact O-NH1 3.21Å; S177-R252 PolarHBondContact O-NH2 2.79Å; G179-R252 PolarHBondContact O-NH2 3.46Å; G179-R252 VanDerWaalsContact O-NH2 3.08Å; N183-R252 PolarHBondContact OD1-NE 2.99Å; N183-R252 PolarHBondContact OD1-NH2 2.83Å; M248-R252 WeakPolarHBondContact O-CG 3.39Å; M248-R252 PolarHBondContact O-N 3.45Å; M248-R252 VanDerWaalsContact O-N 3.1Å; T249-R252 PolarHBondContact O-N 3.47Å; T250-R252 PolarHBondContact O-N 3.02Å
253I91.3Very high93.6Very high24 Ų2449.6 Ų49.612%0.12328%0.279CS..Hα-helixtrans-100.3-29.4-172.8-57.9-176.4000112.1T249 L603 E606T249-I253 HydrophobicContact CG2-CD1 3.6Å; T249-I253 HydrophobicContact CG2-CG1 4.21Å; T249-I253 WeakPolarHBondContact O-CB 3.44Å; T249-I253 WeakPolarHBondContact O-CG1 3.43Å; T249-I253 PolarHBondContact O-N 3.42Å; I253-L603 HydrophobicContact CD1-CD1 3.67Å; I253-L603 HydrophobicContact CD1-CG 3.71Å; I253-L603 HydrophobicContact CG2-CD1 4.23Å; I253-E606 HydrophobicContact CG1-CG 4.22Å; I253-E606 HydrophobicContact CG2-CG 4.49Å
254F92.2Very high93.3Very high117 Ų11749 Ų4951%0.51329%0.29SS..SBendtrans-12214.2-173.9-58.5-70.5000112.8T250 T256 V608T250-F254 HydrophobicContact CG2-CD2 4.1Å; T250-F254 CarbonylContact O-C 3.41Å; T250-F254 WeakPolarHBondContact O-CA 3.38Å; T250-F254 PolarHBondContact O-N 3.15Å; F254-T256 VanDerWaalsContact C-N 3.25Å; F254-T256 PolarHBondContact O-N 3.47Å; F254-V608 HydrophobicContact CE1-CG2 4.3Å; F254-V608 HydrophobicContact CZ-CG2 4.49Å
255D90.7Very high93.1Very high147 Ų14749.7 Ų49.779%0.78630%0.297SS*.  trans52.737177.2-59.6-45000114.3T250T250-D255 PolarHBondContact O-N 3.43Å
256T94.5Very high93Very high45 Ų4555.3 Ų55.328%0.27632%0.324SS..  trans-71.9168.1166.2660000110.8T250 D251 F254 F258T250-T256 WeakPolarHBondContact CB-OG1 3.31Å; T250-T256 PolarHBondContact O-N 3.46Å; T250-T256 PolarHBondContact O-OG1 2.96Å; T250-T256 PolarHBondContact OG1-OG1 2.9Å; D251-T256 WeakPolarHBondContact CA-O 3.41Å; D251-T256 VanDerWaalsContact CA-OG1 3.28Å; D251-T256 WeakPolarHBondContact CA-OG1 3.32Å; D251-T256 VanDerWaalsContact CG-O 3.3Å; D251-T256 PolarHBondContact N-OG1 2.96Å; D251-T256 WeakPolarHBondContact OD1-CB 3.42Å; D251-T256 PolarHBondContact OD1-OG1 3.14Å; F254-T256 VanDerWaalsContact C-N 3.25Å; F254-T256 PolarHBondContact O-N 3.47Å; T256-F258 HydrophobicContact CG2-CE2 4.3Å; T256-F258 WeakPolarHBondContact OG1-CD2 3.39Å; T256-F258 WeakPolarHBondContact OG1-CE2 3.39Å
257A93.7Very high92.8Very high39 Ų3954.8 Ų54.832%0.32232%0.317SS..  trans-131.345.9-173.400000113.1D251 H263 G265D251-A257 PolarHBondContact OD1-N 3.02Å; D251-A257 VanDerWaalsContact OD1-N 3.14Å; A257-H263 HydrophobicContact CB-CB 3.56Å; A257-G265 WeakPolarHBondContact O-CA 3.12Å
258F95.2Very high92.6Very high87 Ų8758.9 Ų58.938%0.38234%0.337SS..SBendtrans-68.1-43.1176.7-67.1-72.5000111.9L247 D251 T256 G265 M266L247-F258 HydrophobicContact CB-CD2 3.97Å; L247-F258 HydrophobicContact CB-CE2 4.48Å; L247-F258 HydrophobicContact CB-CG 4.26Å; L247-F258 HydrophobicContact CD2-CD1 4.08Å; L247-F258 HydrophobicContact CD2-CD2 3.74Å; L247-F258 HydrophobicContact CD2-CE1 3.81Å; L247-F258 HydrophobicContact CD2-CE2 3.47Å; L247-F258 VanDerWaalsContact CD2-CE2 3.47Å; L247-F258 HydrophobicContact CD2-CG 4.06Å; L247-F258 HydrophobicContact CD2-CZ 3.51Å; L247-F258 HydrophobicContact CG-CD2 4.4Å; D251-F258 WeakPolarHBondContact OD1-CD2 3.42Å; D251-F258 PolarHBondContact OD1-N 3.43Å; D251-F258 PolarHBondContact OD2-N 3.24Å; T256-F258 HydrophobicContact CG2-CE2 4.3Å; T256-F258 WeakPolarHBondContact OG1-CD2 3.39Å; T256-F258 WeakPolarHBondContact OG1-CE2 3.39Å; F258-G265 WeakPolarHBondContact O-CA 3.41Å; F258-M266 PolarHBondContact O-N 3.13Å
259F94.7Very high92.6Very high4 Ų461 Ų612%0.01835%0.349CS..SBendtrans-116.7-13.7-174.2-47.4-61.6000113.9A170 L247 M248 D251 V261 P267 L269 W270 F273A170-F259 HydrophobicContact CB-CB 3.81Å; L247-F259 HydrophobicContact CB-CE2 3.8Å; L247-F259 HydrophobicContact CB-CZ 3.94Å; L247-F259 HydrophobicContact CD1-CZ 4.3Å; M248-F259 HydrophobicContact CB-CD2 4.24Å; M248-F259 HydrophobicContact CB-CE2 3.97Å; M248-F259 HydrophobicContact CE-CD2 3.83Å; M248-F259 HydrophobicContact CE-CE2 4.33Å; M248-F259 HydrophobicContact CE-CG 4.38Å; M248-F259 HydrophobicContact SD-CD2 3.94Å; D251-F259 WeakPolarHBondContact OD2-CD2 3.32Å; D251-F259 PolarHBondContact OD2-N 3.17Å; F259-V261 PolarHBondContact O-N 3.33Å; F259-P267 WeakPolarHBondContact O-CG 3.33Å; F259-L269 HydrophobicContact CD1-CB 4.26Å; F259-L269 HydrophobicContact CE1-CB 4.13Å; F259-L269 HydrophobicContact CE1-CD2 4.28Å; F259-L269 HydrophobicContact CE1-CG 4.19Å; F259-W270 HydrophobicContact CD1-CB 3.75Å; F259-W270 HydrophobicContact CD2-CE3 4.37Å; F259-W270 HydrophobicContact CE1-CB 3.85Å; F259-W270 AromaticContact CE2-CE3 3.8Å; F259-W270 HydrophobicContact CE2-CE3 3.8Å; F259-W270 HydrophobicContact CE2-CZ3 4.45Å; F259-W270 HydrophobicContact CG-CB 4.17Å; F259-W270 HydrophobicContact CZ-CB 4.34Å; F259-W270 AromaticContact CZ-CE3 3.91Å; F259-W270 HydrophobicContact CZ-CE3 3.91Å; F259-F273 HydrophobicContact CE1-CD2 4.46Å; F259-F273 HydrophobicContact CZ-CD2 4.48Å
260T91.2Very high92.6Very high23 Ų2360.4 Ų60.414%0.14135%0.345CS..  trans-67.2117.4179.6-56.20000111.6E175 A262 G265E175-T260 HydrophobicContact CG-CG2 3.9Å; E175-T260 VanDerWaalsContact OE1-C 3.28Å; E175-T260 VanDerWaalsContact OE1-CA 3.31Å; E175-T260 WeakPolarHBondContact OE1-CA 3.45Å; E175-T260 WeakPolarHBondContact OE1-CG2 3.27Å; T260-A262 HydrophobicContact CG2-CB 4.27Å; T260-A262 PolarHBondContact O-N 2.93Å; T260-G265 WeakPolarHBondContact O-CA 3.44Å; T260-G265 PolarHBondContact O-N 3.21Å
261V88.8Confident92.6Very high82 Ų8258.7 Ų58.750%0.49734%0.335SS..G310 helixtrans-67.1-39-177.4-179.40000110.8P171 E175 F259 H263 G264 P267P171-V261 HydrophobicContact CB-CG2 4.48Å; E175-V261 PolarHBondContact OE1-N 2.96Å; F259-V261 PolarHBondContact O-N 3.33Å; V261-H263 PolarHBondContact O-N 3.45Å; V261-G264 PolarHBondContact O-N 2.83Å; V261-G264 VanDerWaalsContact O-N 3.07Å; V261-P267 HydrophobicContact CG2-CG 3.24Å
262A87.4Confident92.7Very high75 Ų7560.5 Ų60.562%0.6234%0.344SS*.G310 helixtrans-57.9-24.9-175.500000113.6E175 T260E175-A262 PolarHBondContact OE1-N 3.33Å; T260-A262 HydrophobicContact CG2-CB 4.27Å; T260-A262 PolarHBondContact O-N 2.93Å
263H88.7Confident92.8Very high151 Ų15162.1 Ų62.170%0.69935%0.352SS*.G310 helixtrans-116.119.3-178-63.5-55.1000113.4A257 V261A257-H263 HydrophobicContact CB-CB 3.56Å; V261-H263 PolarHBondContact O-N 3.45Å
264G90.4Very high93Very high69 Ų6961 Ų6171%0.71135%0.346SS*.THydrogen-bonded Turntrans84.57.8175.200000115.4V261V261-G264 PolarHBondContact O-N 2.83Å; V261-G264 VanDerWaalsContact O-N 3.07Å
265G92.8Very high93.3Very high14 Ų1456.2 Ų56.214%0.14433%0.325CS..  trans-65.5163171.500000112.6A257 F258 T260 P267A257-G265 WeakPolarHBondContact O-CA 3.12Å; F258-G265 WeakPolarHBondContact O-CA 3.41Å; T260-G265 WeakPolarHBondContact O-CA 3.44Å; T260-G265 PolarHBondContact O-N 3.21Å; G265-P267 WeakPolarHBondContact O-CD 3.32Å
266M94.2Very high93.6Very high118 Ų11851 Ų5158%0.58130%0.298SS*.  trans-113.4101.3-176.2-69.6-173.8-6900110.9F258 M268 L269F258-M266 PolarHBondContact O-N 3.13Å; M266-M268 PolarHBondContact O-N 3.46Å; M266-M268 VanDerWaalsContact O-N 3.17Å; M266-L269 HydrophobicContact CB-CB 4.05Å; M266-L269 HydrophobicContact CE-CD2 4.34Å; M266-L269 WeakPolarHBondContact O-CB 3.29Å; M266-L269 PolarHBondContact O-N 3.28Å
267P92.7Very high93.8Very high27 Ų2749 Ų4918%0.17529%0.286CS..Hα-helixtrans-57.5-35.1179.7-25.532.1000113.6A170 F259 V261 G265 L269 W270A170-P267 HydrophobicContact CB-CB 3.89Å; F259-P267 WeakPolarHBondContact O-CG 3.33Å; V261-P267 HydrophobicContact CG2-CG 3.24Å; G265-P267 WeakPolarHBondContact O-CD 3.32Å; P267-L269 PolarHBondContact O-N 2.91Å; P267-W270 WeakPolarHBondContact O-CB 3.29Å; P267-W270 PolarHBondContact O-N 3.1Å
268M93.9Very high93.9Very high119 Ų11947.1 Ų47.159%0.58627%0.27SS*.Hα-helixtrans-65.9-21.6179.6-56.8-166.7-7300112.9M266 W270 A271 N272 M333M266-M268 PolarHBondContact O-N 3.46Å; M266-M268 VanDerWaalsContact O-N 3.17Å; M268-W270 VanDerWaalsContact C-N 3.3Å; M268-W270 PolarHBondContact O-N 2.69Å; M268-A271 WeakPolarHBondContact O-CB 3.28Å; M268-A271 PolarHBondContact O-N 3.3Å; M268-N272 PolarHBondContact O-N 3.4Å; M268-N272 VanDerWaalsContact O-N 3.09Å; M268-M333 HydrophobicContact CB-CE 3.54Å; M268-M333 HydrophobicContact CG-CE 3.29Å; M268-M333 HydrophobicContact SD-CE 3.62Å
269L94.4Very high94Very high48 Ų4843.6 Ų43.625%0.25126%0.255SS..Hα-helixtrans-64.7-37.5176.5-173.163.7000111.3F259 M266 P267 N272 F273F259-L269 HydrophobicContact CD1-CB 4.26Å; F259-L269 HydrophobicContact CE1-CB 4.13Å; F259-L269 HydrophobicContact CE1-CD2 4.28Å; F259-L269 HydrophobicContact CE1-CG 4.19Å; M266-L269 HydrophobicContact CB-CB 4.05Å; M266-L269 HydrophobicContact CE-CD2 4.34Å; M266-L269 WeakPolarHBondContact O-CB 3.29Å; M266-L269 PolarHBondContact O-N 3.28Å; P267-L269 PolarHBondContact O-N 2.91Å; L269-N272 PolarHBondContact O-N 3.25Å; L269-F273 HydrophobicContact CD1-CD1 4.45Å; L269-F273 HydrophobicContact CD1-CE1 3.9Å; L269-F273 HydrophobicContact CD1-CE2 3.97Å; L269-F273 HydrophobicContact CD1-CZ 3.64Å; L269-F273 HydrophobicContact CD2-CE2 3.85Å; L269-F273 HydrophobicContact CD2-CZ 4.09Å; L269-F273 HydrophobicContact CG-CD2 4.08Å; L269-F273 HydrophobicContact CG-CE1 4.45Å; L269-F273 HydrophobicContact CG-CE2 3.63Å; L269-F273 HydrophobicContact CG-CZ 3.85Å; L269-F273 PolarHBondContact O-N 2.79Å
270W95.5Very high94.1Very high0 Ų043.4 Ų43.40%025%0.254CS..Hα-helixtrans-59.2-47.9173171.3-93.5000111.1T167 N168 Y169 A170 L186 A244 L245 M248 F259 P267 M268 N272 F273 F274T167-W270 PolarHBondContact O-NE1 2.68Å; N168-W270 HydrophobicContact CB-CZ2 4.44Å; N168-W270 PolarHBondContact O-NE1 2.94Å; Y169-W270 AromaticContact CD1-CD1 3.93Å; A170-W270 HydrophobicContact CB-CB 4.24Å; L186-W270 HydrophobicContact CD2-CH2 4.06Å; A244-W270 HydrophobicContact CB-CE3 4.29Å; A244-W270 HydrophobicContact CB-CZ3 4Å; A244-W270 VanDerWaalsContact O-CZ3 3.29Å; A244-W270 WeakPolarHBondContact O-CZ3 3.48Å; L245-W270 HydrophobicContact CD2-CH2 4.07Å; M248-W270 HydrophobicContact CB-CE3 4Å; M248-W270 HydrophobicContact CB-CH2 4.13Å; M248-W270 HydrophobicContact CB-CZ3 3.44Å; M248-W270 VanDerWaalsContact CB-CZ3 3.44Å; M248-W270 HydrophobicContact CE-CB 4.41Å; M248-W270 HydrophobicContact CE-CD2 3.45Å; M248-W270 VanDerWaalsContact CE-CD2 3.45Å; M248-W270 HydrophobicContact CE-CE3 3.42Å; M248-W270 VanDerWaalsContact CE-CE3 3.42Å; M248-W270 HydrophobicContact CE-CG 3.89Å; M248-W270 HydrophobicContact CE-CH2 4.26Å; M248-W270 HydrophobicContact CE-CZ2 4.33Å; M248-W270 HydrophobicContact CE-CZ3 3.83Å; M248-W270 HydrophobicContact CG-CH2 4.44Å; M248-W270 HydrophobicContact CG-CZ3 4.1Å; F259-W270 HydrophobicContact CD1-CB 3.75Å; F259-W270 HydrophobicContact CD2-CE3 4.37Å; F259-W270 HydrophobicContact CE1-CB 3.85Å; F259-W270 AromaticContact CE2-CE3 3.8Å; F259-W270 HydrophobicContact CE2-CE3 3.8Å; F259-W270 HydrophobicContact CE2-CZ3 4.45Å; F259-W270 HydrophobicContact CG-CB 4.17Å; F259-W270 HydrophobicContact CZ-CB 4.34Å; F259-W270 AromaticContact CZ-CE3 3.91Å; F259-W270 HydrophobicContact CZ-CE3 3.91Å; P267-W270 WeakPolarHBondContact O-CB 3.29Å; P267-W270 PolarHBondContact O-N 3.1Å; M268-W270 VanDerWaalsContact C-N 3.3Å; M268-W270 PolarHBondContact O-N 2.69Å; W270-N272 VanDerWaalsContact C-N 3.29Å; W270-N272 PolarHBondContact O-N 3.39Å; W270-F273 PolarHBondContact O-N 3.4Å; W270-F274 HydrophobicContact CZ2-CD2 4.28Å; W270-F274 WeakPolarHBondContact O-CB 3.31Å; W270-F274 PolarHBondContact O-N 3.23Å
271A95.4Very high94.3Very high3 Ų342.5 Ų42.53%0.02525%0.248CC..Hα-helixtrans-58.1-43.7179.400000111.4Y169 M268 W275 M333Y169-A271 HydrophobicContact CD1-CB 3.89Å; Y169-A271 HydrophobicContact CE1-CB 3.54Å; M268-A271 WeakPolarHBondContact O-CB 3.28Å; M268-A271 PolarHBondContact O-N 3.3Å; A271-W275 PolarHBondContact O-N 3.02Å; A271-W275 VanDerWaalsContact O-N 3.08Å; A271-M333 HydrophobicContact CB-CE 4.2Å; A271-M333 HydrophobicContact CB-SD 4.1Å
272N95.6Very high94.7Very high49 Ų4941 Ų4126%0.26224%0.239SC..Hα-helixtrans-63.1-53.6176.5-177.958.7000112.1M268 L269 W270 F274 W275 V276 W326 F330M268-N272 PolarHBondContact O-N 3.4Å; M268-N272 VanDerWaalsContact O-N 3.09Å; L269-N272 PolarHBondContact O-N 3.25Å; W270-N272 VanDerWaalsContact C-N 3.29Å; W270-N272 PolarHBondContact O-N 3.39Å; N272-F274 VanDerWaalsContact C-N 3.31Å; N272-F274 PolarHBondContact O-N 3.46Å; N272-W275 PolarHBondContact O-N 3.36Å; N272-V276 VanDerWaalsContact O-CG2 3.28Å; N272-V276 WeakPolarHBondContact O-CG2 3.14Å; N272-V276 PolarHBondContact O-N 3.38Å; N272-W326 PolarHBondContact OD1-NE1 3.5Å; N272-F330 HydrophobicContact CB-CZ 4.47Å
273F95.1Very high95.1Very high64 Ų6438.9 Ų38.928%0.28122%0.215SC..Hα-helixtrans-60.5-40.5-179.9-69.5-23.2000112.9A244 L247 F259 L269 W270 W275 V276 W277A244-F273 HydrophobicContact CB-CB 3.94Å; L247-F273 HydrophobicContact CD1-CD2 4.45Å; L247-F273 HydrophobicContact CD1-CE2 4.03Å; F259-F273 HydrophobicContact CE1-CD2 4.46Å; F259-F273 HydrophobicContact CZ-CD2 4.48Å; L269-F273 HydrophobicContact CD1-CD1 4.45Å; L269-F273 HydrophobicContact CD1-CE1 3.9Å; L269-F273 HydrophobicContact CD1-CE2 3.97Å; L269-F273 HydrophobicContact CD1-CZ 3.64Å; L269-F273 HydrophobicContact CD2-CE2 3.85Å; L269-F273 HydrophobicContact CD2-CZ 4.09Å; L269-F273 HydrophobicContact CG-CD2 4.08Å; L269-F273 HydrophobicContact CG-CE1 4.45Å; L269-F273 HydrophobicContact CG-CE2 3.63Å; L269-F273 HydrophobicContact CG-CZ 3.85Å; L269-F273 PolarHBondContact O-N 2.79Å; W270-F273 PolarHBondContact O-N 3.4Å; F273-W275 PolarHBondContact O-N 3.09Å; F273-V276 PolarHBondContact O-N 3.02Å; F273-W277 PolarHBondContact O-N 2.93Å
274F96.8Very high95.5Very high0 Ų031.7 Ų31.70%018%0.182CC..Hα-helixtrans-59.5-47.2176.7-178.7-90.9000111W166 T167 Y185 L241 W270 N272 W277 G278W166-F274 HydrophobicContact CD2-CZ 4.42Å; W166-F274 AromaticContact CE3-CZ 3.83Å; W166-F274 HydrophobicContact CE3-CZ 3.83Å; W166-F274 HydrophobicContact CH2-CE1 4.02Å; W166-F274 AromaticContact CH2-CZ 3.93Å; W166-F274 HydrophobicContact CH2-CZ 3.93Å; W166-F274 HydrophobicContact CZ2-CE1 4.41Å; W166-F274 HydrophobicContact CZ2-CZ 4.49Å; W166-F274 HydrophobicContact CZ3-CE1 4.15Å; W166-F274 AromaticContact CZ3-CZ 3.57Å; W166-F274 HydrophobicContact CZ3-CZ 3.57Å; T167-F274 HydrophobicContact CG2-CE1 3.81Å; T167-F274 HydrophobicContact CG2-CZ 4.17Å; Y185-F274 WeakPolarHBondContact OH-CE2 3.42Å; L241-F274 HydrophobicContact CD1-CD2 4.47Å; W270-F274 HydrophobicContact CZ2-CD2 4.28Å; W270-F274 WeakPolarHBondContact O-CB 3.31Å; W270-F274 PolarHBondContact O-N 3.23Å; N272-F274 VanDerWaalsContact C-N 3.31Å; N272-F274 PolarHBondContact O-N 3.46Å; F274-W277 HydrophobicContact CD2-CE3 4.28Å; F274-W277 HydrophobicContact CD2-CZ3 4.21Å; F274-W277 HydrophobicContact CE1-CZ3 4.31Å; F274-W277 HydrophobicContact CE2-CE3 4.06Å; F274-W277 AromaticContact CE2-CZ3 3.54Å; F274-W277 HydrophobicContact CE2-CZ3 3.54Å; F274-W277 HydrophobicContact CZ-CE3 4.28Å; F274-W277 AromaticContact CZ-CZ3 3.62Å; F274-W277 HydrophobicContact CZ-CZ3 3.62Å; F274-W277 PolarHBondContact O-N 3.41Å; F274-G278 WeakPolarHBondContact O-CA 3.28Å; F274-G278 PolarHBondContact O-N 3.24Å
275W97.8Very high95.7Very high17 Ų1728.4 Ų28.46%0.06415%0.148CC..Hα-helixtrans-78.1-25.6-176.8-74.2120000114.7W166 T167 Y169 A271 N272 F273 W277 G278 H279 W326 H329 F330W166-W275 HydrophobicContact CH2-CH2 4.23Å; W166-W275 HydrophobicContact CH2-CZ3 4.23Å; W166-W275 AromaticContact CZ2-CH2 3.75Å; W166-W275 HydrophobicContact CZ2-CH2 3.75Å; W166-W275 HydrophobicContact CZ2-CZ3 4.19Å; T167-W275 HydrophobicContact CG2-CH2 4.36Å; T167-W275 HydrophobicContact CG2-CZ2 3.87Å; Y169-W275 AromaticContact CZ-NE1 3.78Å; Y169-W275 PolarHBondContact OH-NE1 3.34Å; A271-W275 PolarHBondContact O-N 3.02Å; A271-W275 VanDerWaalsContact O-N 3.08Å; N272-W275 PolarHBondContact O-N 3.36Å; F273-W275 PolarHBondContact O-N 3.09Å; W275-W277 PolarHBondContact O-N 2.83Å; W275-G278 PolarHBondContact O-N 3.22Å; W275-H279 PolarHBondContact O-N 3.47Å; W275-H279 VanDerWaalsContact O-N 3.12Å; W275-W326 HydrophobicContact CB-CB 4.25Å; W275-W326 VanDerWaalsContact O-CB 3.24Å; W275-W326 WeakPolarHBondContact O-CB 3.31Å; W275-H329 HydrophobicContact CD2-CB 3.51Å; W275-H329 AromaticContact CD2-CD2 3.53Å; W275-H329 AromaticContact CD2-CG 3.48Å; W275-H329 VanDerWaalsContact CD2-CG 3.48Å; W275-H329 VanDerWaalsContact CE2-CB 3.42Å; W275-H329 AromaticContact CE2-CG 3.66Å; W275-H329 HydrophobicContact CE3-CB 4.06Å; W275-H329 AromaticContact CE3-CD2 3.2Å; W275-H329 AromaticContact CE3-CE1 3.81Å; W275-H329 AromaticContact CE3-CG 3.47Å; W275-H329 VanDerWaalsContact CE3-CG 3.47Å; W275-H329 AromaticContact CE3-ND1 3.85Å; W275-H329 AromaticContact CE3-NE2 3.42Å; W275-H329 HydrophobicContact CG-CB 3.76Å; W275-H329 HydrophobicContact CH2-CB 4.36Å; W275-H329 AromaticContact CH2-CE1 3.66Å; W275-H329 AromaticContact CH2-CG 3.8Å; W275-H329 AromaticContact CH2-ND1 3.41Å; W275-H329 WeakPolarHBondContact CH2-ND1 3.38Å; W275-H329 HydrophobicContact CZ2-CB 3.88Å; W275-H329 AromaticContact CZ2-CG 3.83Å; W275-H329 AromaticContact CZ2-ND1 3.75Å; W275-H329 HydrophobicContact CZ3-CB 4.46Å; W275-H329 AromaticContact CZ3-CD2 3.61Å; W275-H329 AromaticContact CZ3-CE1 3.33Å; W275-H329 WeakPolarHBondContact CZ3-CE1 3.47Å; W275-H329 AromaticContact CZ3-CG 3.65Å; W275-H329 AromaticContact CZ3-ND1 3.49Å; W275-H329 WeakPolarHBondContact CZ3-ND1 3.33Å; W275-H329 AromaticContact CZ3-NE2 3.4Å; W275-H329 WeakPolarHBondContact CZ3-NE2 3.14Å; W275-F330 HydrophobicContact CB-CD1 4.39Å; W275-F330 HydrophobicContact CB-CE1 3.9Å; W275-F330 AromaticContact CD1-CD1 3.63Å; W275-F330 AromaticContact CD1-CE1 3.93Å; W275-F330 HydrophobicContact CG-CD1 4.23Å; W275-F330 HydrophobicContact CG-CE1 4.22Å
276V96.9Very high95.9Very high37 Ų3728.5 Ų28.522%0.22415%0.145CC..Hα-helixtrans-54.2-35.1167.31690000110.7P240 N272 F273 P280 W326P240-V276 HydrophobicContact CB-CG1 4.01Å; P240-V276 HydrophobicContact CG-CG1 3.98Å; N272-V276 VanDerWaalsContact O-CG2 3.28Å; N272-V276 WeakPolarHBondContact O-CG2 3.14Å; N272-V276 PolarHBondContact O-N 3.38Å; F273-V276 PolarHBondContact O-N 3.02Å; V276-P280 VanDerWaalsContact O-CD 3.29Å; V276-P280 WeakPolarHBondContact O-CD 3.45Å; V276-P280 VanDerWaalsContact O-CG 3.23Å; V276-P280 WeakPolarHBondContact O-CG 3.25Å; V276-W326 HydrophobicContact CG2-CD2 4.05Å; V276-W326 HydrophobicContact CG2-CG 4.07Å; V276-W326 HydrophobicContact CG2-CZ2 4.23Å
277W97.5Very high96.1Very high3 Ų322.9 Ų22.91%0.01112%0.118CC..Hα-helixtrans-85.6-47.8167.9161.575.5000112.7I108 W166 A237 F238 L241 F273 F274 W275 H279 P280 E281I108-W277 HydrophobicContact CD1-CH2 3.9Å; I108-W277 HydrophobicContact CD1-CZ2 3.87Å; W166-W277 HydrophobicContact CZ3-CH2 4.22Å; W166-W277 HydrophobicContact CZ3-CZ3 4.15Å; A237-W277 WeakPolarHBondContact O-CB 3.4Å; A237-W277 VanDerWaalsContact O-CD1 3.27Å; F238-W277 AromaticContact CE2-NE1 3.68Å; F238-W277 AromaticContact CZ-NE1 3.66Å; L241-W277 HydrophobicContact CB-CB 3.89Å; L241-W277 HydrophobicContact CB-CD2 3.9Å; L241-W277 HydrophobicContact CB-CE3 4.48Å; L241-W277 HydrophobicContact CB-CG 3.59Å; L241-W277 HydrophobicContact CD1-CD2 3.93Å; L241-W277 HydrophobicContact CD1-CE3 3.67Å; L241-W277 HydrophobicContact CD1-CG 4.44Å; L241-W277 HydrophobicContact CD1-CZ3 4.04Å; L241-W277 HydrophobicContact CD2-CD2 3.79Å; L241-W277 HydrophobicContact CD2-CE3 4.22Å; L241-W277 HydrophobicContact CD2-CG 4.27Å; L241-W277 HydrophobicContact CD2-CH2 4.18Å; L241-W277 HydrophobicContact CD2-CZ2 3.76Å; L241-W277 HydrophobicContact CD2-CZ3 4.4Å; L241-W277 HydrophobicContact CG-CD2 4.06Å; L241-W277 HydrophobicContact CG-CE3 4.32Å; L241-W277 HydrophobicContact CG-CG 4.29Å; F273-W277 PolarHBondContact O-N 2.93Å; F274-W277 HydrophobicContact CD2-CE3 4.28Å; F274-W277 HydrophobicContact CD2-CZ3 4.21Å; F274-W277 HydrophobicContact CE1-CZ3 4.31Å; F274-W277 HydrophobicContact CE2-CE3 4.06Å; F274-W277 AromaticContact CE2-CZ3 3.54Å; F274-W277 HydrophobicContact CE2-CZ3 3.54Å; F274-W277 HydrophobicContact CZ-CE3 4.28Å; F274-W277 AromaticContact CZ-CZ3 3.62Å; F274-W277 HydrophobicContact CZ-CZ3 3.62Å; F274-W277 PolarHBondContact O-N 3.41Å; W275-W277 PolarHBondContact O-N 2.83Å; W277-H279 VanDerWaalsContact C-N 3.28Å; W277-H279 PolarHBondContact O-N 2.84Å; W277-P280 VanDerWaalsContact O-CD 3.22Å; W277-P280 WeakPolarHBondContact O-CD 3.2Å; W277-E281 HydrophobicContact CD2-CB 4.27Å; W277-E281 HydrophobicContact CH2-CG 4.13Å; W277-E281 HydrophobicContact CZ2-CB 3.84Å; W277-E281 HydrophobicContact CZ2-CG 3.44Å; W277-E281 VanDerWaalsContact CZ2-CG 3.44Å; W277-E281 PolarHBondContact NE1-OE2 3.41Å; W277-E281 WeakPolarHBondContact O-CB 3.36Å; W277-E281 PolarHBondContact O-N 3.21Å
278G96.4Very high96.3Very high0 Ų021.6 Ų21.60%011%0.109CC..Hα-helixtrans-66-27.7-161.700000113.9F274 W275 V282F274-G278 WeakPolarHBondContact O-CA 3.28Å; F274-G278 PolarHBondContact O-N 3.24Å; W275-G278 PolarHBondContact O-N 3.22Å; G278-V282 PolarHBondContact O-N 2.8Å
279H97.3Very high96.5Very high12 Ų1216 Ų166%0.0568%0.082CC..Hα-helixtrans-82.9-44.1173.5-165.468.5000113.7W275 W277 E281 V282 Y283 V325 W326 H328 H329W275-H279 PolarHBondContact O-N 3.47Å; W275-H279 VanDerWaalsContact O-N 3.12Å; W277-H279 VanDerWaalsContact C-N 3.28Å; W277-H279 PolarHBondContact O-N 2.84Å; H279-E281 PolarHBondContact O-N 2.89Å; H279-V282 WeakPolarHBondContact O-CG2 3.49Å; H279-V282 PolarHBondContact O-N 2.87Å; H279-V282 VanDerWaalsContact O-N 3.15Å; H279-Y283 AromaticContact CD2-CE2 3.49Å; H279-Y283 VanDerWaalsContact CD2-CE2 3.49Å; H279-Y283 WeakPolarHBondContact CD2-CE2 3.48Å; H279-Y283 AromaticContact CE1-CE2 3.88Å; H279-Y283 AromaticContact NE2-CE2 3.13Å; H279-Y283 WeakPolarHBondContact NE2-CE2 3.2Å; H279-Y283 AromaticContact NE2-CZ 3.52Å; H279-Y283 PolarHBondContact NE2-OH 3.33Å; H279-Y283 VanDerWaalsContact NE2-OH 3.12Å; H279-Y283 WeakPolarHBondContact O-CD2 3.31Å; H279-V325 WeakPolarHBondContact CD2-CG2 3.28Å; H279-V325 VanDerWaalsContact NE2-CG2 3.27Å; H279-V325 WeakPolarHBondContact NE2-CG2 3.46Å; H279-W326 HydrophobicContact CB-CB 4.28Å; H279-H328 AromaticContact CD2-NE2 3.81Å; H279-H328 AromaticContact CE1-CE1 3.15Å; H279-H328 PolarHBondContact CE1-CE1 3.35Å; H279-H328 AromaticContact CE1-NE2 3.23Å; H279-H328 PolarHBondContact CE1-NE2 3.38Å; H279-H328 AromaticContact CG-NE2 3.4Å; H279-H328 AromaticContact ND1-CE1 3.48Å; H279-H328 PolarHBondContact ND1-CE1 3.38Å; H279-H328 AromaticContact ND1-NE2 3.05Å; H279-H328 PolarHBondContact ND1-NE2 3.05Å; H279-H328 AromaticContact NE2-CE1 3.58Å; H279-H328 AromaticContact NE2-NE2 3.64Å; H279-H329 AromaticContact CG-NE2 3.63Å; H279-H329 AromaticContact ND1-NE2 3.18Å; H279-H329 PolarHBondContact ND1-NE2 3.35Å; H279-H329 VanDerWaalsContact ND1-NE2 3.18Å
280P97.4Very high96.6Very high1 Ų113.9 Ų13.91%0.0067%0.07CC..Hα-helixtrans-51.1-37.5163.9-33.238.9000114.1I233 A237 V276 W277 V282 Y283 I284 F323I233-P280 HydrophobicContact CG2-CB 3.64Å; A237-P280 HydrophobicContact CB-CB 3.58Å; A237-P280 HydrophobicContact CB-CG 4.31Å; V276-P280 VanDerWaalsContact O-CD 3.29Å; V276-P280 WeakPolarHBondContact O-CD 3.45Å; V276-P280 VanDerWaalsContact O-CG 3.23Å; V276-P280 WeakPolarHBondContact O-CG 3.25Å; W277-P280 VanDerWaalsContact O-CD 3.22Å; W277-P280 WeakPolarHBondContact O-CD 3.2Å; P280-V282 VanDerWaalsContact C-N 3.35Å; P280-V282 PolarHBondContact O-N 3.43Å; P280-Y283 WeakPolarHBondContact O-CA 3.17Å; P280-Y283 WeakPolarHBondContact O-CB 3.45Å; P280-Y283 PolarHBondContact O-N 2.84Å; P280-I284 PolarHBondContact O-N 2.85Å; P280-F323 HydrophobicContact CB-CE1 4.16Å; P280-F323 HydrophobicContact CB-CZ 4.31Å; P280-F323 HydrophobicContact CG-CD1 3.96Å; P280-F323 HydrophobicContact CG-CE1 3.9Å; P280-F323 HydrophobicContact CG-CZ 4.44Å
281E95.8Very high96.7Very high3 Ų313.9 Ų13.91%0.0147%0.07CC..Hα-helixtrans-59.4-39.9176.4-176.969.5178.600113.2I107 M112 F238 W277 H279 Y283 I284 V285I107-E281 HydrophobicContact CG2-CG 4.43Å; M112-E281 VanDerWaalsContact CE-OE1 3.27Å; M112-E281 WeakPolarHBondContact CE-OE1 3.32Å; M112-E281 WeakPolarHBondContact CG-OE1 3.25Å; M112-E281 VanDerWaalsContact SD-OE1 3.34Å; F238-E281 WeakPolarHBondContact CE2-OE2 3.14Å; F238-E281 WeakPolarHBondContact CZ-OE2 3.31Å; W277-E281 HydrophobicContact CD2-CB 4.27Å; W277-E281 HydrophobicContact CH2-CG 4.13Å; W277-E281 HydrophobicContact CZ2-CB 3.84Å; W277-E281 HydrophobicContact CZ2-CG 3.44Å; W277-E281 VanDerWaalsContact CZ2-CG 3.44Å; W277-E281 PolarHBondContact NE1-OE2 3.41Å; W277-E281 WeakPolarHBondContact O-CB 3.36Å; W277-E281 PolarHBondContact O-N 3.21Å; H279-E281 PolarHBondContact O-N 2.89Å; E281-Y283 PolarHBondContact O-N 3.37Å; E281-I284 WeakPolarHBondContact O-CA 3.34Å; E281-I284 WeakPolarHBondContact O-CB 3.47Å; E281-I284 PolarHBondContact O-N 3.23Å; E281-I284 VanDerWaalsContact OE2-CD1 3.32Å; E281-I284 WeakPolarHBondContact OE2-CD1 3.26Å; E281-V285 PolarHBondContact O-N 2.81Å
282V95.8Very high96.9Very high52 Ų5213.7 Ų13.732%0.3157%0.069SC..Hα-helixtrans-63.7-26.6176.2-58.20000111.7G278 H279 P280 V285 I286G278-V282 PolarHBondContact O-N 2.8Å; H279-V282 WeakPolarHBondContact O-CG2 3.49Å; H279-V282 PolarHBondContact O-N 2.87Å; H279-V282 VanDerWaalsContact O-N 3.15Å; P280-V282 VanDerWaalsContact C-N 3.35Å; P280-V282 PolarHBondContact O-N 3.43Å; V282-V285 WeakPolarHBondContact O-CG2 3.08Å; V282-I286 WeakPolarHBondContact O-CB 3.37Å; V282-I286 WeakPolarHBondContact O-CG2 3.24Å; V282-I286 PolarHBondContact O-N 3.13Å
283Y96.9Very high97Very high29 Ų2911.4 Ų11.411%0.1146%0.057CC..Hα-helixtrans-77.3-30.2171.4-65.5-64.1000113.3H279 P280 E281 V285 I286 L287 I318 I350H279-Y283 AromaticContact CD2-CE2 3.49Å; H279-Y283 VanDerWaalsContact CD2-CE2 3.49Å; H279-Y283 WeakPolarHBondContact CD2-CE2 3.48Å; H279-Y283 AromaticContact CE1-CE2 3.88Å; H279-Y283 AromaticContact NE2-CE2 3.13Å; H279-Y283 WeakPolarHBondContact NE2-CE2 3.2Å; H279-Y283 AromaticContact NE2-CZ 3.52Å; H279-Y283 PolarHBondContact NE2-OH 3.33Å; H279-Y283 VanDerWaalsContact NE2-OH 3.12Å; H279-Y283 WeakPolarHBondContact O-CD2 3.31Å; P280-Y283 WeakPolarHBondContact O-CA 3.17Å; P280-Y283 WeakPolarHBondContact O-CB 3.45Å; P280-Y283 PolarHBondContact O-N 2.84Å; E281-Y283 PolarHBondContact O-N 3.37Å; Y283-V285 PolarHBondContact O-N 3.46Å; Y283-I286 HydrophobicContact CD1-CG2 3.8Å; Y283-I286 PolarHBondContact O-N 3.42Å; Y283-L287 VanDerWaalsContact O-CB 3.31Å; Y283-L287 WeakPolarHBondContact O-CB 3.23Å; Y283-L287 VanDerWaalsContact O-CG 3.29Å; Y283-L287 WeakPolarHBondContact O-CG 3.48Å; Y283-L287 PolarHBondContact O-N 2.9Å; Y283-I318 HydrophobicContact CD1-CG2 3.36Å; Y283-I318 HydrophobicContact CE1-CG2 3.65Å; Y283-I318 HydrophobicContact CG-CG2 3.89Å; Y283-I350 HydrophobicContact CE1-CG2 4.2Å; Y283-I350 HydrophobicContact CE2-CD1 4.09Å; Y283-I350 VanDerWaalsContact OH-CD1 3.27Å; Y283-I350 WeakPolarHBondContact OH-CD1 3.38Å; Y283-I350 WeakPolarHBondContact OH-CG2 3.38Å
284I96.6Very high97.1Very high0 Ų08.3 Ų8.30%04%0.043CC..Hα-helixtrans-61.5-36.4175.5-68.4168.7000111.4M112 T230 I233 V234 F238 P280 E281 P288M112-I284 HydrophobicContact CE-CG2 3.86Å; M112-I284 HydrophobicContact SD-CG2 3.51Å; M112-I284 VanDerWaalsContact SD-CG2 3.51Å; T230-I284 HydrophobicContact CG2-CB 3.97Å; T230-I284 HydrophobicContact CG2-CG1 4.05Å; T230-I284 HydrophobicContact CG2-CG2 3.71Å; T230-I284 WeakPolarHBondContact CG2-O 3.27Å; I233-I284 HydrophobicContact CB-CD1 4.27Å; I233-I284 HydrophobicContact CB-CG1 3.9Å; I233-I284 HydrophobicContact CG2-CD1 3.82Å; I233-I284 HydrophobicContact CG2-CG1 3.65Å; V234-I284 HydrophobicContact CB-CD1 4.3Å; V234-I284 HydrophobicContact CG2-CD1 3.67Å; V234-I284 HydrophobicContact CG2-CG1 3.96Å; V234-I284 HydrophobicContact CG2-CG2 3.74Å; F238-I284 HydrophobicContact CD2-CD1 4.28Å; F238-I284 HydrophobicContact CE2-CD1 3.87Å; P280-I284 PolarHBondContact O-N 2.85Å; E281-I284 WeakPolarHBondContact O-CA 3.34Å; E281-I284 WeakPolarHBondContact O-CB 3.47Å; E281-I284 PolarHBondContact O-N 3.23Å; E281-I284 VanDerWaalsContact OE2-CD1 3.32Å; E281-I284 WeakPolarHBondContact OE2-CD1 3.26Å; I284-P288 WeakPolarHBondContact O-CD 3.42Å; I284-P288 WeakPolarHBondContact O-CG 3.1Å
285V95.8Very high97.1Very high1 Ų18.4 Ų8.41%0.0064%0.044CC..Hα-helixtrans-82.3-36.2176.4-64.30000113.2A111 M112 E281 V282 Y283 L419 V423A111-V285 HydrophobicContact CB-CG1 4.02Å; M112-V285 HydrophobicContact CG-CG1 4.03Å; M112-V285 HydrophobicContact SD-CG1 3.89Å; E281-V285 PolarHBondContact O-N 2.81Å; V282-V285 WeakPolarHBondContact O-CG2 3.08Å; Y283-V285 PolarHBondContact O-N 3.46Å; V285-L419 HydrophobicContact CG2-CD1 3.75Å; V285-V423 HydrophobicContact CB-CG1 4.27Å; V285-V423 HydrophobicContact CB-CG2 4.07Å; V285-V423 HydrophobicContact CG2-CG2 4.02Å
286I96.7Very high97.1Very high16 Ų167.6 Ų7.68%0.0824%0.041CC..Hα-helixtrans-82.8-34.2-174.7-160.665.4000114V282 Y283 A289 F290 F386 G422 V423V282-I286 WeakPolarHBondContact O-CB 3.37Å; V282-I286 WeakPolarHBondContact O-CG2 3.24Å; V282-I286 PolarHBondContact O-N 3.13Å; Y283-I286 HydrophobicContact CD1-CG2 3.8Å; Y283-I286 PolarHBondContact O-N 3.42Å; I286-A289 WeakPolarHBondContact O-CB 3Å; I286-A289 PolarHBondContact O-N 3.48Å; I286-F290 HydrophobicContact CD1-CD1 4.4Å; I286-F290 HydrophobicContact CD1-CE1 3.9Å; I286-F290 HydrophobicContact CD1-CZ 4.16Å; I286-F290 HydrophobicContact CG1-CD1 4.19Å; I286-F290 HydrophobicContact CG1-CD2 4.19Å; I286-F290 HydrophobicContact CG1-CE1 3.67Å; I286-F290 HydrophobicContact CG1-CE2 3.74Å; I286-F290 HydrophobicContact CG1-CG 4.46Å; I286-F290 HydrophobicContact CG1-CZ 3.47Å; I286-F290 VanDerWaalsContact CG1-CZ 3.47Å; I286-F290 HydrophobicContact CG2-CE2 4.21Å; I286-F290 WeakPolarHBondContact O-CD2 3.33Å; I286-F290 VanDerWaalsContact O-CG 3.31Å; I286-F290 WeakPolarHBondContact O-CG 3.2Å; I286-F290 PolarHBondContact O-N 2.61Å; I286-F386 HydrophobicContact CD1-CE2 3.84Å; I286-F386 HydrophobicContact CG1-CE2 4.26Å; I286-F386 HydrophobicContact CG1-CZ 4.47Å; I286-G422 VanDerWaalsContact CD1-CA 3.43Å; I286-V423 HydrophobicContact CB-CG2 4.38Å; I286-V423 HydrophobicContact CD1-CG2 3.73Å
287L97.3Very high97.2Very high0 Ų05.9 Ų5.90%03%0.03CC..Hα-helixtrans-64.7-46.1-175.6-72.1-175.4000111.8T226 I229 T230 I233 Y283 A289 F290 G291 T315 I318T226-L287 VanDerWaalsContact CB-O 3.23Å; T226-L287 WeakPolarHBondContact CB-O 3.33Å; T226-L287 WeakPolarHBondContact CG2-O 3.44Å; I229-L287 HydrophobicContact CG2-CD1 4.23Å; T230-L287 WeakPolarHBondContact OG1-CB 3.02Å; I233-L287 HydrophobicContact CD1-CD1 3.66Å; Y283-L287 VanDerWaalsContact O-CB 3.31Å; Y283-L287 WeakPolarHBondContact O-CB 3.23Å; Y283-L287 VanDerWaalsContact O-CG 3.29Å; Y283-L287 WeakPolarHBondContact O-CG 3.48Å; Y283-L287 PolarHBondContact O-N 2.9Å; L287-A289 VanDerWaalsContact C-N 3.32Å; L287-A289 PolarHBondContact O-N 3.28Å; L287-F290 HydrophobicContact CD2-CD2 4.12Å; L287-F290 WeakPolarHBondContact O-CB 3.46Å; L287-F290 PolarHBondContact O-N 3.41Å; L287-G291 PolarHBondContact O-N 3.06Å; L287-T315 HydrophobicContact CD1-CG2 4.18Å; L287-T315 HydrophobicContact CD2-CG2 4.05Å; L287-I318 HydrophobicContact CD1-CG2 4.44Å; L287-I318 HydrophobicContact CD2-CB 4.32Å; L287-I318 HydrophobicContact CD2-CD1 4.06Å; L287-I318 HydrophobicContact CD2-CG2 3.96Å; L287-I318 HydrophobicContact CG-CG2 4.5Å
288P97.2Very high97.1Very high0 Ų05.7 Ų5.70%03%0.03CC..Hα-helixtrans-64.3-37.1173.5-25.439.6000112.4I115 W119 F223 T230 I284 F290 G291 I292I115-P288 HydrophobicContact CD1-CB 4.24Å; I115-P288 HydrophobicContact CG2-CB 3.5Å; I115-P288 HydrophobicContact CG2-CG 3.72Å; W119-P288 HydrophobicContact CZ2-CB 4.43Å; W119-P288 HydrophobicContact CZ2-CG 3.63Å; F223-P288 HydrophobicContact CE2-CB 4.3Å; T230-P288 HydrophobicContact CG2-CG 3.94Å; T230-P288 WeakPolarHBondContact OG1-CD 3.35Å; T230-P288 WeakPolarHBondContact OG1-CG 3.25Å; I284-P288 WeakPolarHBondContact O-CD 3.42Å; I284-P288 WeakPolarHBondContact O-CG 3.1Å; P288-F290 VanDerWaalsContact C-N 3.33Å; P288-F290 PolarHBondContact O-N 3Å; P288-G291 CarbonylContact O-C 3.43Å; P288-G291 WeakPolarHBondContact O-CA 3.34Å; P288-G291 PolarHBondContact O-N 3.12Å; P288-I292 WeakPolarHBondContact O-CG1 3.46Å; P288-I292 PolarHBondContact O-N 3.33Å
289A97.7Very high97.2Very high0 Ų05.8 Ų5.80%03%0.03CC..Hα-helixtrans-60.4-42175.500000112.1I286 L287 G291 I292 Y293 G422 V423 A426I286-A289 WeakPolarHBondContact O-CB 3Å; I286-A289 PolarHBondContact O-N 3.48Å; L287-A289 VanDerWaalsContact C-N 3.32Å; L287-A289 PolarHBondContact O-N 3.28Å; A289-G291 VanDerWaalsContact C-N 3.25Å; A289-G291 PolarHBondContact O-N 3.47Å; A289-I292 WeakPolarHBondContact O-CB 3.23Å; A289-I292 PolarHBondContact O-N 3.02Å; A289-I292 VanDerWaalsContact O-N 3.13Å; A289-Y293 WeakPolarHBondContact O-CD2 3.38Å; A289-Y293 PolarHBondContact O-N 2.94Å; A289-Y293 VanDerWaalsContact O-N 3.12Å; A289-G422 VanDerWaalsContact CB-O 3.26Å; A289-G422 WeakPolarHBondContact CB-O 3.4Å; A289-V423 HydrophobicContact CB-CG2 4.33Å; A289-A426 HydrophobicContact CB-CB 3.57Å
290F97.9Very high97.2Very high4 Ų45.2 Ų5.22%0.0183%0.027CC..Hα-helixtrans-61.7-34.2169-66-27.9000112.9I286 L287 P288 S294 T354 K357 W361 F382 F386I286-F290 HydrophobicContact CD1-CD1 4.4Å; I286-F290 HydrophobicContact CD1-CE1 3.9Å; I286-F290 HydrophobicContact CD1-CZ 4.16Å; I286-F290 HydrophobicContact CG1-CD1 4.19Å; I286-F290 HydrophobicContact CG1-CD2 4.19Å; I286-F290 HydrophobicContact CG1-CE1 3.67Å; I286-F290 HydrophobicContact CG1-CE2 3.74Å; I286-F290 HydrophobicContact CG1-CG 4.46Å; I286-F290 HydrophobicContact CG1-CZ 3.47Å; I286-F290 VanDerWaalsContact CG1-CZ 3.47Å; I286-F290 HydrophobicContact CG2-CE2 4.21Å; I286-F290 WeakPolarHBondContact O-CD2 3.33Å; I286-F290 VanDerWaalsContact O-CG 3.31Å; I286-F290 WeakPolarHBondContact O-CG 3.2Å; I286-F290 PolarHBondContact O-N 2.61Å; L287-F290 HydrophobicContact CD2-CD2 4.12Å; L287-F290 WeakPolarHBondContact O-CB 3.46Å; L287-F290 PolarHBondContact O-N 3.41Å; P288-F290 VanDerWaalsContact C-N 3.33Å; P288-F290 PolarHBondContact O-N 3Å; F290-S294 WeakPolarHBondContact O-CB 3.47Å; F290-S294 PolarHBondContact O-N 2.8Å; F290-S294 PolarHBondContact O-OG 2.91Å; F290-S294 VanDerWaalsContact O-OG 3.06Å; F290-T354 HydrophobicContact CZ-CG2 4.27Å; F290-K357 HydrophobicContact CD2-CD 4.39Å; F290-W361 HydrophobicContact CB-CH2 3.92Å; F290-W361 HydrophobicContact CB-CZ2 3.91Å; F290-W361 AromaticContact CD1-CH2 3.55Å; F290-W361 HydrophobicContact CD1-CH2 3.55Å; F290-W361 HydrophobicContact CD1-CZ2 4.3Å; F290-W361 HydrophobicContact CD1-CZ3 4.38Å; F290-W361 HydrophobicContact CE1-CH2 4.09Å; F290-W361 AromaticContact CG-CH2 3.77Å; F290-W361 HydrophobicContact CG-CH2 3.77Å; F290-W361 HydrophobicContact CG-CZ2 4.29Å; F290-F382 HydrophobicContact CD1-CE2 4.19Å; F290-F382 AromaticContact CD1-CZ 3.74Å; F290-F382 HydrophobicContact CD1-CZ 3.74Å; F290-F382 AromaticContact CE1-CE2 3.76Å; F290-F382 HydrophobicContact CE1-CE2 3.76Å; F290-F382 AromaticContact CE1-CZ 3.52Å; F290-F382 HydrophobicContact CE1-CZ 3.52Å; F290-F386 HydrophobicContact CE1-CE1 4.06Å; F290-F386 HydrophobicContact CE1-CE2 4.13Å; F290-F386 AromaticContact CE1-CZ 3.87Å; F290-F386 HydrophobicContact CE1-CZ 3.87Å; F290-F386 AromaticContact CZ-CE1 3.76Å; F290-F386 HydrophobicContact CZ-CE1 3.76Å; F290-F386 HydrophobicContact CZ-CE2 4.13Å; F290-F386 AromaticContact CZ-CZ 3.48Å; F290-F386 HydrophobicContact CZ-CZ 3.48Å; F290-F386 VanDerWaalsContact CZ-CZ 3.48Å
291G97.5Very high97.1Very high0 Ų05.1 Ų5.10%03%0.027CC..Hα-helixtrans-59.4-44.8170.800000112.4T226 L287 P288 A289 S294 E295T226-G291 VanDerWaalsContact OG1-CA 3.32Å; T226-G291 WeakPolarHBondContact OG1-CA 3.5Å; L287-G291 PolarHBondContact O-N 3.06Å; P288-G291 CarbonylContact O-C 3.43Å; P288-G291 WeakPolarHBondContact O-CA 3.34Å; P288-G291 PolarHBondContact O-N 3.12Å; A289-G291 VanDerWaalsContact C-N 3.25Å; A289-G291 PolarHBondContact O-N 3.47Å; G291-S294 CarbonylContact O-C 3.47Å; G291-S294 WeakPolarHBondContact O-CB 3.46Å; G291-S294 PolarHBondContact O-N 3.03Å; G291-S294 VanDerWaalsContact O-N 3.15Å; G291-E295 PolarHBondContact O-N 3.24Å
292I98.2Very high97.1Very high0 Ų011 Ų110%05%0.049CC..Hα-helixtrans-59.5-49.7177.5-60.2171.3000110.3I115 L118 F223 P288 A289 S294 E295 I296 A426 W434I115-I292 HydrophobicContact CD1-CD1 4.1Å; L118-I292 HydrophobicContact CD1-CD1 3.5Å; L118-I292 VanDerWaalsContact CD1-CD1 3.5Å; L118-I292 HydrophobicContact CD1-CG1 4.47Å; F223-I292 HydrophobicContact CD2-CG1 3.76Å; F223-I292 HydrophobicContact CE2-CD1 4.21Å; F223-I292 HydrophobicContact CE2-CG1 3.49Å; F223-I292 VanDerWaalsContact CE2-CG1 3.49Å; F223-I292 HydrophobicContact CZ-CG1 4.36Å; P288-I292 WeakPolarHBondContact O-CG1 3.46Å; P288-I292 PolarHBondContact O-N 3.33Å; A289-I292 WeakPolarHBondContact O-CB 3.23Å; A289-I292 PolarHBondContact O-N 3.02Å; A289-I292 VanDerWaalsContact O-N 3.13Å; I292-S294 VanDerWaalsContact C-N 3.26Å; I292-S294 PolarHBondContact O-N 3.22Å; I292-E295 PolarHBondContact O-N 2.83Å; I292-I296 HydrophobicContact CG2-CD1 3.6Å; I292-I296 HydrophobicContact CG2-CG1 4.32Å; I292-I296 WeakPolarHBondContact O-CG1 3.37Å; I292-I296 PolarHBondContact O-N 3.33Å; I292-A426 HydrophobicContact CB-CB 4.42Å; I292-A426 HydrophobicContact CD1-CB 4.24Å; I292-W434 HydrophobicContact CB-CH2 4.18Å; I292-W434 HydrophobicContact CB-CZ3 4.29Å; I292-W434 HydrophobicContact CD1-CZ3 4.33Å; I292-W434 HydrophobicContact CG1-CH2 3.92Å; I292-W434 HydrophobicContact CG1-CZ3 3.84Å; I292-W434 HydrophobicContact CG2-CH2 3.9Å; I292-W434 HydrophobicContact CG2-CZ3 3.75Å
293Y98.2Very high97Very high0 Ų011.4 Ų11.40%05%0.046CC..Hα-helixtrans-59.7-37.6175.9-66.1-47.8000112.6A289 E295 I296 I297 S379 F382 T421 G422 F425 A426A289-Y293 WeakPolarHBondContact O-CD2 3.38Å; A289-Y293 PolarHBondContact O-N 2.94Å; A289-Y293 VanDerWaalsContact O-N 3.12Å; Y293-E295 PolarHBondContact O-N 2.69Å; Y293-I296 PolarHBondContact O-N 3.13Å; Y293-I297 VanDerWaalsContact O-CB 3.26Å; Y293-I297 WeakPolarHBondContact O-CB 3.22Å; Y293-I297 VanDerWaalsContact O-CG1 3.26Å; Y293-I297 WeakPolarHBondContact O-CG1 3.45Å; Y293-I297 PolarHBondContact O-N 3.17Å; Y293-S379 WeakPolarHBondContact CD1-OG 3.41Å; Y293-F382 HydrophobicContact CD1-CD1 4.32Å; Y293-F382 AromaticContact CD2-CD1 3.52Å; Y293-F382 HydrophobicContact CD2-CD1 3.52Å; Y293-F382 HydrophobicContact CD2-CD2 4.03Å; Y293-F382 AromaticContact CD2-CE1 3.57Å; Y293-F382 HydrophobicContact CD2-CE1 3.57Å; Y293-F382 HydrophobicContact CD2-CE2 4.06Å; Y293-F382 AromaticContact CD2-CG 3.76Å; Y293-F382 HydrophobicContact CD2-CG 3.76Å; Y293-F382 AromaticContact CD2-CZ 3.85Å; Y293-F382 HydrophobicContact CD2-CZ 3.85Å; Y293-F382 HydrophobicContact CE1-CB 3.91Å; Y293-F382 HydrophobicContact CE1-CD1 4.38Å; Y293-F382 HydrophobicContact CE1-CG 4.15Å; Y293-F382 HydrophobicContact CE2-CB 3.85Å; Y293-F382 AromaticContact CE2-CD1 3.58Å; Y293-F382 HydrophobicContact CE2-CD1 3.58Å; Y293-F382 AromaticContact CE2-CD2 3.33Å; Y293-F382 HydrophobicContact CE2-CD2 3.33Å; Y293-F382 AromaticContact CE2-CE1 3.92Å; Y293-F382 HydrophobicContact CE2-CE1 3.92Å; Y293-F382 AromaticContact CE2-CE2 3.67Å; Y293-F382 HydrophobicContact CE2-CE2 3.67Å; Y293-F382 AromaticContact CE2-CG 3.27Å; Y293-F382 HydrophobicContact CE2-CG 3.27Å; Y293-F382 AromaticContact CE2-CZ 3.97Å; Y293-F382 HydrophobicContact CE2-CZ 3.97Å; Y293-F382 AromaticContact CG-CD1 3.91Å; Y293-F382 HydrophobicContact CG-CD1 3.91Å; Y293-F382 HydrophobicContact CG-CE1 4.17Å; Y293-F382 HydrophobicContact CG-CG 4.37Å; Y293-F382 VanDerWaalsContact CZ-CB 3.47Å; Y293-F382 AromaticContact CZ-CD2 3.83Å; Y293-F382 AromaticContact CZ-CG 3.49Å; Y293-F382 VanDerWaalsContact CZ-CG 3.49Å; Y293-F382 WeakPolarHBondContact OH-CB 3.36Å; Y293-T421 PolarHBondContact OH-O 3.29Å; Y293-G422 WeakPolarHBondContact CE2-O 3.28Å; Y293-F425 WeakPolarHBondContact OH-CB 3.4Å; Y293-A426 HydrophobicContact CD2-CB 4.35Å; Y293-A426 HydrophobicContact CE1-CB 4.03Å; Y293-A426 HydrophobicContact CE2-CB 3.72Å; Y293-A426 PolarHBondContact OH-N 3.02Å
294S97.6Very high96.9Very high0 Ų015 Ų150%06%0.06CC..Hα-helixtrans-69-10175.7-68.60000114.7F290 G291 I292 P298 W361F290-S294 WeakPolarHBondContact O-CB 3.47Å; F290-S294 PolarHBondContact O-N 2.8Å; F290-S294 PolarHBondContact O-OG 2.91Å; F290-S294 VanDerWaalsContact O-OG 3.06Å; G291-S294 CarbonylContact O-C 3.47Å; G291-S294 WeakPolarHBondContact O-CB 3.46Å; G291-S294 PolarHBondContact O-N 3.03Å; G291-S294 VanDerWaalsContact O-N 3.15Å; I292-S294 VanDerWaalsContact C-N 3.26Å; I292-S294 PolarHBondContact O-N 3.22Å; S294-P298 WeakPolarHBondContact O-CD 3.5Å; S294-P298 WeakPolarHBondContact O-CG 3.47Å; S294-W361 PolarHBondContact OG-NE1 2.88Å
295E97Very high96.9Very high1 Ų115.2 Ų15.21%0.0056%0.061CC..Hα-helixtrans-97.5-40.7169.6-61.8-56.7139.200111.3M222 F223 G291 I292 Y293 T299 F433 W434 T534M222-E295 PolarHBondContact N-OE1 3.02Å; F223-E295 HydrophobicContact CB-CG 3.63Å; F223-E295 PolarHBondContact N-OE1 2.86Å; G291-E295 PolarHBondContact O-N 3.24Å; I292-E295 PolarHBondContact O-N 2.83Å; Y293-E295 PolarHBondContact O-N 2.69Å; E295-T299 VanDerWaalsContact O-CB 3.3Å; E295-T299 WeakPolarHBondContact O-CB 3.4Å; E295-T299 PolarHBondContact O-N 2.86Å; E295-T299 PolarHBondContact O-OG1 3.37Å; E295-F433 HydrophobicContact CB-CE1 4.46Å; E295-W434 HydrophobicContact CB-CZ2 4.39Å; E295-T534 VanDerWaalsContact OE2-CG2 3.23Å; E295-T534 WeakPolarHBondContact OE2-CG2 3.31Å
296I97.9Very high96.9Very high0 Ų019.6 Ų19.60%08%0.08CC..Hα-helixtrans-68.6-48.6-178.1-65.3172.9000111.5I292 Y293 T299 F300 P375 M376 S379 A429 F433I292-I296 HydrophobicContact CG2-CD1 3.6Å; I292-I296 HydrophobicContact CG2-CG1 4.32Å; I292-I296 WeakPolarHBondContact O-CG1 3.37Å; I292-I296 PolarHBondContact O-N 3.33Å; Y293-I296 PolarHBondContact O-N 3.13Å; I296-T299 PolarHBondContact O-N 2.82Å; I296-F300 HydrophobicContact CG2-CD2 3.65Å; I296-F300 HydrophobicContact CG2-CE2 3.89Å; I296-F300 WeakPolarHBondContact O-CD2 3.36Å; I296-F300 PolarHBondContact O-N 2.82Å; I296-P375 HydrophobicContact CD1-CB 3.96Å; I296-P375 HydrophobicContact CG1-CB 4.42Å; I296-P375 HydrophobicContact CG2-CB 3.94Å; I296-M376 HydrophobicContact CG2-SD 4.43Å; I296-S379 VanDerWaalsContact CG2-OG 3.23Å; I296-S379 WeakPolarHBondContact CG2-OG 3.43Å; I296-A429 HydrophobicContact CD1-CB 3.62Å; I296-F433 HydrophobicContact CD1-CB 4.25Å; I296-F433 HydrophobicContact CD1-CG 4.42Å; I296-F433 HydrophobicContact CG1-CB 4.29Å; I296-F433 HydrophobicContact CG1-CD1 3.89Å; I296-F433 HydrophobicContact CG1-CD2 4.31Å; I296-F433 HydrophobicContact CG1-CE1 4.26Å; I296-F433 HydrophobicContact CG1-CG 3.92Å
297I98Very high96.8Very high1 Ų120.1 Ų20.11%0.0059%0.089CC..Hα-helixtrans-57.9-53.8-176.7-70.3170.3000112Y293 T299 A301 W361 T364 L365 M376Y293-I297 VanDerWaalsContact O-CB 3.26Å; Y293-I297 WeakPolarHBondContact O-CB 3.22Å; Y293-I297 VanDerWaalsContact O-CG1 3.26Å; Y293-I297 WeakPolarHBondContact O-CG1 3.45Å; Y293-I297 PolarHBondContact O-N 3.17Å; I297-T299 VanDerWaalsContact C-N 3.32Å; I297-T299 PolarHBondContact O-N 3.13Å; I297-A301 WeakPolarHBondContact O-CB 3.46Å; I297-A301 PolarHBondContact O-N 2.93Å; I297-W361 HydrophobicContact CD1-CB 3.9Å; I297-W361 HydrophobicContact CD1-CD2 4.34Å; I297-W361 HydrophobicContact CD1-CG 3.66Å; I297-T364 HydrophobicContact CG2-CG2 3.94Å; I297-L365 HydrophobicContact CG2-CD2 3.84Å; I297-L365 HydrophobicContact CG2-CG 4.05Å; I297-M376 HydrophobicContact CG1-SD 4.5Å
298P96.8Very high96.7Very high0 Ų020.7 Ų20.70%09%0.092CC..Hα-helixtrans-67.1-30.7178.524.9-33.6000113.5S294 R302 K303 L305 T364S294-P298 WeakPolarHBondContact O-CD 3.5Å; S294-P298 WeakPolarHBondContact O-CG 3.47Å; P298-R302 WeakPolarHBondContact O-CA 3.34Å; P298-R302 PolarHBondContact O-N 2.93Å; P298-K303 VanDerWaalsContact CA-O 3.3Å; P298-K303 WeakPolarHBondContact CA-O 3.43Å; P298-K303 WeakPolarHBondContact CB-O 3.48Å; P298-K303 PolarHBondContact O-N 2.99Å; P298-K303 VanDerWaalsContact O-N 3.14Å; P298-L305 HydrophobicContact CB-CB 4.42Å; P298-L305 HydrophobicContact CG-CB 4.4Å; P298-L305 HydrophobicContact CG-CD1 4.3Å; P298-T364 HydrophobicContact CB-CG2 4.05Å
299T96.8Very high96.5Very high1 Ų126.6 Ų26.61%0.00612%0.119CC..Hα-helixtrans-61.6-56.4177-63.60000110.9E295 I296 I297 R302 F433 L531E295-T299 VanDerWaalsContact O-CB 3.3Å; E295-T299 WeakPolarHBondContact O-CB 3.4Å; E295-T299 PolarHBondContact O-N 2.86Å; E295-T299 PolarHBondContact O-OG1 3.37Å; I296-T299 PolarHBondContact O-N 2.82Å; I297-T299 VanDerWaalsContact C-N 3.32Å; I297-T299 PolarHBondContact O-N 3.13Å; T299-R302 PolarHBondContact O-N 3.05Å; T299-F433 HydrophobicContact CG2-CE2 3.98Å; T299-F433 HydrophobicContact CG2-CZ 4.08Å; T299-L531 HydrophobicContact CG2-CB 3.98Å
300F97.2Very high96.4Very high0 Ų029 Ų290%014%0.136CC..Hα-helixtrans-84-15.1-177.5-62.2-60.5000114.2I296 R302 R369 I370 T371 E373 P375 M376 F433 W528 L531I296-F300 HydrophobicContact CG2-CD2 3.65Å; I296-F300 HydrophobicContact CG2-CE2 3.89Å; I296-F300 WeakPolarHBondContact O-CD2 3.36Å; I296-F300 PolarHBondContact O-N 2.82Å; F300-R302 VanDerWaalsContact C-N 3.3Å; F300-R369 VanDerWaalsContact O-O 3.08Å; F300-I370 WeakPolarHBondContact O-CA 3.16Å; F300-T371 PolarHBondContact O-N 3.18Å; F300-T371 PolarHBondContact O-OG1 2.79Å; F300-E373 HydrophobicContact CD1-CB 4.36Å; F300-E373 VanDerWaalsContact CD1-CD 3.5Å; F300-E373 HydrophobicContact CD1-CG 4.12Å; F300-E373 WeakPolarHBondContact CD1-OE2 3.29Å; F300-E373 HydrophobicContact CE1-CB 3.97Å; F300-E373 HydrophobicContact CE1-CG 3.71Å; F300-E373 HydrophobicContact CE2-CB 4.46Å; F300-E373 HydrophobicContact CZ-CB 4.02Å; F300-E373 HydrophobicContact CZ-CG 4.22Å; F300-P375 HydrophobicContact CE2-CB 4.01Å; F300-P375 HydrophobicContact CE2-CG 4.24Å; F300-M376 HydrophobicContact CB-CB 3.98Å; F300-M376 HydrophobicContact CB-CG 3.87Å; F300-M376 HydrophobicContact CB-SD 3.97Å; F300-M376 HydrophobicContact CD2-CB 3.76Å; F300-M376 HydrophobicContact CD2-CG 4.46Å; F300-M376 HydrophobicContact CG-CB 4.06Å; F300-M376 HydrophobicContact CG-CG 4.49Å; F300-F433 AromaticContact CE2-CD2 3.8Å; F300-F433 HydrophobicContact CE2-CD2 3.8Å; F300-F433 AromaticContact CE2-CE2 3.83Å; F300-F433 HydrophobicContact CE2-CE2 3.83Å; F300-F433 AromaticContact CZ-CD2 3.93Å; F300-F433 HydrophobicContact CZ-CD2 3.93Å; F300-F433 AromaticContact CZ-CE2 3.9Å; F300-F433 HydrophobicContact CZ-CE2 3.9Å; F300-W528 HydrophobicContact CE1-CB 4.26Å; F300-W528 HydrophobicContact CE1-CD2 4.04Å; F300-W528 AromaticContact CE1-CE3 3.77Å; F300-W528 HydrophobicContact CE1-CE3 3.77Å; F300-W528 HydrophobicContact CE1-CG 4.26Å; F300-W528 HydrophobicContact CE1-CZ3 4.47Å; F300-W528 AromaticContact CZ-CD2 3.69Å; F300-W528 HydrophobicContact CZ-CD2 3.69Å; F300-W528 AromaticContact CZ-CE3 3.63Å; F300-W528 HydrophobicContact CZ-CE3 3.63Å; F300-W528 HydrophobicContact CZ-CG 4.1Å; F300-W528 HydrophobicContact CZ-CZ3 4.09Å; F300-L531 HydrophobicContact CD1-CD1 4.16Å
301A96.9Very high96.2Very high0 Ų028.8 Ų28.80%014%0.135CC..Hα-helixtrans-82-9.7166.100000113.2I297 K303 L365 G368 R369 I370I297-A301 WeakPolarHBondContact O-CB 3.46Å; I297-A301 PolarHBondContact O-N 2.93Å; A301-K303 PolarHBondContact O-N 3.3Å; A301-L365 HydrophobicContact CB-CD2 4.19Å; A301-G368 CarbonylContact O-C 3.51Å; A301-G368 VanDerWaalsContact O-CA 3.28Å; A301-G368 WeakPolarHBondContact O-CA 3.46Å; A301-R369 PolarHBondContact O-N 3.26Å; A301-I370 HydrophobicContact CB-CG1 4.48Å
302R94.7Very high96.2Very high126 Ų12629 Ų2948%0.47514%0.137SC..THydrogen-bonded Turntrans54.338.8-177.9-47.8-172.8-173.9-173-4112.9P298 T299 F300 T371 L531P298-R302 WeakPolarHBondContact O-CA 3.34Å; P298-R302 PolarHBondContact O-N 2.93Å; T299-R302 PolarHBondContact O-N 3.05Å; F300-R302 VanDerWaalsContact C-N 3.3Å; R302-T371 VanDerWaalsContact NH2-CG2 3.31Å; R302-L531 HydrophobicContact CG-CD2 3.91Å
303K94.8Very high96.1Very high60 Ų6037.5 Ų37.526%0.26117%0.169SC..SBendtrans-140.7146.2-175.2-169.4-176175.2-170.70110P298 A301 L363 T364 Y366P298-K303 VanDerWaalsContact CA-O 3.3Å; P298-K303 WeakPolarHBondContact CA-O 3.43Å; P298-K303 WeakPolarHBondContact CB-O 3.48Å; P298-K303 PolarHBondContact O-N 2.99Å; P298-K303 VanDerWaalsContact O-N 3.14Å; A301-K303 PolarHBondContact O-N 3.3Å; K303-L363 PolarHBondContact NZ-O 3.01Å; K303-T364 VanDerWaalsContact CD-O 3.3Å; K303-T364 WeakPolarHBondContact CD-O 3.3Å; K303-Y366 PolarHBondContact NZ-O 2.93Å
304R94.8Very high96Very high105 Ų10538 Ų3840%0.39617%0.173SC..  trans-55.7141170.3-173.1166.4-176.1153.34.7110.5F306 D557 Y558 D559R304-F306 PolarHBondContact O-N 2.98Å; R304-F306 VanDerWaalsContact O-N 3.1Å; R304-D557 IonicContact CZ-OD1 2.79Å; R304-D557 IonicContact CZ-OD2 3.7Å; R304-D557 VanDerWaalsContact CZ-OD2 3.28Å; R304-D557 IonicContact NH1-OD1 3.97Å; R304-D557 IonicContact NH1-OD2 3.16Å; R304-D557 PolarHBondContact NH1-OD2 3.01Å; R304-D557 IonicContact NH2-OD1 2.78Å; R304-D557 PolarHBondContact NH2-OD1 3.16Å; R304-D557 IonicContact NH2-OD2 3.86Å; R304-D557 PolarHBondContact NH2-OD2 3.39Å; R304-Y558 HydrophobicContact CG-CD1 4.17Å; R304-D559 WeakPolarHBondContact CB-OD2 3.45Å; R304-D559 VanDerWaalsContact CD-OD2 3.26Å; R304-D559 WeakPolarHBondContact CD-OD2 3.5Å; R304-D559 WeakPolarHBondContact CG-OD2 3.21Å; R304-D559 IonicContact NE-OD2 3.09Å
305L95.9Very high95.9Very high4 Ų438 Ų382%0.02117%0.173CC..  trans-58.2115.7174.9-171.868.6000110.3M222 P298 G307 M311 T364 Y558M222-L305 HydrophobicContact CB-CD2 4.09Å; M222-L305 HydrophobicContact CG-CD2 3.28Å; P298-L305 HydrophobicContact CB-CB 4.42Å; P298-L305 HydrophobicContact CG-CB 4.4Å; P298-L305 HydrophobicContact CG-CD1 4.3Å; L305-G307 PolarHBondContact O-N 3.37Å; L305-M311 HydrophobicContact CD1-CE 3.72Å; L305-M311 HydrophobicContact CD1-SD 4.23Å; L305-M311 HydrophobicContact CD2-CE 4.28Å; L305-M311 HydrophobicContact CD2-SD 3.71Å; L305-M311 HydrophobicContact CG-CE 4.09Å; L305-M311 HydrophobicContact CG-SD 4.14Å; L305-T364 HydrophobicContact CD1-CG2 4.33Å; L305-Y558 HydrophobicContact CB-CE1 4.08Å
306F96.6Very high95.9Very high94 Ų9439.7 Ų39.741%0.41219%0.187SC..THydrogen-bonded Turntrans-66.6132.7179.7-174-88.1000109.8R304 H308 N360 L363 T364R304-F306 PolarHBondContact O-N 2.98Å; R304-F306 VanDerWaalsContact O-N 3.1Å; F306-H308 PolarHBondContact O-N 2.74Å; F306-N360 WeakPolarHBondContact CD1-OD1 3.44Å; F306-N360 WeakPolarHBondContact O-CB 3.36Å; F306-L363 HydrophobicContact CB-CB 4.05Å; F306-L363 HydrophobicContact CD1-CB 3.59Å; F306-L363 HydrophobicContact CD1-CD1 3.69Å; F306-L363 HydrophobicContact CD1-CG 4.3Å; F306-L363 HydrophobicContact CD2-CB 4.21Å; F306-L363 HydrophobicContact CE1-CB 4.08Å; F306-L363 HydrophobicContact CE1-CD1 3.34Å; F306-L363 HydrophobicContact CE1-CG 4.34Å; F306-L363 HydrophobicContact CG-CB 3.67Å; F306-L363 HydrophobicContact CG-CD1 4.48Å; F306-L363 HydrophobicContact CZ-CD1 3.88Å; F306-T364 WeakPolarHBondContact CB-OG1 3.48Å; F306-T364 PolarHBondContact N-OG1 3.32Å
307G94.3Very high95.8Very high26 Ų2640.9 Ų40.927%0.26820%0.199SC..THydrogen-bonded Turntrans64.237.7177.800000114L305 Q309 S310 M311 N360L305-G307 PolarHBondContact O-N 3.37Å; G307-Q309 VanDerWaalsContact C-N 3.32Å; G307-Q309 PolarHBondContact O-N 3.27Å; G307-S310 WeakPolarHBondContact CA-OG 3.45Å; G307-S310 PolarHBondContact O-N 3.31Å; G307-S310 PolarHBondContact O-OG 3.35Å; G307-M311 PolarHBondContact O-N 2.89Å; G307-N360 PolarHBondContact O-ND2 3.03Å
308H94.1Very high95.7Very high13 Ų1340.9 Ų40.96%0.0620%0.199CC..Hα-helixtrans-47.7-51.9178175.5-79.6000112.4M218 M220 F306 S310 M311 V312 Y558M218-H308 PolarHBondContact O-CE1 3.47Å; M218-H308 PolarHBondContact O-ND1 3.31Å; M220-H308 PolarHBondContact O-NE2 3.45Å; F306-H308 PolarHBondContact O-N 2.74Å; H308-S310 PolarHBondContact O-N 3.45Å; H308-M311 WeakPolarHBondContact O-CB 3.47Å; H308-M311 PolarHBondContact O-N 2.76Å; H308-M311 VanDerWaalsContact O-N 3.13Å; H308-V312 WeakPolarHBondContact O-CG2 3.41Å; H308-V312 PolarHBondContact O-N 3.2Å; H308-Y558 AromaticContact CD2-CD2 3.36Å; H308-Y558 WeakPolarHBondContact CD2-CD2 3.41Å; H308-Y558 AromaticContact CD2-CE2 3.46Å; H308-Y558 VanDerWaalsContact CD2-CE2 3.46Å; H308-Y558 WeakPolarHBondContact CD2-CE2 3.41Å; H308-Y558 AromaticContact NE2-CD2 3.44Å; H308-Y558 WeakPolarHBondContact NE2-CD2 3.38Å; H308-Y558 AromaticContact NE2-CE2 3.73Å
309Q93.6Very high95.7Very high124 Ų12441.5 Ų41.558%0.57920%0.204SC*.Hα-helixtrans-62.4-38.7178.7-61.6-171.1-21.700113.2M218 G307 M311 V312 W313M218-Q309 HydrophobicContact CE-CB 3.85Å; M218-Q309 HydrophobicContact CE-CG 3.84Å; G307-Q309 VanDerWaalsContact C-N 3.32Å; G307-Q309 PolarHBondContact O-N 3.27Å; Q309-M311 VanDerWaalsContact C-N 3.31Å; Q309-M311 PolarHBondContact O-N 3.09Å; Q309-V312 PolarHBondContact O-N 2.87Å; Q309-W313 PolarHBondContact O-N 3.32Å; Q309-W313 VanDerWaalsContact O-N 3.11Å
310S94.7Very high95.6Very high49 Ų4948.4 Ų48.434%0.34324%0.235SC..Hα-helixtrans-68.6-32.4177.165.20000111.6G307 H308 A314 N360G307-S310 WeakPolarHBondContact CA-OG 3.45Å; G307-S310 PolarHBondContact O-N 3.31Å; G307-S310 PolarHBondContact O-OG 3.35Å; H308-S310 PolarHBondContact O-N 3.45Å; S310-A314 VanDerWaalsContact O-CB 3.25Å; S310-A314 WeakPolarHBondContact O-CB 3.4Å; S310-A314 PolarHBondContact O-N 3.36Å; S310-N360 PolarHBondContact OG-ND2 2.9Å
311M95.4Very high95.6Very high0 Ų049.6 Ų49.60%024%0.241CC..Hα-helixtrans-66.1-37.8170.6-70.1-156.8179.800113M222 L305 G307 H308 Q309 T315 N360 W361M222-M311 HydrophobicContact CE-CB 3.79Å; M222-M311 HydrophobicContact SD-CB 4.31Å; L305-M311 HydrophobicContact CD1-CE 3.72Å; L305-M311 HydrophobicContact CD1-SD 4.23Å; L305-M311 HydrophobicContact CD2-CE 4.28Å; L305-M311 HydrophobicContact CD2-SD 3.71Å; L305-M311 HydrophobicContact CG-CE 4.09Å; L305-M311 HydrophobicContact CG-SD 4.14Å; G307-M311 PolarHBondContact O-N 2.89Å; H308-M311 WeakPolarHBondContact O-CB 3.47Å; H308-M311 PolarHBondContact O-N 2.76Å; H308-M311 VanDerWaalsContact O-N 3.13Å; Q309-M311 VanDerWaalsContact C-N 3.31Å; Q309-M311 PolarHBondContact O-N 3.09Å; M311-T315 WeakPolarHBondContact O-CB 3.5Å; M311-T315 PolarHBondContact O-N 3.39Å; M311-T315 PolarHBondContact O-OG1 3.28Å; M311-N360 HydrophobicContact CE-CB 3.27Å; M311-N360 HydrophobicContact CG-CB 4.1Å; M311-N360 VanDerWaalsContact CG-ND2 3.31Å; M311-N360 WeakPolarHBondContact CG-ND2 3.44Å; M311-W361 HydrophobicContact CE-CD2 4.34Å; M311-W361 HydrophobicContact CE-CG 4.06Å
312V96.2Very high95.6Very high6 Ų649.6 Ų49.64%0.03624%0.241CC..Hα-helixtrans-60.6-51.6174.7177.20000110F217 M218 M222 V225 H308 Q309 A314 T315 A316F217-V312 HydrophobicContact CE1-CG1 4.32Å; M218-V312 HydrophobicContact CE-CB 4.15Å; M218-V312 HydrophobicContact CE-CG1 4.21Å; M218-V312 HydrophobicContact CE-CG2 4.43Å; M218-V312 HydrophobicContact SD-CB 4.38Å; M218-V312 HydrophobicContact SD-CG1 3.85Å; M222-V312 HydrophobicContact CE-CG2 4.18Å; M222-V312 HydrophobicContact SD-CG2 3.66Å; V225-V312 HydrophobicContact CG1-CB 4.36Å; V225-V312 HydrophobicContact CG1-CG1 3.89Å; V225-V312 HydrophobicContact CG1-CG2 3.98Å; V225-V312 HydrophobicContact CG2-CG2 4.43Å; H308-V312 WeakPolarHBondContact O-CG2 3.41Å; H308-V312 PolarHBondContact O-N 3.2Å; Q309-V312 PolarHBondContact O-N 2.87Å; V312-A314 PolarHBondContact O-N 3.47Å; V312-T315 PolarHBondContact O-N 3.12Å; V312-A316 PolarHBondContact O-N 3.44Å
313W96.4Very high95.6Very high178 Ų17846.3 Ų46.367%0.67423%0.23SC*.Hα-helixtrans-63.3-40.3178.3-72.8118.3000113.1Q309 T315 A316 G317Q309-W313 PolarHBondContact O-N 3.32Å; Q309-W313 VanDerWaalsContact O-N 3.11Å; W313-T315 VanDerWaalsContact C-N 3.32Å; W313-T315 PolarHBondContact O-N 2.98Å; W313-A316 PolarHBondContact O-N 3.19Å; W313-G317 PolarHBondContact O-N 2.99Å
314A96.4Very high95.7Very high10 Ų1046.3 Ų46.38%0.08323%0.232CC..Hα-helixtrans-60.5-42.7174.200000111.5S310 V312 G317 I318 P353 V356 K357S310-A314 VanDerWaalsContact O-CB 3.25Å; S310-A314 WeakPolarHBondContact O-CB 3.4Å; S310-A314 PolarHBondContact O-N 3.36Å; V312-A314 PolarHBondContact O-N 3.47Å; A314-G317 PolarHBondContact O-N 2.98Å; A314-I318 WeakPolarHBondContact O-CG1 3.36Å; A314-I318 PolarHBondContact O-N 2.67Å; A314-P353 HydrophobicContact CB-CB 4.06Å; A314-P353 WeakPolarHBondContact O-CB 3.4Å; A314-V356 HydrophobicContact CB-CG1 4.45Å; A314-K357 HydrophobicContact CB-CG 4.16Å
315T96.5Very high95.8Very high0 Ų041.3 Ų41.30%021%0.213CC..Hα-helixtrans-64.9-40.8177.6-55.60000111.3T226 I229 L287 M311 V312 W313 I318 A319T226-T315 HydrophobicContact CG2-CG2 3.95Å; I229-T315 HydrophobicContact CB-CG2 4.02Å; I229-T315 HydrophobicContact CD1-CG2 3.43Å; I229-T315 VanDerWaalsContact CD1-CG2 3.43Å; I229-T315 HydrophobicContact CG1-CG2 4.31Å; I229-T315 HydrophobicContact CG2-CG2 3.98Å; L287-T315 HydrophobicContact CD1-CG2 4.18Å; L287-T315 HydrophobicContact CD2-CG2 4.05Å; M311-T315 WeakPolarHBondContact O-CB 3.5Å; M311-T315 PolarHBondContact O-N 3.39Å; M311-T315 PolarHBondContact O-OG1 3.28Å; V312-T315 PolarHBondContact O-N 3.12Å; W313-T315 VanDerWaalsContact C-N 3.32Å; W313-T315 PolarHBondContact O-N 2.98Å; T315-I318 PolarHBondContact O-N 2.91Å; T315-A319 PolarHBondContact O-N 3Å; T315-A319 VanDerWaalsContact O-N 3.1Å
316A96.1Very high95.9Very high37 Ų3743.7 Ų43.731%0.30622%0.222SC..Hα-helixtrans-64.8-39.4174.700000112.1I229 V312 W313 A319 F320I229-A316 HydrophobicContact CD1-CB 4.31Å; V312-A316 PolarHBondContact O-N 3.44Å; W313-A316 PolarHBondContact O-N 3.19Å; A316-A319 PolarHBondContact O-N 3.21Å; A316-F320 PolarHBondContact O-N 2.91Å
317G96.2Very high95.9Very high25 Ų2539.5 Ų39.526%0.25821%0.205SC..Hα-helixtrans-61.2-42.7174.600000112.8W313 A314 F320 L321W313-G317 PolarHBondContact O-N 2.99Å; A314-G317 PolarHBondContact O-N 2.98Å; G317-F320 PolarHBondContact O-N 3.4Å; G317-L321 WeakPolarHBondContact O-CB 3.2Å; G317-L321 WeakPolarHBondContact O-CG 3.44Å; G317-L321 PolarHBondContact O-N 3.41Å
318I96.3Very high96.1Very high1 Ų139.6 Ų39.61%0.00520%0.198CC..Hα-helixtrans-61.1-45.8174.1-66.2167.6000110.5Y283 L287 A314 T315 F320 L321 S322 P353 K357Y283-I318 HydrophobicContact CD1-CG2 3.36Å; Y283-I318 HydrophobicContact CE1-CG2 3.65Å; Y283-I318 HydrophobicContact CG-CG2 3.89Å; L287-I318 HydrophobicContact CD1-CG2 4.44Å; L287-I318 HydrophobicContact CD2-CB 4.32Å; L287-I318 HydrophobicContact CD2-CD1 4.06Å; L287-I318 HydrophobicContact CD2-CG2 3.96Å; L287-I318 HydrophobicContact CG-CG2 4.5Å; A314-I318 WeakPolarHBondContact O-CG1 3.36Å; A314-I318 PolarHBondContact O-N 2.67Å; T315-I318 PolarHBondContact O-N 2.91Å; I318-F320 VanDerWaalsContact C-N 3.34Å; I318-F320 PolarHBondContact O-N 2.75Å; I318-L321 PolarHBondContact O-N 2.8Å; I318-S322 WeakPolarHBondContact O-CB 3.49Å; I318-S322 PolarHBondContact O-N 3.21Å; I318-P353 HydrophobicContact CD1-CB 4.06Å; I318-P353 HydrophobicContact CG1-CB 3.62Å; I318-P353 HydrophobicContact CG1-CG 4.33Å; I318-K357 HydrophobicContact CD1-CD 4.4Å
319A95.7Very high96.2Very high13 Ų1341.1 Ų41.111%0.10721%0.205CC..Hα-helixtrans-61.2-42.3179.900000112.4I229 I233 T315 A316 S322 F323I229-A319 HydrophobicContact CG2-CB 3.33Å; I233-A319 HydrophobicContact CD1-CB 3.83Å; I233-A319 HydrophobicContact CG1-CB 3.96Å; T315-A319 PolarHBondContact O-N 3Å; T315-A319 VanDerWaalsContact O-N 3.1Å; A316-A319 PolarHBondContact O-N 3.21Å; A319-S322 PolarHBondContact O-OG 3.14Å; A319-F323 WeakPolarHBondContact O-CD2 3.4Å
320F96Very high96.3Very high146 Ų14635.9 Ų35.964%0.6418%0.18SC*.Hα-helixtrans-63.6-50.1174.6177.1-101.5000112.1A316 G317 I318 S322 F323 L324A316-F320 PolarHBondContact O-N 2.91Å; G317-F320 PolarHBondContact O-N 3.4Å; I318-F320 VanDerWaalsContact C-N 3.34Å; I318-F320 PolarHBondContact O-N 2.75Å; F320-S322 VanDerWaalsContact C-N 3.26Å; F320-S322 PolarHBondContact O-N 3.04Å; F320-F323 PolarHBondContact O-N 3.31Å; F320-L324 HydrophobicContact CD1-CD1 4.28Å; F320-L324 HydrophobicContact CE1-CD1 3.66Å; F320-L324 HydrophobicContact CZ-CD1 3.96Å
321L96.2Very high96.3Very high25 Ų2533.5 Ų33.513%0.13116%0.164CC..Hα-helixtrans-66.8-25.5-178.6-70170000113G317 I318 F323 L324 V325 L349 I350 P353G317-L321 WeakPolarHBondContact O-CB 3.2Å; G317-L321 WeakPolarHBondContact O-CG 3.44Å; G317-L321 PolarHBondContact O-N 3.41Å; I318-L321 PolarHBondContact O-N 2.8Å; L321-F323 PolarHBondContact O-N 3.27Å; L321-F323 VanDerWaalsContact O-N 3.1Å; L321-L324 PolarHBondContact O-N 3.31Å; L321-V325 WeakPolarHBondContact O-CG2 3.31Å; L321-L349 HydrophobicContact CD1-CB 4.29Å; L321-I350 HydrophobicContact CB-CD1 3.86Å; L321-I350 HydrophobicContact CB-CG1 3.65Å; L321-I350 HydrophobicContact CD1-CG1 3.9Å; L321-I350 HydrophobicContact CG-CG1 4.38Å; L321-P353 HydrophobicContact CD1-CG 4.5Å
322S95.8Very high96.3Very high0 Ų035.9 Ų35.90%018%0.178CC..Hα-helixtrans-56.1-29.2179.972.30000113.6I318 A319 F320 L324I318-S322 WeakPolarHBondContact O-CB 3.49Å; I318-S322 PolarHBondContact O-N 3.21Å; A319-S322 PolarHBondContact O-OG 3.14Å; F320-S322 VanDerWaalsContact C-N 3.26Å; F320-S322 PolarHBondContact O-N 3.04Å; S322-L324 VanDerWaalsContact C-N 3.34Å
323F96Very high96.1Very high57 Ų5738.8 Ų38.825%0.2519%0.192CC..THydrogen-bonded Turntrans-90.411.8177.3-65.9-79.1000113.6I233 L236 A237 P280 A319 F320 L321 W326I233-F323 HydrophobicContact CB-CZ 4.47Å; I233-F323 HydrophobicContact CG1-CE2 4.42Å; I233-F323 HydrophobicContact CG2-CE2 4.15Å; I233-F323 HydrophobicContact CG2-CZ 3.88Å; L236-F323 HydrophobicContact CB-CE1 3.92Å; L236-F323 HydrophobicContact CB-CE2 4.29Å; L236-F323 HydrophobicContact CB-CZ 3.52Å; L236-F323 HydrophobicContact CD1-CE2 4.17Å; L236-F323 HydrophobicContact CD1-CZ 4.24Å; A237-F323 HydrophobicContact CB-CE1 3.95Å; A237-F323 HydrophobicContact CB-CZ 4.14Å; P280-F323 HydrophobicContact CB-CE1 4.16Å; P280-F323 HydrophobicContact CB-CZ 4.31Å; P280-F323 HydrophobicContact CG-CD1 3.96Å; P280-F323 HydrophobicContact CG-CE1 3.9Å; P280-F323 HydrophobicContact CG-CZ 4.44Å; A319-F323 WeakPolarHBondContact O-CD2 3.4Å; F320-F323 PolarHBondContact O-N 3.31Å; L321-F323 PolarHBondContact O-N 3.27Å; L321-F323 VanDerWaalsContact O-N 3.1Å; F323-W326 WeakPolarHBondContact O-CZ3 3.41Å
324L96.7Very high95.8Very high59 Ų5933.4 Ų33.431%0.30919%0.192SC..THydrogen-bonded Turntrans-127.710.6-176.5-63.3178.5000113.7F320 L321 S322 F343 S346F320-L324 HydrophobicContact CD1-CD1 4.28Å; F320-L324 HydrophobicContact CE1-CD1 3.66Å; F320-L324 HydrophobicContact CZ-CD1 3.96Å; L321-L324 PolarHBondContact O-N 3.31Å; S322-L324 VanDerWaalsContact C-N 3.34Å; L324-F343 VanDerWaalsContact O-CD1 3.29Å; L324-F343 WeakPolarHBondContact O-CD1 3.43Å; L324-F343 VanDerWaalsContact O-CE1 3.24Å; L324-F343 WeakPolarHBondContact O-CE1 3.37Å; L324-S346 PolarHBondContact O-OG 3.35Å; L324-S346 VanDerWaalsContact O-OG 3.1Å
325V97.5Very high95.5Very high0 Ų035.3 Ų35.30%020%0.201CC..  trans-130-7-168.3-65.20000114.6H279 L321 V327 H328 S346 I350H279-V325 WeakPolarHBondContact CD2-CG2 3.28Å; H279-V325 VanDerWaalsContact NE2-CG2 3.27Å; H279-V325 WeakPolarHBondContact NE2-CG2 3.46Å; L321-V325 WeakPolarHBondContact O-CG2 3.31Å; V325-V327 PolarHBondContact O-N 3.39Å; V325-H328 PolarHBondContact O-CD2 3.36Å; V325-H328 PolarHBondContact O-N 2.63Å; V325-H328 VanDerWaalsContact O-N 3.11Å; V325-S346 VanDerWaalsContact CG1-C 3.5Å; V325-I350 HydrophobicContact CB-CD1 4.29Å; V325-I350 HydrophobicContact CG1-CD1 3.71Å; V325-I350 HydrophobicContact CG1-CG1 4.33Å; V325-I350 HydrophobicContact CG2-CD1 3.81Å
326W97.5Very high95.4Very high54 Ų5437.4 Ų37.421%0.20522%0.222CC..G310 helixtrans-60-25.7-166.772.593.9000115.8N272 W275 V276 H279 F323 H328 H329 F330 F343N272-W326 PolarHBondContact OD1-NE1 3.5Å; W275-W326 HydrophobicContact CB-CB 4.25Å; W275-W326 VanDerWaalsContact O-CB 3.24Å; W275-W326 WeakPolarHBondContact O-CB 3.31Å; V276-W326 HydrophobicContact CG2-CD2 4.05Å; V276-W326 HydrophobicContact CG2-CG 4.07Å; V276-W326 HydrophobicContact CG2-CZ2 4.23Å; H279-W326 HydrophobicContact CB-CB 4.28Å; F323-W326 WeakPolarHBondContact O-CZ3 3.41Å; W326-H328 PolarHBondContact O-N 3.41Å; W326-H329 PolarHBondContact O-CD2 3.39Å; W326-H329 PolarHBondContact O-N 3.11Å; W326-F330 AromaticContact CD1-CE1 3.96Å; W326-F330 AromaticContact CD1-CZ 3.93Å; W326-F343 HydrophobicContact CD2-CE1 4.05Å; W326-F343 HydrophobicContact CD2-CZ 4.46Å; W326-F343 AromaticContact CE3-CE1 3.8Å; W326-F343 HydrophobicContact CE3-CE1 3.8Å; W326-F343 HydrophobicContact CE3-CZ 4.29Å; W326-F343 HydrophobicContact CH2-CE1 4.17Å; W326-F343 AromaticContact CH2-CZ 3.82Å; W326-F343 HydrophobicContact CH2-CZ 3.82Å; W326-F343 HydrophobicContact CZ2-CE1 4.42Å; W326-F343 HydrophobicContact CZ2-CZ 4.02Å; W326-F343 AromaticContact CZ3-CE1 3.82Å; W326-F343 HydrophobicContact CZ3-CE1 3.82Å; W326-F343 AromaticContact CZ3-CZ 3.94Å; W326-F343 HydrophobicContact CZ3-CZ 3.94Å
327V96.9Very high95.2Very high7 Ų739.4 Ų39.44%0.04224%0.239CC..G310 helixtrans-64.1-19.4179.3174.30000113V325 H329 F330 F331 I339 F343V325-V327 PolarHBondContact O-N 3.39Å; V327-H329 PolarHBondContact O-N 2.99Å; V327-F330 HydrophobicContact CB-CE1 4.48Å; V327-F330 HydrophobicContact CB-CE2 3.99Å; V327-F330 HydrophobicContact CB-CZ 3.92Å; V327-F330 HydrophobicContact CG1-CD2 4.06Å; V327-F330 HydrophobicContact CG1-CE2 3.68Å; V327-F330 HydrophobicContact CG1-CZ 4.15Å; V327-F330 HydrophobicContact CG2-CE2 3.9Å; V327-F330 HydrophobicContact CG2-CZ 3.66Å; V327-F330 CarbonylContact O-C 3.59Å; V327-F330 PolarHBondContact O-N 3.2Å; V327-F331 PolarHBondContact O-N 3.21Å; V327-I339 HydrophobicContact CG1-CG2 4.21Å; V327-F343 HydrophobicContact CB-CB 3.96Å; V327-F343 HydrophobicContact CB-CD1 3.55Å; V327-F343 HydrophobicContact CB-CD2 3.66Å; V327-F343 HydrophobicContact CB-CE1 3.85Å; V327-F343 HydrophobicContact CB-CE2 3.98Å; V327-F343 HydrophobicContact CB-CG 3.45Å; V327-F343 VanDerWaalsContact CB-CG 3.45Å; V327-F343 HydrophobicContact CB-CZ 4.06Å; V327-F343 HydrophobicContact CG1-CB 4.31Å; V327-F343 HydrophobicContact CG1-CD2 4.05Å; V327-F343 HydrophobicContact CG1-CG 4.11Å; V327-F343 HydrophobicContact CG2-CD1 3.82Å; V327-F343 HydrophobicContact CG2-CD2 3.72Å; V327-F343 HydrophobicContact CG2-CE1 3.56Å; V327-F343 HydrophobicContact CG2-CE2 3.48Å; V327-F343 VanDerWaalsContact CG2-CE2 3.48Å; V327-F343 HydrophobicContact CG2-CG 3.91Å; V327-F343 HydrophobicContact CG2-CZ 3.38Å
328H97.3Very high95.2Very high28 Ų2845.2 Ų45.213%0.1326%0.263CS..G310 helixtrans-59.9-16.7176.874.6163.5000115H279 V325 W326 F330 F331 T347H279-H328 AromaticContact CD2-NE2 3.81Å; H279-H328 AromaticContact CE1-CE1 3.15Å; H279-H328 PolarHBondContact CE1-CE1 3.35Å; H279-H328 AromaticContact CE1-NE2 3.23Å; H279-H328 PolarHBondContact CE1-NE2 3.38Å; H279-H328 AromaticContact CG-NE2 3.4Å; H279-H328 AromaticContact ND1-CE1 3.48Å; H279-H328 PolarHBondContact ND1-CE1 3.38Å; H279-H328 AromaticContact ND1-NE2 3.05Å; H279-H328 PolarHBondContact ND1-NE2 3.05Å; H279-H328 AromaticContact NE2-CE1 3.58Å; H279-H328 AromaticContact NE2-NE2 3.64Å; V325-H328 PolarHBondContact O-CD2 3.36Å; V325-H328 PolarHBondContact O-N 2.63Å; V325-H328 VanDerWaalsContact O-N 3.11Å; W326-H328 PolarHBondContact O-N 3.41Å; H328-F330 PolarHBondContact O-N 3.19Å; H328-F331 HydrophobicContact CB-CD2 4.28Å; H328-F331 HydrophobicContact CB-CE1 4.09Å; H328-F331 HydrophobicContact CB-CE2 3.51Å; H328-F331 HydrophobicContact CB-CZ 3.4Å; H328-F331 WeakPolarHBondContact O-CD2 3.32Å; H328-T347 WeakPolarHBondContact ND1-CG2 3.25Å; H328-T347 PolarHBondContact ND1-OG1 3.31Å
329H97.2Very high95.2Very high44 Ų4448.9 Ų48.920%0.20428%0.282CS..G310 helixtrans-78.3-8.3174.9-70.5-76000113.7W275 H279 W326 V327 H406W275-H329 HydrophobicContact CD2-CB 3.51Å; W275-H329 AromaticContact CD2-CD2 3.53Å; W275-H329 AromaticContact CD2-CG 3.48Å; W275-H329 VanDerWaalsContact CD2-CG 3.48Å; W275-H329 VanDerWaalsContact CE2-CB 3.42Å; W275-H329 AromaticContact CE2-CG 3.66Å; W275-H329 HydrophobicContact CE3-CB 4.06Å; W275-H329 AromaticContact CE3-CD2 3.2Å; W275-H329 AromaticContact CE3-CE1 3.81Å; W275-H329 AromaticContact CE3-CG 3.47Å; W275-H329 VanDerWaalsContact CE3-CG 3.47Å; W275-H329 AromaticContact CE3-ND1 3.85Å; W275-H329 AromaticContact CE3-NE2 3.42Å; W275-H329 HydrophobicContact CG-CB 3.76Å; W275-H329 HydrophobicContact CH2-CB 4.36Å; W275-H329 AromaticContact CH2-CE1 3.66Å; W275-H329 AromaticContact CH2-CG 3.8Å; W275-H329 AromaticContact CH2-ND1 3.41Å; W275-H329 WeakPolarHBondContact CH2-ND1 3.38Å; W275-H329 HydrophobicContact CZ2-CB 3.88Å; W275-H329 AromaticContact CZ2-CG 3.83Å; W275-H329 AromaticContact CZ2-ND1 3.75Å; W275-H329 HydrophobicContact CZ3-CB 4.46Å; W275-H329 AromaticContact CZ3-CD2 3.61Å; W275-H329 AromaticContact CZ3-CE1 3.33Å; W275-H329 WeakPolarHBondContact CZ3-CE1 3.47Å; W275-H329 AromaticContact CZ3-CG 3.65Å; W275-H329 AromaticContact CZ3-ND1 3.49Å; W275-H329 WeakPolarHBondContact CZ3-ND1 3.33Å; W275-H329 AromaticContact CZ3-NE2 3.4Å; W275-H329 WeakPolarHBondContact CZ3-NE2 3.14Å; H279-H329 AromaticContact CG-NE2 3.63Å; H279-H329 AromaticContact ND1-NE2 3.18Å; H279-H329 PolarHBondContact ND1-NE2 3.35Å; H279-H329 VanDerWaalsContact ND1-NE2 3.18Å; W326-H329 PolarHBondContact O-CD2 3.39Å; W326-H329 PolarHBondContact O-N 3.11Å; V327-H329 PolarHBondContact O-N 2.99Å; H329-H406 PolarHBondContact O-CE1 2.56Å
330F94.8Very high95.2Very high14 Ų1448.7 Ų48.76%0.06128%0.279CS..G310 helixtrans-14437.6-17652.4-91.2000112.8N272 W275 W326 V327 H328 T332 M333 N335N272-F330 HydrophobicContact CB-CZ 4.47Å; W275-F330 HydrophobicContact CB-CD1 4.39Å; W275-F330 HydrophobicContact CB-CE1 3.9Å; W275-F330 AromaticContact CD1-CD1 3.63Å; W275-F330 AromaticContact CD1-CE1 3.93Å; W275-F330 HydrophobicContact CG-CD1 4.23Å; W275-F330 HydrophobicContact CG-CE1 4.22Å; W326-F330 AromaticContact CD1-CE1 3.96Å; W326-F330 AromaticContact CD1-CZ 3.93Å; V327-F330 HydrophobicContact CB-CE1 4.48Å; V327-F330 HydrophobicContact CB-CE2 3.99Å; V327-F330 HydrophobicContact CB-CZ 3.92Å; V327-F330 HydrophobicContact CG1-CD2 4.06Å; V327-F330 HydrophobicContact CG1-CE2 3.68Å; V327-F330 HydrophobicContact CG1-CZ 4.15Å; V327-F330 HydrophobicContact CG2-CE2 3.9Å; V327-F330 HydrophobicContact CG2-CZ 3.66Å; V327-F330 CarbonylContact O-C 3.59Å; V327-F330 PolarHBondContact O-N 3.2Å; H328-F330 PolarHBondContact O-N 3.19Å; F330-T332 PolarHBondContact O-N 3.26Å; F330-T332 VanDerWaalsContact O-N 3.14Å; F330-M333 HydrophobicContact CB-CB 4.22Å; F330-M333 HydrophobicContact CB-CG 3.72Å; F330-M333 HydrophobicContact CB-SD 3.39Å; F330-M333 WeakPolarHBondContact CB-SD 3.45Å; F330-M333 HydrophobicContact CD2-SD 4.35Å; F330-M333 HydrophobicContact CG-SD 4.08Å; F330-M333 PolarHBondContact O-N 3.48Å; F330-M333 VanDerWaalsContact O-N 3.07Å; F330-N335 PolarHBondContact O-ND2 3.17Å
331F96Very high95.2Very high0 Ų044.8 Ų44.80%027%0.27CS..G310 helixtrans-53.8-31.3170.2-71.2-38.9000112.7V327 H328 M333 N340 F343 A399 D402 Y403V327-F331 PolarHBondContact O-N 3.21Å; H328-F331 HydrophobicContact CB-CD2 4.28Å; H328-F331 HydrophobicContact CB-CE1 4.09Å; H328-F331 HydrophobicContact CB-CE2 3.51Å; H328-F331 HydrophobicContact CB-CZ 3.4Å; H328-F331 WeakPolarHBondContact O-CD2 3.32Å; F331-M333 VanDerWaalsContact C-N 3.31Å; F331-M333 PolarHBondContact O-N 3.38Å; F331-N340 HydrophobicContact CD1-CB 4.1Å; F331-N340 WeakPolarHBondContact CD1-OD1 3.41Å; F331-N340 HydrophobicContact CE1-CB 4.42Å; F331-N340 PolarHBondContact O-ND2 3.37Å; F331-N340 VanDerWaalsContact O-ND2 3.12Å; F331-F343 HydrophobicContact CE1-CB 3.86Å; F331-F343 HydrophobicContact CZ-CB 4.35Å; F331-A399 HydrophobicContact CB-CB 4.49Å; F331-A399 HydrophobicContact CD1-CB 3.96Å; F331-A399 HydrophobicContact CD2-CB 3.78Å; F331-A399 HydrophobicContact CE1-CB 3.99Å; F331-A399 HydrophobicContact CE2-CB 3.81Å; F331-A399 HydrophobicContact CG-CB 3.84Å; F331-A399 HydrophobicContact CZ-CB 3.91Å; F331-D402 HydrophobicContact CD2-CB 4.04Å; F331-Y403 PolarHBondContact O-OH 3.19Å
332T94.2Very high95.2Very high50 Ų5049 Ų4931%0.30729%0.288SS..G310 helixtrans-78.5-2.7-179.656.30000114.9F330 G334 Y403 H406F330-T332 PolarHBondContact O-N 3.26Å; F330-T332 VanDerWaalsContact O-N 3.14Å; T332-G334 VanDerWaalsContact C-N 3.26Å; T332-G334 PolarHBondContact O-N 2.9Å; T332-Y403 HydrophobicContact CG2-CD1 4.08Å; T332-Y403 HydrophobicContact CG2-CE1 4.41Å; T332-Y403 HydrophobicContact CG2-CG 4.32Å; T332-H406 HydrophobicContact CG2-CB 3.69Å; T332-H406 PolarHBondContact OG1-CD2 2.93Å; T332-H406 PolarHBondContact OG1-CE1 2.97Å; T332-H406 PolarHBondContact OG1-NE2 2.87Å
333M93.1Very high95.3Very high67 Ų6750 Ų5033%0.3329%0.292SS..G310 helixtrans-8512.6-179.5-69.8-175.563.100114.5M268 A271 F330 F331M268-M333 HydrophobicContact CB-CE 3.54Å; M268-M333 HydrophobicContact CG-CE 3.29Å; M268-M333 HydrophobicContact SD-CE 3.62Å; A271-M333 HydrophobicContact CB-CE 4.2Å; A271-M333 HydrophobicContact CB-SD 4.1Å; F330-M333 HydrophobicContact CB-CB 4.22Å; F330-M333 HydrophobicContact CB-CG 3.72Å; F330-M333 HydrophobicContact CB-SD 3.39Å; F330-M333 WeakPolarHBondContact CB-SD 3.45Å; F330-M333 HydrophobicContact CD2-SD 4.35Å; F330-M333 HydrophobicContact CG-SD 4.08Å; F330-M333 PolarHBondContact O-N 3.48Å; F330-M333 VanDerWaalsContact O-N 3.07Å; F331-M333 VanDerWaalsContact C-N 3.31Å; F331-M333 PolarHBondContact O-N 3.38Å
334G89.7Confident95.3Very high65 Ų6548 Ų4867%0.6729%0.285SS*.  trans80.324.8172.900000115.1T332T332-G334 VanDerWaalsContact C-N 3.26Å; T332-G334 PolarHBondContact O-N 2.9Å
335N90.7Very high95.3Very high50 Ų5050 Ų5027%0.26730%0.295SS..  trans-60.7156.2170.7-65-52.8000111.7F330 I339 N340F330-N335 PolarHBondContact O-ND2 3.17Å; N335-I339 HydrophobicContact CB-CB 4.47Å; N335-I339 HydrophobicContact CB-CG2 4.41Å; N335-N340 WeakPolarHBondContact CB-OD1 3.3Å
336G92.7Very high95.3Very high43 Ų4350.4 Ų50.444%0.44330%0.298SS..  trans-62.3146.8173.700000112.9L338 I339 N340G336-L338 PolarHBondContact O-N 3.09Å; G336-L338 VanDerWaalsContact O-N 3.13Å; G336-I339 WeakPolarHBondContact O-CB 3.34Å; G336-I339 PolarHBondContact O-N 3.3Å; G336-N340 PolarHBondContact O-N 3.47Å; G336-N340 VanDerWaalsContact O-N 3.14Å
337A93.4Very high95.3Very high79 Ų7948.7 Ų48.765%0.65329%0.293SS*.Hα-helixtrans-54.3-36.2-176.400000113.7S341A337-S341 WeakPolarHBondContact O-CB 3.31Å; A337-S341 PolarHBondContact O-N 2.87Å; A337-S341 PolarHBondContact O-OG 3.36Å
338L95.4Very high95.3Very high147 Ų14751.8 Ų51.877%0.7731%0.308SS*.Hα-helixtrans-62.3-43.9176.8-179.564.9000111.9G336 S341 F342G336-L338 PolarHBondContact O-N 3.09Å; G336-L338 VanDerWaalsContact O-N 3.13Å; L338-S341 PolarHBondContact O-N 3.43Å; L338-F342 PolarHBondContact O-N 3.46Å
339I95.5Very high95.2Very high79 Ų7954.3 Ų54.341%0.40532%0.322SS..Hα-helixtrans-65.5-50.9179.9-62.3173.9000109.2V327 N335 G336 S341 F342 F343V327-I339 HydrophobicContact CG1-CG2 4.21Å; N335-I339 HydrophobicContact CB-CB 4.47Å; N335-I339 HydrophobicContact CB-CG2 4.41Å; G336-I339 WeakPolarHBondContact O-CB 3.34Å; G336-I339 PolarHBondContact O-N 3.3Å; I339-S341 VanDerWaalsContact C-N 3.27Å; I339-S341 PolarHBondContact O-N 3.39Å; I339-F342 PolarHBondContact O-N 2.96Å; I339-F343 HydrophobicContact CG2-CD2 3.87Å; I339-F343 HydrophobicContact CG2-CE2 4.12Å; I339-F343 WeakPolarHBondContact O-CD2 3.5Å; I339-F343 PolarHBondContact O-N 2.99Å
340N96Very high95.1Very high9 Ų952.6 Ų52.65%0.04831%0.314CS..Hα-helixtrans-57.8-40.5177.5-80.72.4000112F331 N335 G336 S344 A399 Y403F331-N340 HydrophobicContact CD1-CB 4.1Å; F331-N340 WeakPolarHBondContact CD1-OD1 3.41Å; F331-N340 HydrophobicContact CE1-CB 4.42Å; F331-N340 PolarHBondContact O-ND2 3.37Å; F331-N340 VanDerWaalsContact O-ND2 3.12Å; N335-N340 WeakPolarHBondContact CB-OD1 3.3Å; G336-N340 PolarHBondContact O-N 3.47Å; G336-N340 VanDerWaalsContact O-N 3.14Å; N340-S344 WeakPolarHBondContact O-CB 3.43Å; N340-S344 PolarHBondContact O-N 3.44Å; N340-A399 HydrophobicContact CB-CB 4.12Å; N340-Y403 PolarHBondContact ND2-OH 3.2Å
341S96Very high95.1Very high63 Ų6353.6 Ų53.644%0.44133%0.329SS..Hα-helixtrans-67.1-42.1178-57.40000112.5A337 L338 I339 S344 I345A337-S341 WeakPolarHBondContact O-CB 3.31Å; A337-S341 PolarHBondContact O-N 2.87Å; A337-S341 PolarHBondContact O-OG 3.36Å; L338-S341 PolarHBondContact O-N 3.43Å; I339-S341 VanDerWaalsContact C-N 3.27Å; I339-S341 PolarHBondContact O-N 3.39Å; S341-S344 PolarHBondContact O-N 3.08Å; S341-I345 VanDerWaalsContact O-CG1 3.32Å; S341-I345 WeakPolarHBondContact O-CG1 3.37Å; S341-I345 PolarHBondContact O-N 3.43Å
342F96.9Very high95Very high115 Ų11559 Ų5950%0.50436%0.356SS..Hα-helixtrans-60.2-48.1176.1175.3-89.6000111.6L338 I339 I345 S346L338-F342 PolarHBondContact O-N 3.46Å; I339-F342 PolarHBondContact O-N 2.96Å; F342-I345 PolarHBondContact O-N 3.23Å; F342-S346 WeakPolarHBondContact O-CB 3.35Å; F342-S346 PolarHBondContact O-N 2.89Å; F342-S346 PolarHBondContact O-OG 3.16Å
343F97.1Very high95.1Very high20 Ų2057.5 Ų57.59%0.08835%0.347CS..Hα-helixtrans-71.5-29.8-179.7-81.7-85.9000112.8L324 W326 V327 F331 I339 S346 T347L324-F343 VanDerWaalsContact O-CD1 3.29Å; L324-F343 WeakPolarHBondContact O-CD1 3.43Å; L324-F343 VanDerWaalsContact O-CE1 3.24Å; L324-F343 WeakPolarHBondContact O-CE1 3.37Å; W326-F343 HydrophobicContact CD2-CE1 4.05Å; W326-F343 HydrophobicContact CD2-CZ 4.46Å; W326-F343 AromaticContact CE3-CE1 3.8Å; W326-F343 HydrophobicContact CE3-CE1 3.8Å; W326-F343 HydrophobicContact CE3-CZ 4.29Å; W326-F343 HydrophobicContact CH2-CE1 4.17Å; W326-F343 AromaticContact CH2-CZ 3.82Å; W326-F343 HydrophobicContact CH2-CZ 3.82Å; W326-F343 HydrophobicContact CZ2-CE1 4.42Å; W326-F343 HydrophobicContact CZ2-CZ 4.02Å; W326-F343 AromaticContact CZ3-CE1 3.82Å; W326-F343 HydrophobicContact CZ3-CE1 3.82Å; W326-F343 AromaticContact CZ3-CZ 3.94Å; W326-F343 HydrophobicContact CZ3-CZ 3.94Å; V327-F343 HydrophobicContact CB-CB 3.96Å; V327-F343 HydrophobicContact CB-CD1 3.55Å; V327-F343 HydrophobicContact CB-CD2 3.66Å; V327-F343 HydrophobicContact CB-CE1 3.85Å; V327-F343 HydrophobicContact CB-CE2 3.98Å; V327-F343 HydrophobicContact CB-CG 3.45Å; V327-F343 VanDerWaalsContact CB-CG 3.45Å; V327-F343 HydrophobicContact CB-CZ 4.06Å; V327-F343 HydrophobicContact CG1-CB 4.31Å; V327-F343 HydrophobicContact CG1-CD2 4.05Å; V327-F343 HydrophobicContact CG1-CG 4.11Å; V327-F343 HydrophobicContact CG2-CD1 3.82Å; V327-F343 HydrophobicContact CG2-CD2 3.72Å; V327-F343 HydrophobicContact CG2-CE1 3.56Å; V327-F343 HydrophobicContact CG2-CE2 3.48Å; V327-F343 VanDerWaalsContact CG2-CE2 3.48Å; V327-F343 HydrophobicContact CG2-CG 3.91Å; V327-F343 HydrophobicContact CG2-CZ 3.38Å; F331-F343 HydrophobicContact CE1-CB 3.86Å; F331-F343 HydrophobicContact CZ-CB 4.35Å; I339-F343 HydrophobicContact CG2-CD2 3.87Å; I339-F343 HydrophobicContact CG2-CE2 4.12Å; I339-F343 WeakPolarHBondContact O-CD2 3.5Å; I339-F343 PolarHBondContact O-N 2.99Å; F343-S346 VanDerWaalsContact CA-OG 3.25Å; F343-S346 WeakPolarHBondContact CA-OG 3.44Å; F343-S346 PolarHBondContact O-OG 2.69Å; F343-S346 VanDerWaalsContact O-OG 3.12Å; F343-T347 VanDerWaalsContact O-CB 3.24Å; F343-T347 WeakPolarHBondContact O-CB 3.12Å; F343-T347 PolarHBondContact O-N 2.69Å; F343-T347 PolarHBondContact O-OG1 3.31Å
344S97.2Very high95.1Very high15 Ų1555.3 Ų55.311%0.10534%0.338CS..Hα-helixtrans-62-52.3169168.50000111.7N340 S341 T347 M348 A397N340-S344 WeakPolarHBondContact O-CB 3.43Å; N340-S344 PolarHBondContact O-N 3.44Å; S341-S344 PolarHBondContact O-N 3.08Å; S344-T347 PolarHBondContact O-N 3.14Å; S344-M348 WeakPolarHBondContact O-CG 3.47Å; S344-M348 PolarHBondContact O-N 3.44Å; S344-A397 WeakPolarHBondContact CA-O 3.34Å; S344-A397 VanDerWaalsContact CB-O 3.32Å; S344-A397 WeakPolarHBondContact CB-O 3.06Å; S344-A397 PolarHBondContact OG-O 3.18Å
345I96.9Very high95.3Very high100 Ų10053.2 Ų53.251%0.51332%0.316SS..Hα-helixtrans-62.6-48.8-179.3-66.5165.6000111.4S341 F342 T347 M348 L349S341-I345 VanDerWaalsContact O-CG1 3.32Å; S341-I345 WeakPolarHBondContact O-CG1 3.37Å; S341-I345 PolarHBondContact O-N 3.43Å; F342-I345 PolarHBondContact O-N 3.23Å; I345-T347 VanDerWaalsContact C-N 3.29Å; I345-T347 PolarHBondContact O-N 2.94Å; I345-M348 HydrophobicContact CG1-CE 4.21Å; I345-M348 PolarHBondContact O-N 3.39Å; I345-L349 WeakPolarHBondContact O-CG 3.39Å; I345-L349 PolarHBondContact O-N 3.04Å
346S96.9Very high95.6Very high10 Ų1053.3 Ų53.37%0.0732%0.319CS..Hα-helixtrans-61.1-37.3178.951.10000112.4L324 V325 F342 F343 L349L324-S346 PolarHBondContact O-OG 3.35Å; L324-S346 VanDerWaalsContact O-OG 3.1Å; V325-S346 VanDerWaalsContact CG1-C 3.5Å; F342-S346 WeakPolarHBondContact O-CB 3.35Å; F342-S346 PolarHBondContact O-N 2.89Å; F342-S346 PolarHBondContact O-OG 3.16Å; F343-S346 VanDerWaalsContact CA-OG 3.25Å; F343-S346 WeakPolarHBondContact CA-OG 3.44Å; F343-S346 PolarHBondContact O-OG 2.69Å; F343-S346 VanDerWaalsContact O-OG 3.12Å; S346-L349 WeakPolarHBondContact O-CB 3.11Å; S346-L349 PolarHBondContact O-N 3.2Å
347T97.1Very high95.7Very high17 Ų1751.3 Ų51.310%0.10430%0.297CS..Hα-helixtrans-64.6-44.3174.8-58.10000111.2H328 F343 S344 I345 L349 I350 A397H328-T347 WeakPolarHBondContact ND1-CG2 3.25Å; H328-T347 PolarHBondContact ND1-OG1 3.31Å; F343-T347 VanDerWaalsContact O-CB 3.24Å; F343-T347 WeakPolarHBondContact O-CB 3.12Å; F343-T347 PolarHBondContact O-N 2.69Å; F343-T347 PolarHBondContact O-OG1 3.31Å; S344-T347 PolarHBondContact O-N 3.14Å; I345-T347 VanDerWaalsContact C-N 3.29Å; I345-T347 PolarHBondContact O-N 2.94Å; T347-L349 VanDerWaalsContact C-N 3.27Å; T347-L349 PolarHBondContact O-N 3.16Å; T347-I350 WeakPolarHBondContact O-CB 3.39Å; T347-I350 PolarHBondContact O-N 3.15Å; T347-I350 VanDerWaalsContact O-N 3.15Å; T347-A397 HydrophobicContact CG2-CB 3.46Å; T347-A397 VanDerWaalsContact CG2-CB 3.46Å
348M96.3Very high95.7Very high72 Ų7248.4 Ų48.436%0.35527%0.271SS..Hα-helixtrans-61.7-33.8176.7-70.9-173.3-7000112.7S344 I345 I350 G351 A397S344-M348 WeakPolarHBondContact O-CG 3.47Å; S344-M348 PolarHBondContact O-N 3.44Å; I345-M348 HydrophobicContact CG1-CE 4.21Å; I345-M348 PolarHBondContact O-N 3.39Å; M348-I350 PolarHBondContact O-N 3.29Å; M348-G351 PolarHBondContact O-N 2.94Å; M348-A397 HydrophobicContact CG-CB 3.91Å
349L96Very high95.8Very high81 Ų8148 Ų4842%0.42426%0.263SS..Hα-helixtrans-59.9-28.8176.6-71.2175000113L321 I345 S346 T347 G351 I352 P353L321-L349 HydrophobicContact CD1-CB 4.29Å; I345-L349 WeakPolarHBondContact O-CG 3.39Å; I345-L349 PolarHBondContact O-N 3.04Å; S346-L349 WeakPolarHBondContact O-CB 3.11Å; S346-L349 PolarHBondContact O-N 3.2Å; T347-L349 VanDerWaalsContact C-N 3.27Å; T347-L349 PolarHBondContact O-N 3.16Å; L349-G351 PolarHBondContact O-N 3.3Å; L349-I352 HydrophobicContact CD2-CD1 4.19Å; L349-I352 PolarHBondContact O-N 2.9Å; L349-I352 VanDerWaalsContact O-N 3.13Å; L349-P353 WeakPolarHBondContact O-CD 3.49Å
350I95.2Very high95.9Very high8 Ų844.7 Ų44.74%0.04125%0.247CC..Hα-helixtrans-65.1-24.6176.8-62.6-172.9000112.1Y283 L321 V325 T347 M348 I352 P353 T354Y283-I350 HydrophobicContact CE1-CG2 4.2Å; Y283-I350 HydrophobicContact CE2-CD1 4.09Å; Y283-I350 VanDerWaalsContact OH-CD1 3.27Å; Y283-I350 WeakPolarHBondContact OH-CD1 3.38Å; Y283-I350 WeakPolarHBondContact OH-CG2 3.38Å; L321-I350 HydrophobicContact CB-CD1 3.86Å; L321-I350 HydrophobicContact CB-CG1 3.65Å; L321-I350 HydrophobicContact CD1-CG1 3.9Å; L321-I350 HydrophobicContact CG-CG1 4.38Å; V325-I350 HydrophobicContact CB-CD1 4.29Å; V325-I350 HydrophobicContact CG1-CD1 3.71Å; V325-I350 HydrophobicContact CG1-CG1 4.33Å; V325-I350 HydrophobicContact CG2-CD1 3.81Å; T347-I350 WeakPolarHBondContact O-CB 3.39Å; T347-I350 PolarHBondContact O-N 3.15Å; T347-I350 VanDerWaalsContact O-N 3.15Å; M348-I350 PolarHBondContact O-N 3.29Å; I350-I352 PolarHBondContact O-N 2.85Å; I350-P353 WeakPolarHBondContact O-CD 3.33Å; I350-T354 PolarHBondContact O-N 3.45Å; I350-T354 PolarHBondContact O-OG1 2.82Å
351G94.3Very high96Very high35 Ų3544.3 Ų44.336%0.36124%0.244SC..Hα-helixtrans-57.8-32.1173.500000112.9M348 L349 G355M348-G351 PolarHBondContact O-N 2.94Å; L349-G351 PolarHBondContact O-N 3.3Å; G351-G355 PolarHBondContact O-N 2.81Å
352I95.4Very high96Very high113 Ų11345.1 Ų45.158%0.57924%0.243SC*.Hα-helixtrans-69.3-58.5-176.8-62.2167.9000111.7L349 I350 T354 G355 V356L349-I352 HydrophobicContact CD2-CD1 4.19Å; L349-I352 PolarHBondContact O-N 2.9Å; L349-I352 VanDerWaalsContact O-N 3.13Å; I350-I352 PolarHBondContact O-N 2.85Å; I352-T354 PolarHBondContact O-N 3.29Å; I352-G355 PolarHBondContact O-N 2.89Å; I352-G355 VanDerWaalsContact O-N 3.17Å; I352-V356 WeakPolarHBondContact O-CG2 3.28Å; I352-V356 PolarHBondContact O-N 3Å
353P95.7Very high96.1Very high19 Ų1942.9 Ų42.912%0.12324%0.236CC..Hα-helixtrans-55.4-38.7176-28.134.7000113.6A314 I318 L321 L349 I350 V356 K357A314-P353 HydrophobicContact CB-CB 4.06Å; A314-P353 WeakPolarHBondContact O-CB 3.4Å; I318-P353 HydrophobicContact CD1-CB 4.06Å; I318-P353 HydrophobicContact CG1-CB 3.62Å; I318-P353 HydrophobicContact CG1-CG 4.33Å; L321-P353 HydrophobicContact CD1-CG 4.5Å; L349-P353 WeakPolarHBondContact O-CD 3.49Å; I350-P353 WeakPolarHBondContact O-CD 3.33Å; P353-V356 PolarHBondContact O-N 2.61Å; P353-K357 WeakPolarHBondContact O-CG 3.08Å; P353-K357 PolarHBondContact O-N 3.05Å
354T93.2Very high96.1Very high22 Ų2241.9 Ų41.914%0.13523%0.232CC..Hα-helixtrans-67-42.5179.6-52.90000111.1F290 I350 I352 V356 K357 L358 F386F290-T354 HydrophobicContact CZ-CG2 4.27Å; I350-T354 PolarHBondContact O-N 3.45Å; I350-T354 PolarHBondContact O-OG1 2.82Å; I352-T354 PolarHBondContact O-N 3.29Å; T354-V356 PolarHBondContact O-N 3.1Å; T354-K357 PolarHBondContact O-N 2.63Å; T354-L358 PolarHBondContact O-N 2.75Å; T354-F386 HydrophobicContact CG2-CE1 3.71Å; T354-F386 HydrophobicContact CG2-CZ 4.34Å
355G94.6Very high96.1Very high20 Ų2042.1 Ų42.121%0.20623%0.232CC..Hα-helixtrans-60.2-43.3174.300000112.9G351 I352 K357 L358 F359G351-G355 PolarHBondContact O-N 2.81Å; I352-G355 PolarHBondContact O-N 2.89Å; I352-G355 VanDerWaalsContact O-N 3.17Å; G355-K357 PolarHBondContact O-N 3.45Å; G355-L358 PolarHBondContact O-N 3.44Å; G355-L358 VanDerWaalsContact O-N 3.12Å; G355-F359 WeakPolarHBondContact O-CD2 3.12Å; G355-F359 PolarHBondContact O-N 2.83Å
356V95.3Very high96.1Very high53 Ų5344.1 Ų44.132%0.32123%0.234SC..Hα-helixtrans-54.8-41.4175.7171.20000111.3A314 I352 P353 T354 F359 N360A314-V356 HydrophobicContact CB-CG1 4.45Å; I352-V356 WeakPolarHBondContact O-CG2 3.28Å; I352-V356 PolarHBondContact O-N 3Å; P353-V356 PolarHBondContact O-N 2.61Å; T354-V356 PolarHBondContact O-N 3.1Å; V356-F359 PolarHBondContact O-N 3.26Å; V356-N360 WeakPolarHBondContact O-CB 3.23Å; V356-N360 VanDerWaalsContact O-CG 3.31Å; V356-N360 PolarHBondContact O-N 3.05Å; V356-N360 PolarHBondContact O-ND2 3.19Å
357K94.7Very high96Very high0 Ų051.6 Ų51.60%027%0.265CS..Hα-helixtrans-66.3-44178-62.8179.474.5174.90112.1F290 A314 I318 P353 T354 G355 F359 N360 W361F290-K357 HydrophobicContact CD2-CD 4.39Å; A314-K357 HydrophobicContact CB-CG 4.16Å; I318-K357 HydrophobicContact CD1-CD 4.4Å; P353-K357 WeakPolarHBondContact O-CG 3.08Å; P353-K357 PolarHBondContact O-N 3.05Å; T354-K357 PolarHBondContact O-N 2.63Å; G355-K357 PolarHBondContact O-N 3.45Å; K357-F359 PolarHBondContact O-N 3.49Å; K357-N360 PolarHBondContact O-N 3.26Å; K357-W361 HydrophobicContact CB-CE3 4.41Å; K357-W361 HydrophobicContact CB-CH2 3.76Å; K357-W361 HydrophobicContact CB-CZ2 4.22Å; K357-W361 HydrophobicContact CB-CZ3 3.87Å; K357-W361 VanDerWaalsContact O-CD2 3.3Å; K357-W361 VanDerWaalsContact O-CE3 3.28Å; K357-W361 PolarHBondContact O-N 3.48Å
358L94.8Very high95.8Very high19 Ų1952 Ų5210%0.09927%0.272CS..Hα-helixtrans-56.8-47.6175.3-73170000111.9T354 G355 N360 W361 L362 F382 I383 F386 L387T354-L358 PolarHBondContact O-N 2.75Å; G355-L358 PolarHBondContact O-N 3.44Å; G355-L358 VanDerWaalsContact O-N 3.12Å; L358-N360 PolarHBondContact O-N 3.03Å; L358-W361 HydrophobicContact CD2-CE3 3.93Å; L358-W361 HydrophobicContact CD2-CZ3 3.89Å; L358-W361 HydrophobicContact CG-CE3 4.4Å; L358-W361 HydrophobicContact CG-CZ3 4.22Å; L358-W361 PolarHBondContact O-N 3.29Å; L358-L362 WeakPolarHBondContact O-CG 3.5Å; L358-L362 PolarHBondContact O-N 2.81Å; L358-F382 HydrophobicContact CD2-CE1 4.42Å; L358-F382 HydrophobicContact CD2-CZ 4.41Å; L358-I383 HydrophobicContact CD2-CG2 4.34Å; L358-F386 HydrophobicContact CD2-CD1 4.49Å; L358-L387 HydrophobicContact CD1-CD1 4.32Å
359F96.7Very high95.7Very high137 Ų13758 Ų5860%0.60129%0.291SS*.Hα-helixtrans-64-40.9176.9-75-67.4000112.8G355 V356 K357 W361 L362 L363G355-F359 WeakPolarHBondContact O-CD2 3.12Å; G355-F359 PolarHBondContact O-N 2.83Å; V356-F359 PolarHBondContact O-N 3.26Å; K357-F359 PolarHBondContact O-N 3.49Å; F359-W361 PolarHBondContact O-N 3.38Å; F359-L362 PolarHBondContact O-N 2.91Å; F359-L363 WeakPolarHBondContact O-CB 3.18Å; F359-L363 WeakPolarHBondContact O-CG 3.03Å; F359-L363 PolarHBondContact O-N 2.95Å
360N97.5Very high95.7Very high11 Ų1156.9 Ų56.96%0.05929%0.285CS..Hα-helixtrans-63.7-38.5177.1-79.3-18000112.3F306 G307 S310 M311 V356 K357 L358 L363 T364F306-N360 WeakPolarHBondContact CD1-OD1 3.44Å; F306-N360 WeakPolarHBondContact O-CB 3.36Å; G307-N360 PolarHBondContact O-ND2 3.03Å; S310-N360 PolarHBondContact OG-ND2 2.9Å; M311-N360 HydrophobicContact CE-CB 3.27Å; M311-N360 HydrophobicContact CG-CB 4.1Å; M311-N360 VanDerWaalsContact CG-ND2 3.31Å; M311-N360 WeakPolarHBondContact CG-ND2 3.44Å; V356-N360 WeakPolarHBondContact O-CB 3.23Å; V356-N360 VanDerWaalsContact O-CG 3.31Å; V356-N360 PolarHBondContact O-N 3.05Å; V356-N360 PolarHBondContact O-ND2 3.19Å; K357-N360 PolarHBondContact O-N 3.26Å; L358-N360 PolarHBondContact O-N 3.03Å; N360-L363 PolarHBondContact O-N 3.43Å; N360-T364 WeakPolarHBondContact O-CB 3.43Å; N360-T364 PolarHBondContact O-N 3.42Å; N360-T364 PolarHBondContact O-OG1 3Å
361W97.9Very high95.7Very high0 Ų057.9 Ų57.90%029%0.291CS..Hα-helixtrans-63.7-45.6172.2-69.9-48.3000111.8F290 S294 I297 M311 K357 L358 F359 L363 T364 L365 F382 I383F290-W361 HydrophobicContact CB-CH2 3.92Å; F290-W361 HydrophobicContact CB-CZ2 3.91Å; F290-W361 AromaticContact CD1-CH2 3.55Å; F290-W361 HydrophobicContact CD1-CH2 3.55Å; F290-W361 HydrophobicContact CD1-CZ2 4.3Å; F290-W361 HydrophobicContact CD1-CZ3 4.38Å; F290-W361 HydrophobicContact CE1-CH2 4.09Å; F290-W361 AromaticContact CG-CH2 3.77Å; F290-W361 HydrophobicContact CG-CH2 3.77Å; F290-W361 HydrophobicContact CG-CZ2 4.29Å; S294-W361 PolarHBondContact OG-NE1 2.88Å; I297-W361 HydrophobicContact CD1-CB 3.9Å; I297-W361 HydrophobicContact CD1-CD2 4.34Å; I297-W361 HydrophobicContact CD1-CG 3.66Å; M311-W361 HydrophobicContact CE-CD2 4.34Å; M311-W361 HydrophobicContact CE-CG 4.06Å; K357-W361 HydrophobicContact CB-CE3 4.41Å; K357-W361 HydrophobicContact CB-CH2 3.76Å; K357-W361 HydrophobicContact CB-CZ2 4.22Å; K357-W361 HydrophobicContact CB-CZ3 3.87Å; K357-W361 VanDerWaalsContact O-CD2 3.3Å; K357-W361 VanDerWaalsContact O-CE3 3.28Å; K357-W361 PolarHBondContact O-N 3.48Å; L358-W361 HydrophobicContact CD2-CE3 3.93Å; L358-W361 HydrophobicContact CD2-CZ3 3.89Å; L358-W361 HydrophobicContact CG-CE3 4.4Å; L358-W361 HydrophobicContact CG-CZ3 4.22Å; L358-W361 PolarHBondContact O-N 3.29Å; F359-W361 PolarHBondContact O-N 3.38Å; W361-L363 VanDerWaalsContact C-N 3.32Å; W361-L363 PolarHBondContact O-N 3.44Å; W361-T364 WeakPolarHBondContact O-CA 3.23Å; W361-T364 WeakPolarHBondContact O-CB 3.48Å; W361-T364 PolarHBondContact O-N 3.3Å; W361-T364 VanDerWaalsContact O-N 3.07Å; W361-L365 WeakPolarHBondContact O-CG 3.24Å; W361-L365 PolarHBondContact O-N 3.15Å; W361-F382 HydrophobicContact CD2-CE1 4.44Å; W361-F382 AromaticContact CE3-CE1 3.71Å; W361-F382 HydrophobicContact CE3-CE1 3.71Å; W361-F382 HydrophobicContact CE3-CZ 4.29Å; W361-F382 AromaticContact CH2-CE1 3.98Å; W361-F382 HydrophobicContact CH2-CE1 3.98Å; W361-F382 AromaticContact CH2-CZ 3.96Å; W361-F382 HydrophobicContact CH2-CZ 3.96Å; W361-F382 AromaticContact CZ3-CE1 3.48Å; W361-F382 HydrophobicContact CZ3-CE1 3.48Å; W361-F382 VanDerWaalsContact CZ3-CE1 3.48Å; W361-F382 AromaticContact CZ3-CZ 3.6Å; W361-F382 HydrophobicContact CZ3-CZ 3.6Å; W361-I383 HydrophobicContact CB-CD1 4.43Å
362L97.4Very high95.8Very high80 Ų8061.9 Ų61.942%0.41930%0.299SS..Hα-helixtrans-58.6-42.2175.7-70.6172.6000112.2L358 F359 T364 L365 Y366 I383L358-L362 WeakPolarHBondContact O-CG 3.5Å; L358-L362 PolarHBondContact O-N 2.81Å; F359-L362 PolarHBondContact O-N 2.91Å; L362-T364 VanDerWaalsContact C-N 3.3Å; L362-T364 PolarHBondContact O-N 2.81Å; L362-L365 WeakPolarHBondContact O-CB 3.2Å; L362-L365 PolarHBondContact O-N 3.12Å; L362-Y366 WeakPolarHBondContact O-CB 3.45Å; L362-Y366 PolarHBondContact O-N 3.02Å; L362-I383 HydrophobicContact CD2-CD1 4.3Å; L362-I383 HydrophobicContact CD2-CG2 4.09Å; L362-I383 HydrophobicContact CG-CG2 4.48Å
363L97.6Very high95.9Very high68 Ų6858.1 Ų58.136%0.35628%0.279SS..Hα-helixtrans-73.1-21.6177.1-69.1172.8000113.1K303 F306 F359 N360 W361K303-L363 PolarHBondContact NZ-O 3.01Å; F306-L363 HydrophobicContact CB-CB 4.05Å; F306-L363 HydrophobicContact CD1-CB 3.59Å; F306-L363 HydrophobicContact CD1-CD1 3.69Å; F306-L363 HydrophobicContact CD1-CG 4.3Å; F306-L363 HydrophobicContact CD2-CB 4.21Å; F306-L363 HydrophobicContact CE1-CB 4.08Å; F306-L363 HydrophobicContact CE1-CD1 3.34Å; F306-L363 HydrophobicContact CE1-CG 4.34Å; F306-L363 HydrophobicContact CG-CB 3.67Å; F306-L363 HydrophobicContact CG-CD1 4.48Å; F306-L363 HydrophobicContact CZ-CD1 3.88Å; F359-L363 WeakPolarHBondContact O-CB 3.18Å; F359-L363 WeakPolarHBondContact O-CG 3.03Å; F359-L363 PolarHBondContact O-N 2.95Å; N360-L363 PolarHBondContact O-N 3.43Å; W361-L363 VanDerWaalsContact C-N 3.32Å; W361-L363 PolarHBondContact O-N 3.44Å
364T97.3Very high95.9Very high0 Ų057.2 Ų57.20%027%0.273CS..Hα-helixtrans-72.1-38.6168.6-55.10000110.8I297 P298 K303 L305 F306 N360 W361 L362I297-T364 HydrophobicContact CG2-CG2 3.94Å; P298-T364 HydrophobicContact CB-CG2 4.05Å; K303-T364 VanDerWaalsContact CD-O 3.3Å; K303-T364 WeakPolarHBondContact CD-O 3.3Å; L305-T364 HydrophobicContact CD1-CG2 4.33Å; F306-T364 WeakPolarHBondContact CB-OG1 3.48Å; F306-T364 PolarHBondContact N-OG1 3.32Å; N360-T364 WeakPolarHBondContact O-CB 3.43Å; N360-T364 PolarHBondContact O-N 3.42Å; N360-T364 PolarHBondContact O-OG1 3Å; W361-T364 WeakPolarHBondContact O-CA 3.23Å; W361-T364 WeakPolarHBondContact O-CB 3.48Å; W361-T364 PolarHBondContact O-N 3.3Å; W361-T364 VanDerWaalsContact O-N 3.07Å; L362-T364 VanDerWaalsContact C-N 3.3Å; L362-T364 PolarHBondContact O-N 2.81Å
365L97.4Very high96.1Very high20 Ų2056.1 Ų56.111%0.10527%0.267CS..Hα-helixtrans-70-37.9174-63.3170.5000112.1I297 A301 W361 L362 K367 G368 I370 M376 L380 I383I297-L365 HydrophobicContact CG2-CD2 3.84Å; I297-L365 HydrophobicContact CG2-CG 4.05Å; A301-L365 HydrophobicContact CB-CD2 4.19Å; W361-L365 WeakPolarHBondContact O-CG 3.24Å; W361-L365 PolarHBondContact O-N 3.15Å; L362-L365 WeakPolarHBondContact O-CB 3.2Å; L362-L365 PolarHBondContact O-N 3.12Å; L365-K367 PolarHBondContact O-N 3.04Å; L365-G368 PolarHBondContact O-N 3.37Å; L365-I370 HydrophobicContact CB-CD1 4.19Å; L365-I370 HydrophobicContact CD2-CD1 4Å; L365-I370 HydrophobicContact CD2-CG1 4.27Å; L365-M376 HydrophobicContact CD2-CE 3.2Å; L365-L380 HydrophobicContact CD1-CD2 3.83Å; L365-L380 HydrophobicContact CD2-CD2 4.24Å; L365-I383 HydrophobicContact CD1-CD1 3.81Å
366Y96.8Very high96.3Very high142 Ų14255.2 Ų55.256%0.55726%0.257SS*.THydrogen-bonded Turntrans-60.2126.7-179.7-178.6-112.1000111.8K303 L362 G368K303-Y366 PolarHBondContact NZ-O 2.93Å; L362-Y366 WeakPolarHBondContact O-CB 3.45Å; L362-Y366 PolarHBondContact O-N 3.02Å; Y366-G368 PolarHBondContact O-N 3.33Å
367K94.7Very high96.5Very high167 Ų16753.6 Ų53.673%0.72625%0.246SC*.THydrogen-bonded Turntrans6016-173.6-59.7179.4174.4-177.80114.6L365L365-K367 PolarHBondContact O-N 3.04Å
368G93.3Very high96.6Very high24 Ų2453.6 Ų53.625%0.24725%0.246CC..SBendtrans-81.3169.5167.400000112.3A301 L365 Y366A301-G368 CarbonylContact O-C 3.51Å; A301-G368 VanDerWaalsContact O-CA 3.28Å; A301-G368 WeakPolarHBondContact O-CA 3.46Å; L365-G368 PolarHBondContact O-N 3.37Å; Y366-G368 PolarHBondContact O-N 3.33Å
369R94.7Very high96.8Very high198 Ų19852.7 Ų52.775%0.74724%0.241SC*.  trans-106.987170.3-67.8-172.4-176.9-168.52.7108.6F300 A301 T371F300-R369 VanDerWaalsContact O-O 3.08Å; A301-R369 PolarHBondContact O-N 3.26Å; R369-T371 PolarHBondContact O-N 3.14Å
370I96.1Very high96.9Very high59 Ų5948.3 Ų48.330%0.30322%0.224SC..  trans-75.5124-170.7-54.8168.4000110.3F300 A301 L365 F372 M376F300-I370 WeakPolarHBondContact O-CA 3.16Å; A301-I370 HydrophobicContact CB-CG1 4.48Å; L365-I370 HydrophobicContact CB-CD1 4.19Å; L365-I370 HydrophobicContact CD2-CD1 4Å; L365-I370 HydrophobicContact CD2-CG1 4.27Å; I370-F372 HydrophobicContact CG2-CE1 4.23Å; I370-F372 HydrophobicContact CG2-CZ 4.29Å; I370-M376 HydrophobicContact CG2-CE 3.78Å; I370-M376 HydrophobicContact CG2-CG 4.33Å
371T95.1Very high96.9Very high28 Ų2848.2 Ų48.217%0.17223%0.225CC..  trans-99.8148.6164.853.30000110.6F300 R302 R369 E373 M376F300-T371 PolarHBondContact O-N 3.18Å; F300-T371 PolarHBondContact O-OG1 2.79Å; R302-T371 VanDerWaalsContact NH2-CG2 3.31Å; R369-T371 PolarHBondContact O-N 3.14Å; T371-E373 VanDerWaalsContact CB-CD 3.47Å; T371-E373 WeakPolarHBondContact CB-OE1 3.4Å; T371-E373 WeakPolarHBondContact CB-OE2 3.35Å; T371-E373 PolarHBondContact OG1-OE1 3.18Å; T371-E373 VanDerWaalsContact OG1-OE1 3.05Å; T371-E373 PolarHBondContact OG1-OE2 3.08Å; T371-M376 VanDerWaalsContact O-CG 3.32Å; T371-M376 WeakPolarHBondContact O-CG 3.41Å
372F96Very high96.9Very high119 Ų11948.2 Ų48.252%0.52223%0.225SC..  trans-108.254-170.8-66.2-79.3000112.1I370 L377 L380 K449I370-F372 HydrophobicContact CG2-CE1 4.23Å; I370-F372 HydrophobicContact CG2-CZ 4.29Å; F372-L377 HydrophobicContact CB-CD2 4.21Å; F372-L377 HydrophobicContact CD1-CD2 4Å; F372-L380 HydrophobicContact CD1-CD1 3.81Å; F372-L380 HydrophobicContact CE1-CD1 3.58Å; F372-K449 VanDerWaalsContact O-CE 3.24Å; F372-K449 WeakPolarHBondContact O-CE 3.44Å; F372-K449 PolarHBondContact O-NZ 3.13Å
373E96.2Very high96.9Very high34 Ų3445.2 Ų45.216%0.15921%0.209CC..  trans-70156.7166.1-62.576.7-169.700110.7F300 T371 M376 L377 E445 W528F300-E373 HydrophobicContact CD1-CB 4.36Å; F300-E373 VanDerWaalsContact CD1-CD 3.5Å; F300-E373 HydrophobicContact CD1-CG 4.12Å; F300-E373 WeakPolarHBondContact CD1-OE2 3.29Å; F300-E373 HydrophobicContact CE1-CB 3.97Å; F300-E373 HydrophobicContact CE1-CG 3.71Å; F300-E373 HydrophobicContact CE2-CB 4.46Å; F300-E373 HydrophobicContact CZ-CB 4.02Å; F300-E373 HydrophobicContact CZ-CG 4.22Å; T371-E373 VanDerWaalsContact CB-CD 3.47Å; T371-E373 WeakPolarHBondContact CB-OE1 3.4Å; T371-E373 WeakPolarHBondContact CB-OE2 3.35Å; T371-E373 PolarHBondContact OG1-OE1 3.18Å; T371-E373 VanDerWaalsContact OG1-OE1 3.05Å; T371-E373 PolarHBondContact OG1-OE2 3.08Å; E373-M376 WeakPolarHBondContact O-CA 3.06Å; E373-M376 VanDerWaalsContact O-CB 3.28Å; E373-M376 WeakPolarHBondContact O-CB 3.39Å; E373-M376 PolarHBondContact O-N 3.42Å; E373-L377 PolarHBondContact O-N 2.78Å; E373-E445 WeakPolarHBondContact CA-OE1 3.28Å; E373-W528 HydrophobicContact CB-CZ3 4.28Å; E373-W528 HydrophobicContact CG-CE3 4.32Å; E373-W528 HydrophobicContact CG-CZ3 4.15Å
374S97.4Very high96.9Very high0 Ų045.2 Ų45.20%021%0.213CC..Hα-helixtrans-56.2-43.9-173.8-67.20000114.1M376 L377 F378 E445 N448S374-M376 PolarHBondContact O-N 2.88Å; S374-L377 WeakPolarHBondContact O-CB 3.17Å; S374-L377 PolarHBondContact O-N 3.29Å; S374-F378 VanDerWaalsContact O-CD2 3.28Å; S374-F378 WeakPolarHBondContact O-CD2 3.44Å; S374-F378 PolarHBondContact O-N 2.92Å; S374-E445 WeakPolarHBondContact CB-OE1 3.31Å; S374-E445 PolarHBondContact N-OE1 2.61Å; S374-E445 PolarHBondContact OG-OE1 2.94Å; S374-E445 PolarHBondContact OG-OE2 3.4Å; S374-N448 WeakPolarHBondContact OG-CB 3.28Å
375P97.7Very high96.9Very high0 Ų045.4 Ų45.40%021%0.214CC..Hα-helixtrans-60-35.5174.4-20.431.5000112.9I296 F300 S379 A429 I432 F433 W528I296-P375 HydrophobicContact CD1-CB 3.96Å; I296-P375 HydrophobicContact CG1-CB 4.42Å; I296-P375 HydrophobicContact CG2-CB 3.94Å; F300-P375 HydrophobicContact CE2-CB 4.01Å; F300-P375 HydrophobicContact CE2-CG 4.24Å; P375-S379 PolarHBondContact O-N 3.25Å; P375-S379 VanDerWaalsContact O-N 3.12Å; P375-S379 PolarHBondContact O-OG 3.43Å; P375-A429 HydrophobicContact CB-CB 4.34Å; P375-I432 HydrophobicContact CG-CB 4.07Å; P375-I432 HydrophobicContact CG-CG2 3.75Å; P375-F433 HydrophobicContact CB-CB 4.04Å; P375-F433 HydrophobicContact CB-CD2 4.5Å; P375-F433 HydrophobicContact CG-CB 3.99Å; P375-F433 HydrophobicContact CG-CD2 4.43Å; P375-W528 HydrophobicContact CG-CH2 4.14Å; P375-W528 HydrophobicContact CG-CZ2 4.33Å
376M98Very high96.9Very high0 Ų045.2 Ų45.20%021%0.212CC..Hα-helixtrans-69.5-37.5177.6-170.756.1-172.800111.7I296 I297 F300 L365 I370 T371 E373 S374 S379 L380I296-M376 HydrophobicContact CG2-SD 4.43Å; I297-M376 HydrophobicContact CG1-SD 4.5Å; F300-M376 HydrophobicContact CB-CB 3.98Å; F300-M376 HydrophobicContact CB-CG 3.87Å; F300-M376 HydrophobicContact CB-SD 3.97Å; F300-M376 HydrophobicContact CD2-CB 3.76Å; F300-M376 HydrophobicContact CD2-CG 4.46Å; F300-M376 HydrophobicContact CG-CB 4.06Å; F300-M376 HydrophobicContact CG-CG 4.49Å; L365-M376 HydrophobicContact CD2-CE 3.2Å; I370-M376 HydrophobicContact CG2-CE 3.78Å; I370-M376 HydrophobicContact CG2-CG 4.33Å; T371-M376 VanDerWaalsContact O-CG 3.32Å; T371-M376 WeakPolarHBondContact O-CG 3.41Å; E373-M376 WeakPolarHBondContact O-CA 3.06Å; E373-M376 VanDerWaalsContact O-CB 3.28Å; E373-M376 WeakPolarHBondContact O-CB 3.39Å; E373-M376 PolarHBondContact O-N 3.42Å; S374-M376 PolarHBondContact O-N 2.88Å; M376-S379 WeakPolarHBondContact O-CB 3.38Å; M376-S379 PolarHBondContact O-N 3.39Å; M376-L380 HydrophobicContact CE-CD1 4.15Å; M376-L380 HydrophobicContact CE-CD2 3.63Å; M376-L380 HydrophobicContact CE-CG 3.73Å; M376-L380 HydrophobicContact CG-CD1 4.26Å; M376-L380 HydrophobicContact CG-CG 4.35Å; M376-L380 WeakPolarHBondContact O-CB 3.31Å; M376-L380 WeakPolarHBondContact O-CG 3.46Å; M376-L380 PolarHBondContact O-N 3.32Å; M376-L380 HydrophobicContact SD-CG 4.47Å
377L98.4Very high96.9Very high19 Ų1943 Ų4310%0.09921%0.209CC..Hα-helixtrans-59.9-47.1175.1-66.1177.4000112.2F372 E373 S374 S379 L380 A381 K449 F452F372-L377 HydrophobicContact CB-CD2 4.21Å; F372-L377 HydrophobicContact CD1-CD2 4Å; E373-L377 PolarHBondContact O-N 2.78Å; S374-L377 WeakPolarHBondContact O-CB 3.17Å; S374-L377 PolarHBondContact O-N 3.29Å; L377-S379 VanDerWaalsContact C-N 3.3Å; L377-S379 PolarHBondContact O-N 2.97Å; L377-L380 PolarHBondContact O-N 3.12Å; L377-A381 WeakPolarHBondContact O-CB 3Å; L377-A381 PolarHBondContact O-N 3.46Å; L377-K449 HydrophobicContact CD1-CD 4.39Å; L377-K449 HydrophobicContact CD1-CG 3.8Å; L377-F452 HydrophobicContact CB-CD1 3.91Å; L377-F452 HydrophobicContact CB-CD2 3.8Å; L377-F452 HydrophobicContact CB-CE1 3.92Å; L377-F452 HydrophobicContact CB-CE2 3.8Å; L377-F452 HydrophobicContact CB-CG 3.85Å; L377-F452 HydrophobicContact CB-CZ 3.86Å; L377-F452 HydrophobicContact CD1-CD1 3.89Å; L377-F452 HydrophobicContact CD1-CE1 4.3Å; L377-F452 HydrophobicContact CD1-CG 4.28Å; L377-F452 HydrophobicContact CD2-CE1 4.47Å; L377-F452 HydrophobicContact CG-CD1 4.44Å; L377-F452 HydrophobicContact CG-CE1 4.48Å; L377-F452 WeakPolarHBondContact O-CE2 3Å
378F98.4Very high97Very high0 Ų039.3 Ų39.30%020%0.197CC..Hα-helixtrans-59.5-41.4173.6-77.9-76.4000111.8S374 A381 F382 F425 L428 A429 I432 F452S374-F378 VanDerWaalsContact O-CD2 3.28Å; S374-F378 WeakPolarHBondContact O-CD2 3.44Å; S374-F378 PolarHBondContact O-N 2.92Å; F378-A381 PolarHBondContact O-N 3.18Å; F378-F382 WeakPolarHBondContact O-CB 3.3Å; F378-F382 PolarHBondContact O-N 3.49Å; F378-F425 HydrophobicContact CD1-CB 4.03Å; F378-F425 HydrophobicContact CD1-CD1 4.34Å; F378-F425 AromaticContact CD1-CD2 3.94Å; F378-F425 HydrophobicContact CD1-CD2 3.94Å; F378-F425 AromaticContact CD1-CG 3.83Å; F378-F425 HydrophobicContact CD1-CG 3.83Å; F378-F425 HydrophobicContact CE1-CG 4.48Å; F378-L428 HydrophobicContact CE1-CB 4.24Å; F378-L428 HydrophobicContact CE1-CD1 3.89Å; F378-L428 HydrophobicContact CE2-CB 4.45Å; F378-L428 HydrophobicContact CZ-CB 4.18Å; F378-L428 HydrophobicContact CZ-CD1 4.07Å; F378-A429 HydrophobicContact CB-CB 3.77Å; F378-A429 HydrophobicContact CG-CB 4.37Å; F378-I432 HydrophobicContact CE2-CD1 3.99Å; F378-F452 AromaticContact CD1-CD2 3.95Å; F378-F452 HydrophobicContact CD1-CD2 3.95Å; F378-F452 HydrophobicContact CD2-CD2 4.21Å; F378-F452 HydrophobicContact CE1-CD2 4.08Å; F378-F452 HydrophobicContact CE2-CB 4.01Å; F378-F452 HydrophobicContact CE2-CD2 4.32Å; F378-F452 HydrophobicContact CG-CD2 4.01Å; F378-F452 HydrophobicContact CZ-CB 4Å; F378-F452 HydrophobicContact CZ-CD2 4.26Å
379S98.1Very high97.1Very high0 Ų038.1 Ų38.10%019%0.186CC..Hα-helixtrans-65.7-38.5178.4-55.80000112.9Y293 I296 P375 M376 L377 F382Y293-S379 WeakPolarHBondContact CD1-OG 3.41Å; I296-S379 VanDerWaalsContact CG2-OG 3.23Å; I296-S379 WeakPolarHBondContact CG2-OG 3.43Å; P375-S379 PolarHBondContact O-N 3.25Å; P375-S379 VanDerWaalsContact O-N 3.12Å; P375-S379 PolarHBondContact O-OG 3.43Å; M376-S379 WeakPolarHBondContact O-CB 3.38Å; M376-S379 PolarHBondContact O-N 3.39Å; L377-S379 VanDerWaalsContact C-N 3.3Å; L377-S379 PolarHBondContact O-N 2.97Å; S379-F382 WeakPolarHBondContact O-CB 3.35Å
380L98.1Very high97.2Very high46 Ų4630 Ų3024%0.24116%0.164CC..Hα-helixtrans-69.2-40.1175.2-72.3174000111.7L365 F372 M376 L377 F382 P384L365-L380 HydrophobicContact CD1-CD2 3.83Å; L365-L380 HydrophobicContact CD2-CD2 4.24Å; F372-L380 HydrophobicContact CD1-CD1 3.81Å; F372-L380 HydrophobicContact CE1-CD1 3.58Å; M376-L380 HydrophobicContact CE-CD1 4.15Å; M376-L380 HydrophobicContact CE-CD2 3.63Å; M376-L380 HydrophobicContact CE-CG 3.73Å; M376-L380 HydrophobicContact CG-CD1 4.26Å; M376-L380 HydrophobicContact CG-CG 4.35Å; M376-L380 WeakPolarHBondContact O-CB 3.31Å; M376-L380 WeakPolarHBondContact O-CG 3.46Å; M376-L380 PolarHBondContact O-N 3.32Å; M376-L380 HydrophobicContact SD-CG 4.47Å; L377-L380 PolarHBondContact O-N 3.12Å; L380-F382 VanDerWaalsContact C-N 3.34Å; L380-P384 WeakPolarHBondContact O-CD 3.34Å
381A98.1Very high97.1Very high8 Ų831.1 Ų31.17%0.06617%0.173CC..Hα-helixtrans-69.3-32.1176.300000112.6L377 F378 I383 P384 N385 F425 F452 M456L377-A381 WeakPolarHBondContact O-CB 3Å; L377-A381 PolarHBondContact O-N 3.46Å; F378-A381 PolarHBondContact O-N 3.18Å; A381-I383 VanDerWaalsContact C-N 3.33Å; A381-I383 PolarHBondContact O-N 2.91Å; A381-P384 WeakPolarHBondContact O-CD 3.41Å; A381-N385 PolarHBondContact O-N 2.91Å; A381-N385 PolarHBondContact O-ND2 3.32Å; A381-F425 HydrophobicContact CB-CD2 4.33Å; A381-F425 HydrophobicContact CB-CE2 3.99Å; A381-F452 HydrophobicContact CB-CE2 3.65Å; A381-F452 HydrophobicContact CB-CZ 3.96Å; A381-M456 HydrophobicContact CB-CE 4.39Å; A381-M456 HydrophobicContact CB-CG 4.4Å; A381-M456 HydrophobicContact CB-SD 3.89Å
382F97.9Very high97.2Very high0 Ų030.5 Ų30.50%017%0.169CC..Hα-helixtrans-54.8-46.9175.4152.8-106.9000112.2F290 Y293 L358 W361 F378 S379 L380 N385 F386 T421F290-F382 HydrophobicContact CD1-CE2 4.19Å; F290-F382 AromaticContact CD1-CZ 3.74Å; F290-F382 HydrophobicContact CD1-CZ 3.74Å; F290-F382 AromaticContact CE1-CE2 3.76Å; F290-F382 HydrophobicContact CE1-CE2 3.76Å; F290-F382 AromaticContact CE1-CZ 3.52Å; F290-F382 HydrophobicContact CE1-CZ 3.52Å; Y293-F382 HydrophobicContact CD1-CD1 4.32Å; Y293-F382 AromaticContact CD2-CD1 3.52Å; Y293-F382 HydrophobicContact CD2-CD1 3.52Å; Y293-F382 HydrophobicContact CD2-CD2 4.03Å; Y293-F382 AromaticContact CD2-CE1 3.57Å; Y293-F382 HydrophobicContact CD2-CE1 3.57Å; Y293-F382 HydrophobicContact CD2-CE2 4.06Å; Y293-F382 AromaticContact CD2-CG 3.76Å; Y293-F382 HydrophobicContact CD2-CG 3.76Å; Y293-F382 AromaticContact CD2-CZ 3.85Å; Y293-F382 HydrophobicContact CD2-CZ 3.85Å; Y293-F382 HydrophobicContact CE1-CB 3.91Å; Y293-F382 HydrophobicContact CE1-CD1 4.38Å; Y293-F382 HydrophobicContact CE1-CG 4.15Å; Y293-F382 HydrophobicContact CE2-CB 3.85Å; Y293-F382 AromaticContact CE2-CD1 3.58Å; Y293-F382 HydrophobicContact CE2-CD1 3.58Å; Y293-F382 AromaticContact CE2-CD2 3.33Å; Y293-F382 HydrophobicContact CE2-CD2 3.33Å; Y293-F382 AromaticContact CE2-CE1 3.92Å; Y293-F382 HydrophobicContact CE2-CE1 3.92Å; Y293-F382 AromaticContact CE2-CE2 3.67Å; Y293-F382 HydrophobicContact CE2-CE2 3.67Å; Y293-F382 AromaticContact CE2-CG 3.27Å; Y293-F382 HydrophobicContact CE2-CG 3.27Å; Y293-F382 AromaticContact CE2-CZ 3.97Å; Y293-F382 HydrophobicContact CE2-CZ 3.97Å; Y293-F382 AromaticContact CG-CD1 3.91Å; Y293-F382 HydrophobicContact CG-CD1 3.91Å; Y293-F382 HydrophobicContact CG-CE1 4.17Å; Y293-F382 HydrophobicContact CG-CG 4.37Å; Y293-F382 VanDerWaalsContact CZ-CB 3.47Å; Y293-F382 AromaticContact CZ-CD2 3.83Å; Y293-F382 AromaticContact CZ-CG 3.49Å; Y293-F382 VanDerWaalsContact CZ-CG 3.49Å; Y293-F382 WeakPolarHBondContact OH-CB 3.36Å; L358-F382 HydrophobicContact CD2-CE1 4.42Å; L358-F382 HydrophobicContact CD2-CZ 4.41Å; W361-F382 HydrophobicContact CD2-CE1 4.44Å; W361-F382 AromaticContact CE3-CE1 3.71Å; W361-F382 HydrophobicContact CE3-CE1 3.71Å; W361-F382 HydrophobicContact CE3-CZ 4.29Å; W361-F382 AromaticContact CH2-CE1 3.98Å; W361-F382 HydrophobicContact CH2-CE1 3.98Å; W361-F382 AromaticContact CH2-CZ 3.96Å; W361-F382 HydrophobicContact CH2-CZ 3.96Å; W361-F382 AromaticContact CZ3-CE1 3.48Å; W361-F382 HydrophobicContact CZ3-CE1 3.48Å; W361-F382 VanDerWaalsContact CZ3-CE1 3.48Å; W361-F382 AromaticContact CZ3-CZ 3.6Å; W361-F382 HydrophobicContact CZ3-CZ 3.6Å; F378-F382 WeakPolarHBondContact O-CB 3.3Å; F378-F382 PolarHBondContact O-N 3.49Å; S379-F382 WeakPolarHBondContact O-CB 3.35Å; L380-F382 VanDerWaalsContact C-N 3.34Å; F382-N385 PolarHBondContact O-N 3.48Å; F382-F386 HydrophobicContact CD2-CB 3.55Å; F382-F386 HydrophobicContact CD2-CD2 4.25Å; F382-F386 HydrophobicContact CD2-CG 4Å; F382-F386 HydrophobicContact CE2-CB 3.39Å; F382-F386 AromaticContact CE2-CD1 3.92Å; F382-F386 HydrophobicContact CE2-CD1 3.92Å; F382-F386 AromaticContact CE2-CD2 3.62Å; F382-F386 HydrophobicContact CE2-CD2 3.62Å; F382-F386 HydrophobicContact CE2-CE2 4.4Å; F382-F386 AromaticContact CE2-CG 3.34Å; F382-F386 HydrophobicContact CE2-CG 3.34Å; F382-F386 HydrophobicContact CG-CB 4.5Å; F382-F386 HydrophobicContact CZ-CB 4.2Å; F382-F386 HydrophobicContact CZ-CD1 4.21Å; F382-F386 HydrophobicContact CZ-CG 4.08Å; F382-F386 WeakPolarHBondContact O-CB 3.22Å; F382-F386 PolarHBondContact O-N 3.05Å; F382-T421 VanDerWaalsContact CD2-O 3.29Å; F382-T421 WeakPolarHBondContact CD2-O 3.44Å
383I97.5Very high97.1Very high18 Ų1825.7 Ų25.79%0.09215%0.153CC..Hα-helixtrans-54-57.7-173.3-62.6173000112.9L358 W361 L362 L365 A381 L387L358-I383 HydrophobicContact CD2-CG2 4.34Å; W361-I383 HydrophobicContact CB-CD1 4.43Å; L362-I383 HydrophobicContact CD2-CD1 4.3Å; L362-I383 HydrophobicContact CD2-CG2 4.09Å; L362-I383 HydrophobicContact CG-CG2 4.48Å; L365-I383 HydrophobicContact CD1-CD1 3.81Å; A381-I383 VanDerWaalsContact C-N 3.33Å; A381-I383 PolarHBondContact O-N 2.91Å; I383-L387 WeakPolarHBondContact O-CB 3.43Å; I383-L387 PolarHBondContact O-N 2.96Å; I383-L387 VanDerWaalsContact O-N 3.11Å
384P97.4Very high97Very high67 Ų6727.3 Ų27.344%0.43517%0.165SC..Hα-helixtrans-70.7-39.8-178.727.1-34.8000113.4L380 A381 L387 L388L380-P384 WeakPolarHBondContact O-CD 3.34Å; A381-P384 WeakPolarHBondContact O-CD 3.41Å; P384-L387 WeakPolarHBondContact O-CB 3.38Å; P384-L387 PolarHBondContact O-N 3.38Å; P384-L388 WeakPolarHBondContact O-CG 3.36Å; P384-L388 PolarHBondContact O-N 3.23Å; P384-L388 VanDerWaalsContact O-N 3.08Å
385N98Very high97Very high4 Ų430.4 Ų30.42%0.02118%0.18CC..Hα-helixtrans-68.8-43.2-179.2-67.3-67.3000111.5A381 F382 L387 L388 G389 Y417 T421 M456 F459 N460A381-N385 PolarHBondContact O-N 2.91Å; A381-N385 PolarHBondContact O-ND2 3.32Å; F382-N385 PolarHBondContact O-N 3.48Å; N385-L387 VanDerWaalsContact C-N 3.26Å; N385-L387 PolarHBondContact O-N 3.24Å; N385-L388 PolarHBondContact O-N 2.88Å; N385-G389 PolarHBondContact O-N 2.89Å; N385-Y417 HydrophobicContact CB-CD1 4.34Å; N385-Y417 HydrophobicContact CB-CE1 4.5Å; N385-Y417 WeakPolarHBondContact O-CD1 3.3Å; N385-T421 HydrophobicContact CB-CG2 3.49Å; N385-T421 VanDerWaalsContact CB-CG2 3.49Å; N385-M456 WeakPolarHBondContact ND2-CE 3.24Å; N385-M456 PolarHBondContact ND2-SD 3.46Å; N385-F459 HydrophobicContact CB-CE1 4.42Å; N385-N460 PolarHBondContact OD1-ND2 3.2Å; N385-N460 PolarHBondContact OD1-OD1 2.93Å
386F97.5Very high96.9Very high16 Ų1631.1 Ų31.17%0.0718%0.184CC..Hα-helixtrans-65.8-33.1177.3-171.2-92.2000111.3I286 F290 T354 L358 F382 G389 G390 T418 T421I286-F386 HydrophobicContact CD1-CE2 3.84Å; I286-F386 HydrophobicContact CG1-CE2 4.26Å; I286-F386 HydrophobicContact CG1-CZ 4.47Å; F290-F386 HydrophobicContact CE1-CE1 4.06Å; F290-F386 HydrophobicContact CE1-CE2 4.13Å; F290-F386 AromaticContact CE1-CZ 3.87Å; F290-F386 HydrophobicContact CE1-CZ 3.87Å; F290-F386 AromaticContact CZ-CE1 3.76Å; F290-F386 HydrophobicContact CZ-CE1 3.76Å; F290-F386 HydrophobicContact CZ-CE2 4.13Å; F290-F386 AromaticContact CZ-CZ 3.48Å; F290-F386 HydrophobicContact CZ-CZ 3.48Å; F290-F386 VanDerWaalsContact CZ-CZ 3.48Å; T354-F386 HydrophobicContact CG2-CE1 3.71Å; T354-F386 HydrophobicContact CG2-CZ 4.34Å; L358-F386 HydrophobicContact CD2-CD1 4.49Å; F382-F386 HydrophobicContact CD2-CB 3.55Å; F382-F386 HydrophobicContact CD2-CD2 4.25Å; F382-F386 HydrophobicContact CD2-CG 4Å; F382-F386 HydrophobicContact CE2-CB 3.39Å; F382-F386 AromaticContact CE2-CD1 3.92Å; F382-F386 HydrophobicContact CE2-CD1 3.92Å; F382-F386 AromaticContact CE2-CD2 3.62Å; F382-F386 HydrophobicContact CE2-CD2 3.62Å; F382-F386 HydrophobicContact CE2-CE2 4.4Å; F382-F386 AromaticContact CE2-CG 3.34Å; F382-F386 HydrophobicContact CE2-CG 3.34Å; F382-F386 HydrophobicContact CG-CB 4.5Å; F382-F386 HydrophobicContact CZ-CB 4.2Å; F382-F386 HydrophobicContact CZ-CD1 4.21Å; F382-F386 HydrophobicContact CZ-CG 4.08Å; F382-F386 WeakPolarHBondContact O-CB 3.22Å; F382-F386 PolarHBondContact O-N 3.05Å; F386-G389 PolarHBondContact O-N 3.47Å; F386-G390 PolarHBondContact O-N 2.77Å; F386-T418 HydrophobicContact CE2-CG2 4.36Å; F386-T418 WeakPolarHBondContact CE2-O 3.26Å; F386-T421 PolarHBondContact N-OG1 2.94Å
387L96.8Very high96.9Very high95 Ų9531.2 Ų31.250%0.49719%0.185SC..Hα-helixtrans-61-47.2171179.264.2000111.7L358 I383 P384 N385 G389 G390 V391L358-L387 HydrophobicContact CD1-CD1 4.32Å; I383-L387 WeakPolarHBondContact O-CB 3.43Å; I383-L387 PolarHBondContact O-N 2.96Å; I383-L387 VanDerWaalsContact O-N 3.11Å; P384-L387 WeakPolarHBondContact O-CB 3.38Å; P384-L387 PolarHBondContact O-N 3.38Å; N385-L387 VanDerWaalsContact C-N 3.26Å; N385-L387 PolarHBondContact O-N 3.24Å; L387-G389 VanDerWaalsContact C-N 3.33Å; L387-G389 PolarHBondContact O-N 2.81Å; L387-G390 PolarHBondContact O-N 3.38Å; L387-G390 VanDerWaalsContact O-N 3.14Å; L387-V391 HydrophobicContact CD1-CG2 4.3Å; L387-V391 WeakPolarHBondContact O-CG2 3.37Å; L387-V391 PolarHBondContact O-N 3.21Å
388L96.3Very high96.8Very high90 Ų9034.3 Ų34.347%0.47120%0.2SC..Hα-helixtrans-59.8-43.2175.5-70171.3000111.9P384 N385 T392 Y417P384-L388 WeakPolarHBondContact O-CG 3.36Å; P384-L388 PolarHBondContact O-N 3.23Å; P384-L388 VanDerWaalsContact O-N 3.08Å; N385-L388 PolarHBondContact O-N 2.88Å; L388-T392 WeakPolarHBondContact O-CG2 3.32Å; L388-T392 PolarHBondContact O-N 2.65Å; L388-T392 PolarHBondContact O-OG1 3.18Å; L388-T392 VanDerWaalsContact O-OG1 3.09Å; L388-Y417 HydrophobicContact CB-CD1 4.09Å; L388-Y417 HydrophobicContact CB-CE1 4.26Å; L388-Y417 HydrophobicContact CD1-CE1 4.17Å
389G96.3Very high96.6Very high0 Ų034.8 Ų34.80%020%0.204CC..Hα-helixtrans-61-43.117200000112.5N385 F386 L387 T392 G393 H414 T418N385-G389 PolarHBondContact O-N 2.89Å; F386-G389 PolarHBondContact O-N 3.47Å; L387-G389 VanDerWaalsContact C-N 3.33Å; L387-G389 PolarHBondContact O-N 2.81Å; G389-T392 PolarHBondContact O-N 2.9Å; G389-T392 PolarHBondContact O-OG1 2.89Å; G389-G393 PolarHBondContact O-N 3.17Å; G389-H414 PolarHBondContact O-CE1 2.91Å; G389-H414 PolarHBondContact O-ND1 3.46Å; G389-T418 VanDerWaalsContact C-CG2 3.49Å
390G95.2Very high96.4Very high28 Ų2839.7 Ų39.729%0.28924%0.238SC..Hα-helixtrans-64-44.6179.500000112.7F386 L387 T392 G393 V394F386-G390 PolarHBondContact O-N 2.77Å; L387-G390 PolarHBondContact O-N 3.38Å; L387-G390 VanDerWaalsContact O-N 3.14Å; G390-T392 VanDerWaalsContact C-N 3.33Å; G390-T392 PolarHBondContact O-N 3.31Å; G390-G393 WeakPolarHBondContact O-CA 3.41Å; G390-G393 PolarHBondContact O-N 3.36Å; G390-G393 VanDerWaalsContact O-N 3.1Å; G390-V394 WeakPolarHBondContact O-CG2 3.23Å; G390-V394 PolarHBondContact O-N 3.43Å
391V95.1Very high96.2Very high81 Ų8138.8 Ų38.849%0.49124%0.237SC..Hα-helixtrans-61-43.2177.9172.90000111L387 G393 V394 M395L387-V391 HydrophobicContact CD1-CG2 4.3Å; L387-V391 WeakPolarHBondContact O-CG2 3.37Å; L387-V391 PolarHBondContact O-N 3.21Å; V391-G393 VanDerWaalsContact C-N 3.28Å; V391-G393 PolarHBondContact O-N 3.17Å; V391-V394 PolarHBondContact O-N 2.89Å; V391-M395 PolarHBondContact O-N 3.36Å
392T96.7Very high96.2Very high16 Ų1638.6 Ų38.610%0.09824%0.235CC..Hα-helixtrans-68.8-27.2176.253.20000112.7L388 G389 G390 M395 L396 F410 H414 F467L388-T392 WeakPolarHBondContact O-CG2 3.32Å; L388-T392 PolarHBondContact O-N 2.65Å; L388-T392 PolarHBondContact O-OG1 3.18Å; L388-T392 VanDerWaalsContact O-OG1 3.09Å; G389-T392 PolarHBondContact O-N 2.9Å; G389-T392 PolarHBondContact O-OG1 2.89Å; G390-T392 VanDerWaalsContact C-N 3.33Å; G390-T392 PolarHBondContact O-N 3.31Å; T392-M395 HydrophobicContact CG2-SD 4.43Å; T392-M395 WeakPolarHBondContact O-CB 3.44Å; T392-M395 PolarHBondContact O-N 3.1Å; T392-L396 PolarHBondContact O-N 2.69Å; T392-L396 VanDerWaalsContact O-N 3.15Å; T392-F410 HydrophobicContact CG2-CE2 4.47Å; T392-F410 HydrophobicContact CG2-CZ 3.91Å; T392-H414 PolarHBondContact OG1-ND1 3.34Å; T392-H414 VanDerWaalsContact OG1-ND1 3.13Å; T392-F467 HydrophobicContact CG2-CD1 4.2Å; T392-F467 HydrophobicContact CG2-CE1 3.55Å; T392-F467 HydrophobicContact CG2-CZ 3.76Å
393G94.5Very high96Very high18 Ų1844.5 Ų44.519%0.18626%0.258CS..Hα-helixtrans-69.6-38.2172.100000113.2G389 G390 V391 M395 L396 A397 H414G389-G393 PolarHBondContact O-N 3.17Å; G390-G393 WeakPolarHBondContact O-CA 3.41Å; G390-G393 PolarHBondContact O-N 3.36Å; G390-G393 VanDerWaalsContact O-N 3.1Å; V391-G393 VanDerWaalsContact C-N 3.28Å; V391-G393 PolarHBondContact O-N 3.17Å; G393-M395 PolarHBondContact O-N 3.23Å; G393-L396 PolarHBondContact O-N 2.89Å; G393-A397 PolarHBondContact O-N 2.92Å; G393-H414 WeakPolarHBondContact CA-CE1 3.35Å; G393-H414 WeakPolarHBondContact CA-ND1 3.4Å; G393-H414 PolarHBondContact N-CE1 3.32Å; G393-H414 VanDerWaalsContact N-CE1 3.27Å; G393-H414 PolarHBondContact N-ND1 3.2Å
394V94.1Very high95.9Very high67 Ų6749.9 Ų49.941%0.40628%0.283SS..Hα-helixtrans-62.5-35172.5175.80000110.7G390 V391 A397 M398G390-V394 WeakPolarHBondContact O-CG2 3.23Å; G390-V394 PolarHBondContact O-N 3.43Å; V391-V394 PolarHBondContact O-N 2.89Å; V394-A397 WeakPolarHBondContact O-CB 3.26Å; V394-A397 PolarHBondContact O-N 3.15Å; V394-M398 PolarHBondContact O-N 3.48Å
395M96.1Very high95.7Very high66 Ų6649.4 Ų49.433%0.32527%0.273SS..Hα-helixtrans-64.3-43173-62.117062.800112.1V391 T392 G393 A397 M398 F410V391-M395 PolarHBondContact O-N 3.36Å; T392-M395 HydrophobicContact CG2-SD 4.43Å; T392-M395 WeakPolarHBondContact O-CB 3.44Å; T392-M395 PolarHBondContact O-N 3.1Å; G393-M395 PolarHBondContact O-N 3.23Å; M395-A397 VanDerWaalsContact C-N 3.29Å; M395-A397 PolarHBondContact O-N 3.29Å; M395-M398 WeakPolarHBondContact O-CB 3.08Å; M395-M398 PolarHBondContact O-N 3.43Å; M395-F410 HydrophobicContact CE-CE2 4.34Å; M395-F410 HydrophobicContact CE-CZ 3.78Å; M395-F410 HydrophobicContact SD-CZ 3.99Å
396L96.9Very high95.6Very high15 Ų1551.2 Ų51.28%0.07928%0.281CS..Hα-helixtrans-68.5-26.9176.3-71.3165.3000112.8T392 G393 M398 D402 F410 L411 H414T392-L396 PolarHBondContact O-N 2.69Å; T392-L396 VanDerWaalsContact O-N 3.15Å; G393-L396 PolarHBondContact O-N 2.89Å; L396-M398 PolarHBondContact O-N 3.17Å; L396-D402 VanDerWaalsContact CD2-OD1 3.29Å; L396-D402 WeakPolarHBondContact CD2-OD1 3.13Å; L396-F410 HydrophobicContact CD1-CD1 4.46Å; L396-F410 HydrophobicContact CD1-CE1 4.43Å; L396-F410 HydrophobicContact CD2-CD1 4.11Å; L396-F410 HydrophobicContact CD2-CE1 4.34Å; L396-F410 HydrophobicContact CG-CD1 4.29Å; L396-F410 HydrophobicContact CG-CE1 4.11Å; L396-L411 HydrophobicContact CD1-CD1 3.91Å; L396-H414 HydrophobicContact CD1-CB 3.73Å; L396-H414 WeakPolarHBondContact CD1-CD2 3.45Å; L396-H414 VanDerWaalsContact CD1-CG 3.5Å
397A97Very high95.6Very high2 Ų253.4 Ų53.42%0.01729%0.294CS..Hα-helixtrans-66.2-23.4173.400000112.5S344 T347 M348 G393 V394 M395 A399S344-A397 WeakPolarHBondContact CA-O 3.34Å; S344-A397 VanDerWaalsContact CB-O 3.32Å; S344-A397 WeakPolarHBondContact CB-O 3.06Å; S344-A397 PolarHBondContact OG-O 3.18Å; T347-A397 HydrophobicContact CG2-CB 3.46Å; T347-A397 VanDerWaalsContact CG2-CB 3.46Å; M348-A397 HydrophobicContact CG-CB 3.91Å; G393-A397 PolarHBondContact O-N 2.92Å; V394-A397 WeakPolarHBondContact O-CB 3.26Å; V394-A397 PolarHBondContact O-N 3.15Å; M395-A397 VanDerWaalsContact C-N 3.29Å; M395-A397 PolarHBondContact O-N 3.29Å; A397-A399 PolarHBondContact O-N 2.79Å
398M96Very high95.7Very high83 Ų8349.6 Ų49.641%0.40927%0.274SS..  trans-73.593.9176.4-61.4172.362.800109.7V394 M395 L396 S400 A401 D402V394-M398 PolarHBondContact O-N 3.48Å; M395-M398 WeakPolarHBondContact O-CB 3.08Å; M395-M398 PolarHBondContact O-N 3.43Å; L396-M398 PolarHBondContact O-N 3.17Å; M398-S400 PolarHBondContact O-N 3.21Å; M398-A401 HydrophobicContact CB-CB 4.09Å; M398-A401 PolarHBondContact O-N 2.91Å; M398-D402 PolarHBondContact O-N 3.39Å
399A94.7Very high95.7Very high10 Ų1045.9 Ų45.98%0.08325%0.254CS..Hα-helixtrans-50.8-29.9-178.100000114.3F331 N340 A397 Y403F331-A399 HydrophobicContact CB-CB 4.49Å; F331-A399 HydrophobicContact CD1-CB 3.96Å; F331-A399 HydrophobicContact CD2-CB 3.78Å; F331-A399 HydrophobicContact CE1-CB 3.99Å; F331-A399 HydrophobicContact CE2-CB 3.81Å; F331-A399 HydrophobicContact CG-CB 3.84Å; F331-A399 HydrophobicContact CZ-CB 3.91Å; N340-A399 HydrophobicContact CB-CB 4.12Å; A397-A399 PolarHBondContact O-N 2.79Å; A399-Y403 WeakPolarHBondContact O-CD2 3.23Å; A399-Y403 WeakPolarHBondContact O-CE2 3.35Å
400S93.7Very high95.8Very high103 Ų10346.2 Ų46.272%0.7226%0.255SS*.Hα-helixtrans-71.5-30.5175.753.10000114.2M398M398-S400 PolarHBondContact O-N 3.21Å
401A95.2Very high96Very high27 Ų2746.5 Ų46.522%0.22325%0.25CS..Hα-helixtrans-91.3-27.5178.500000112.2M398 Y403 Q404M398-A401 HydrophobicContact CB-CB 4.09Å; M398-A401 PolarHBondContact O-N 2.91Å; A401-Y403 PolarHBondContact O-N 3.21Å; A401-Q404 WeakPolarHBondContact O-CB 3.34Å; A401-Q404 PolarHBondContact O-N 3.01Å
402D96.4Very high96.1Very high5 Ų543.3 Ų43.33%0.02723%0.231CC..Hα-helixtrans-57.2-36.2-178.3-170.256000111.7F331 L396 M398 Q404 Y405 H406F331-D402 HydrophobicContact CD2-CB 4.04Å; L396-D402 VanDerWaalsContact CD2-OD1 3.29Å; L396-D402 WeakPolarHBondContact CD2-OD1 3.13Å; M398-D402 PolarHBondContact O-N 3.39Å; D402-Q404 PolarHBondContact O-N 2.98Å; D402-Y405 PolarHBondContact O-N 2.99Å; D402-H406 WeakPolarHBondContact O-CA 3.32Å; D402-H406 WeakPolarHBondContact O-CB 3.08Å; D402-H406 PolarHBondContact O-N 3.28Å; D402-H406 IonicContact OD2-CG 2.86Å; D402-H406 IonicContact OD2-ND1 3.28Å; D402-H406 PolarHBondContact OD2-ND1 2.92Å; D402-H406 VanDerWaalsContact OD2-ND1 3.09Å
403Y94.6Very high96.2Very high124 Ų12442.6 Ų42.649%0.48623%0.226SC..Hα-helixtrans-52.4-27.4176.5-72.5-100.6000114.3F331 T332 N340 A399 A401F331-Y403 PolarHBondContact O-OH 3.19Å; T332-Y403 HydrophobicContact CG2-CD1 4.08Å; T332-Y403 HydrophobicContact CG2-CE1 4.41Å; T332-Y403 HydrophobicContact CG2-CG 4.32Å; N340-Y403 PolarHBondContact ND2-OH 3.2Å; A399-Y403 WeakPolarHBondContact O-CD2 3.23Å; A399-Y403 WeakPolarHBondContact O-CE2 3.35Å; A401-Y403 PolarHBondContact O-N 3.21Å
404Q95Very high96.3Very high130 Ų13043.1 Ų43.161%0.60722%0.224SC*.Hα-helixtrans-82.9-39.7178.8-175.763.11700113A401 D402A401-Q404 WeakPolarHBondContact O-CB 3.34Å; A401-Q404 PolarHBondContact O-N 3.01Å; D402-Q404 PolarHBondContact O-N 2.98Å
405Y94.1Very high96.4Very high57 Ų5743 Ų4322%0.22422%0.218CC..Hα-helixtrans-105.8-4.2-172.1-48.5-53.2000113.1D402 N407 T408 F410 L471D402-Y405 PolarHBondContact O-N 2.99Å; Y405-N407 PolarHBondContact O-N 3.44Å; Y405-T408 PolarHBondContact O-N 3.36Å; Y405-T408 VanDerWaalsContact O-N 3.11Å; Y405-T408 PolarHBondContact O-OG1 2.99Å; Y405-F410 HydrophobicContact CG-CD1 4.33Å; Y405-F410 HydrophobicContact CG-CG 4.36Å; Y405-L471 HydrophobicContact CD1-CD2 3.55Å; Y405-L471 HydrophobicContact CE1-CD2 3.08Å; Y405-L471 HydrophobicContact CE1-CG 4.45Å; Y405-L471 HydrophobicContact CE2-CD2 4.38Å; Y405-L471 HydrophobicContact CG-CD2 4.38Å
406H96.5Very high96.5Very high43 Ų4341.2 Ų41.220%0.19921%0.209CC..THydrogen-bonded Turntrans-57.5126.1178.6-17388.5000110.1H329 T332 D402 T408H329-H406 PolarHBondContact O-CE1 2.56Å; T332-H406 HydrophobicContact CG2-CB 3.69Å; T332-H406 PolarHBondContact OG1-CD2 2.93Å; T332-H406 PolarHBondContact OG1-CE1 2.97Å; T332-H406 PolarHBondContact OG1-NE2 2.87Å; D402-H406 WeakPolarHBondContact O-CA 3.32Å; D402-H406 WeakPolarHBondContact O-CB 3.08Å; D402-H406 PolarHBondContact O-N 3.28Å; D402-H406 IonicContact OD2-CG 2.86Å; D402-H406 IonicContact OD2-ND1 3.28Å; D402-H406 PolarHBondContact OD2-ND1 2.92Å; D402-H406 VanDerWaalsContact OD2-ND1 3.09Å; H406-T408 PolarHBondContact O-N 2.9Å; H406-T408 VanDerWaalsContact O-N 3.12Å
407N96.5Very high96.6Very high62 Ų6240.5 Ų40.533%0.33221%0.205SC..THydrogen-bonded Turntrans56.519-177.6-72.5-28.6000116.1Y405 R476Y405-N407 PolarHBondContact O-N 3.44Å; N407-R476 HydrophobicContact CB-CG 4.14Å; N407-R476 WeakPolarHBondContact O-CB 3.37Å; N407-R476 WeakPolarHBondContact O-CG 3.32Å; N407-R476 PolarHBondContact O-N 3.38Å; N407-R476 VanDerWaalsContact OD1-CD 3.3Å; N407-R476 WeakPolarHBondContact OD1-CD 3.48Å; N407-R476 PolarHBondContact OD1-NH1 3.29Å
408T98.1Very high96.6Very high14 Ų1441.8 Ų41.89%0.08621%0.213CC..BIsolated β-bridgetrans-86.1174.8162.279.70000110.7Y405 H406 F410 L411 G470 M474Y405-T408 PolarHBondContact O-N 3.36Å; Y405-T408 VanDerWaalsContact O-N 3.11Å; Y405-T408 PolarHBondContact O-OG1 2.99Å; H406-T408 PolarHBondContact O-N 2.9Å; H406-T408 VanDerWaalsContact O-N 3.12Å; T408-F410 PolarHBondContact O-N 2.92Å; T408-F410 VanDerWaalsContact O-N 3.08Å; T408-F410 WeakPolarHBondContact OG1-CB 3.47Å; T408-F410 PolarHBondContact OG1-N 3.43Å; T408-L411 PolarHBondContact O-N 3.46Å; T408-G470 VanDerWaalsContact CB-O 3.31Å; T408-G470 WeakPolarHBondContact CB-O 3.49Å; T408-G470 WeakPolarHBondContact OG1-CA 3.2Å; T408-G470 PolarHBondContact OG1-O 3.19Å; T408-M474 WeakPolarHBondContact CA-O 3.27Å; T408-M474 WeakPolarHBondContact CB-O 3.42Å
409Y97.8Very high96.6Very high12 Ų1239.5 Ų39.55%0.04720%0.202CC..Hα-helixtrans-60.6-11.5171.6-94.4-94.3000113.9L82 V412 A413 Q466 M474 P475L82-Y409 WeakPolarHBondContact CD1-OH 3.37Å; Y409-V412 HydrophobicContact CD1-CB 4.13Å; Y409-V412 HydrophobicContact CD1-CG1 4.27Å; Y409-V412 HydrophobicContact CD1-CG2 4.44Å; Y409-V412 HydrophobicContact CE1-CG1 4.43Å; Y409-V412 WeakPolarHBondContact O-CB 3.41Å; Y409-V412 PolarHBondContact O-N 2.99Å; Y409-A413 WeakPolarHBondContact O-CB 3.46Å; Y409-A413 PolarHBondContact O-N 2.89Å; Y409-Q466 CarbonylContact C-O 3.27Å; Y409-Q466 WeakPolarHBondContact CB-O 3.33Å; Y409-Q466 HydrophobicContact CD1-CB 4.05Å; Y409-Q466 HydrophobicContact CD1-CG 3.86Å; Y409-Q466 HydrophobicContact CE1-CG 4.4Å; Y409-M474 HydrophobicContact CD2-CB 4.14Å; Y409-M474 HydrophobicContact CD2-CE 4.13Å; Y409-M474 HydrophobicContact CD2-CG 3.64Å; Y409-M474 HydrophobicContact CD2-SD 3.64Å; Y409-M474 HydrophobicContact CE2-CE 3.55Å; Y409-M474 HydrophobicContact CE2-CG 3.96Å; Y409-M474 HydrophobicContact CE2-SD 3.71Å; Y409-M474 HydrophobicContact CG-SD 4.26Å; Y409-M474 PolarHBondContact N-O 3.2Å; Y409-P475 WeakPolarHBondContact CD2-O 3.02Å; Y409-P475 WeakPolarHBondContact CE2-O 3.32Å
410F98.3Very high96.7Very high7 Ų739.9 Ų39.93%0.03120%0.203CC..Hα-helixtrans-65.8-45.3175.3-173.6-86.9000110.7T392 M395 L396 Y405 T408 V412 A413 H414 F467 L471T392-F410 HydrophobicContact CG2-CE2 4.47Å; T392-F410 HydrophobicContact CG2-CZ 3.91Å; M395-F410 HydrophobicContact CE-CE2 4.34Å; M395-F410 HydrophobicContact CE-CZ 3.78Å; M395-F410 HydrophobicContact SD-CZ 3.99Å; L396-F410 HydrophobicContact CD1-CD1 4.46Å; L396-F410 HydrophobicContact CD1-CE1 4.43Å; L396-F410 HydrophobicContact CD2-CD1 4.11Å; L396-F410 HydrophobicContact CD2-CE1 4.34Å; L396-F410 HydrophobicContact CG-CD1 4.29Å; L396-F410 HydrophobicContact CG-CE1 4.11Å; Y405-F410 HydrophobicContact CG-CD1 4.33Å; Y405-F410 HydrophobicContact CG-CG 4.36Å; T408-F410 PolarHBondContact O-N 2.92Å; T408-F410 VanDerWaalsContact O-N 3.08Å; T408-F410 WeakPolarHBondContact OG1-CB 3.47Å; T408-F410 PolarHBondContact OG1-N 3.43Å; F410-V412 VanDerWaalsContact C-N 3.26Å; F410-V412 PolarHBondContact O-N 3.37Å; F410-A413 PolarHBondContact O-N 3.17Å; F410-H414 WeakPolarHBondContact O-CB 3.28Å; F410-H414 PolarHBondContact O-N 3.18Å; F410-F467 HydrophobicContact CD2-CB 4.47Å; F410-F467 AromaticContact CD2-CD1 3.64Å; F410-F467 HydrophobicContact CD2-CD1 3.64Å; F410-F467 HydrophobicContact CD2-CE1 4.45Å; F410-F467 AromaticContact CE2-CD1 3.66Å; F410-F467 HydrophobicContact CE2-CD1 3.66Å; F410-F467 HydrophobicContact CE2-CE1 4.28Å; F410-F467 HydrophobicContact CG-CD1 4.21Å; F410-F467 HydrophobicContact CZ-CD1 4.23Å; F410-F467 HydrophobicContact CZ-CE1 4.41Å; F410-L471 HydrophobicContact CD2-CD2 3.72Å; F410-L471 HydrophobicContact CD2-CG 3.9Å; F410-L471 HydrophobicContact CE2-CD2 4Å; F410-L471 HydrophobicContact CE2-CG 4.33Å
411L97.8Very high96.9Very high34 Ų3435 Ų3518%0.17817%0.169CC..Hα-helixtrans-58.1-43.2171.5175.364.2000110.6L396 T408 H414 F415L396-L411 HydrophobicContact CD1-CD1 3.91Å; T408-L411 PolarHBondContact O-N 3.46Å; L411-H414 PolarHBondContact O-N 2.85Å; L411-F415 WeakPolarHBondContact O-CD1 3.38Å; L411-F415 PolarHBondContact O-N 2.99Å; L411-F415 VanDerWaalsContact O-N 3.1Å
412V97.8Very high97Very high15 Ų1533.7 Ų33.79%0.09116%0.158CC..Hα-helixtrans-62.2-48.7-179.9-176.40000111.3Y409 F410 F415 H416 R476Y409-V412 HydrophobicContact CD1-CB 4.13Å; Y409-V412 HydrophobicContact CD1-CG1 4.27Å; Y409-V412 HydrophobicContact CD1-CG2 4.44Å; Y409-V412 HydrophobicContact CE1-CG1 4.43Å; Y409-V412 WeakPolarHBondContact O-CB 3.41Å; Y409-V412 PolarHBondContact O-N 2.99Å; F410-V412 VanDerWaalsContact C-N 3.26Å; F410-V412 PolarHBondContact O-N 3.37Å; V412-F415 VanDerWaalsContact CA-CE1 3.45Å; V412-F415 HydrophobicContact CB-CE1 4.07Å; V412-F415 HydrophobicContact CG1-CE1 3.98Å; V412-F415 HydrophobicContact CG1-CZ 4.17Å; V412-F415 HydrophobicContact CG2-CE1 4.19Å; V412-F415 WeakPolarHBondContact O-CD1 3.41Å; V412-H416 WeakPolarHBondContact CG1-ND1 3.44Å; V412-H416 PolarHBondContact O-N 3.49Å; V412-H416 VanDerWaalsContact O-N 3.14Å; V412-H416 PolarHBondContact O-ND1 3.33Å; V412-R476 HydrophobicContact CG2-CB 3.81Å
413A98.4Very high97Very high0 Ų033.4 Ų33.40%016%0.157CC..Hα-helixtrans-61.5-46.6177.200000111.6Y409 F410 F415 H416 Y417 Q466 F467Y409-A413 WeakPolarHBondContact O-CB 3.46Å; Y409-A413 PolarHBondContact O-N 2.89Å; F410-A413 PolarHBondContact O-N 3.17Å; A413-F415 PolarHBondContact O-N 3.48Å; A413-H416 PolarHBondContact O-N 3.34Å; A413-Y417 WeakPolarHBondContact O-CD2 3.41Å; A413-Y417 PolarHBondContact O-N 3.44Å; A413-Q466 HydrophobicContact CB-CB 3.86Å; A413-F467 HydrophobicContact CB-CB 4.41Å; A413-F467 HydrophobicContact CB-CD1 3.46Å; A413-F467 VanDerWaalsContact CB-CD1 3.46Å; A413-F467 HydrophobicContact CB-CD2 3.84Å; A413-F467 HydrophobicContact CB-CE1 3.5Å; A413-F467 HydrophobicContact CB-CE2 3.9Å; A413-F467 HydrophobicContact CB-CG 3.63Å; A413-F467 HydrophobicContact CB-CZ 3.73Å
414H97.9Very high97.1Very high30 Ų3027.9 Ų27.914%0.13914%0.136CC..Hα-helixtrans-52.7-56.1177.8164.261.2000111.9G389 T392 G393 L396 F410 L411 H416 Y417 T418 F467G389-H414 PolarHBondContact O-CE1 2.91Å; G389-H414 PolarHBondContact O-ND1 3.46Å; T392-H414 PolarHBondContact OG1-ND1 3.34Å; T392-H414 VanDerWaalsContact OG1-ND1 3.13Å; G393-H414 WeakPolarHBondContact CA-CE1 3.35Å; G393-H414 WeakPolarHBondContact CA-ND1 3.4Å; G393-H414 PolarHBondContact N-CE1 3.32Å; G393-H414 VanDerWaalsContact N-CE1 3.27Å; G393-H414 PolarHBondContact N-ND1 3.2Å; L396-H414 HydrophobicContact CD1-CB 3.73Å; L396-H414 WeakPolarHBondContact CD1-CD2 3.45Å; L396-H414 VanDerWaalsContact CD1-CG 3.5Å; F410-H414 WeakPolarHBondContact O-CB 3.28Å; F410-H414 PolarHBondContact O-N 3.18Å; L411-H414 PolarHBondContact O-N 2.85Å; H414-H416 VanDerWaalsContact C-N 3.31Å; H414-H416 PolarHBondContact O-N 2.99Å; H414-Y417 PolarHBondContact O-N 3.3Å; H414-T418 PolarHBondContact O-N 3.26Å; H414-T418 PolarHBondContact O-OG1 2.92Å; H414-F467 HydrophobicContact CB-CE1 4.15Å
415F96.4Very high97.3Very high65 Ų6521.7 Ų21.729%0.28511%0.107SC..Hα-helixtrans-70.4-29.9-174.283.8-111.4000112L411 V412 A413 T418 L419L411-F415 WeakPolarHBondContact O-CD1 3.38Å; L411-F415 PolarHBondContact O-N 2.99Å; L411-F415 VanDerWaalsContact O-N 3.1Å; V412-F415 VanDerWaalsContact CA-CE1 3.45Å; V412-F415 HydrophobicContact CB-CE1 4.07Å; V412-F415 HydrophobicContact CG1-CE1 3.98Å; V412-F415 HydrophobicContact CG1-CZ 4.17Å; V412-F415 HydrophobicContact CG2-CE1 4.19Å; V412-F415 WeakPolarHBondContact O-CD1 3.41Å; A413-F415 PolarHBondContact O-N 3.48Å; F415-T418 WeakPolarHBondContact CA-OG1 3.44Å; F415-T418 PolarHBondContact O-N 3.22Å; F415-T418 PolarHBondContact O-OG1 3.09Å; F415-L419 WeakPolarHBondContact O-CB 3.46Å; F415-L419 PolarHBondContact O-N 2.98Å
416H98.1Very high97.5Very high28 Ų2819 Ų1913%0.1310%0.096CC..Hα-helixtrans-69.9-35.9173.7-7694.9000111.6V412 A413 H414 V420 F463V412-H416 WeakPolarHBondContact CG1-ND1 3.44Å; V412-H416 PolarHBondContact O-N 3.49Å; V412-H416 VanDerWaalsContact O-N 3.14Å; V412-H416 PolarHBondContact O-ND1 3.33Å; A413-H416 PolarHBondContact O-N 3.34Å; H414-H416 VanDerWaalsContact C-N 3.31Å; H414-H416 PolarHBondContact O-N 2.99Å; H416-V420 HydrophobicContact CB-CG2 4.27Å; H416-V420 WeakPolarHBondContact O-CB 3.49Å; H416-V420 VanDerWaalsContact O-CG2 3.29Å; H416-V420 WeakPolarHBondContact O-CG2 3.41Å; H416-V420 PolarHBondContact O-N 3.39Å; H416-F463 HydrophobicContact CB-CD1 3.56Å; H416-F463 HydrophobicContact CB-CD2 4.16Å; H416-F463 HydrophobicContact CB-CE1 3.56Å; H416-F463 HydrophobicContact CB-CE2 4.15Å; H416-F463 HydrophobicContact CB-CG 3.88Å; H416-F463 HydrophobicContact CB-CZ 3.86Å; H416-F463 AromaticContact CD2-CE1 3.35Å; H416-F463 WeakPolarHBondContact CD2-CE1 3.34Å; H416-F463 AromaticContact CD2-CZ 3.27Å; H416-F463 WeakPolarHBondContact CD2-CZ 3.26Å; H416-F463 AromaticContact CE1-CE1 3.8Å; H416-F463 AromaticContact CG-CD1 3.71Å; H416-F463 AromaticContact CG-CE1 3.21Å; H416-F463 AromaticContact CG-CZ 3.57Å; H416-F463 AromaticContact ND1-CE1 3.54Å; H416-F463 AromaticContact NE2-CE1 3.73Å; H416-F463 AromaticContact NE2-CZ 3.86Å
417Y98.3Very high97.5Very high0 Ų017 Ų170%09%0.088CC..Hα-helixtrans-62.6-43.5171.2-92.6-101.7000112.6N385 L388 A413 H414 T421 F459 N460 F463 F467N385-Y417 HydrophobicContact CB-CD1 4.34Å; N385-Y417 HydrophobicContact CB-CE1 4.5Å; N385-Y417 WeakPolarHBondContact O-CD1 3.3Å; L388-Y417 HydrophobicContact CB-CD1 4.09Å; L388-Y417 HydrophobicContact CB-CE1 4.26Å; L388-Y417 HydrophobicContact CD1-CE1 4.17Å; A413-Y417 WeakPolarHBondContact O-CD2 3.41Å; A413-Y417 PolarHBondContact O-N 3.44Å; H414-Y417 PolarHBondContact O-N 3.3Å; Y417-T421 PolarHBondContact O-OG1 3.06Å; Y417-F459 AromaticContact CD1-CE1 3.82Å; Y417-F459 HydrophobicContact CD1-CE1 3.82Å; Y417-F459 AromaticContact CD1-CZ 3.9Å; Y417-F459 HydrophobicContact CD1-CZ 3.9Å; Y417-F459 HydrophobicContact CD2-CE1 4.18Å; Y417-F459 AromaticContact CD2-CZ 3.62Å; Y417-F459 HydrophobicContact CD2-CZ 3.62Å; Y417-F459 AromaticContact CE1-CE1 3.68Å; Y417-F459 HydrophobicContact CE1-CE1 3.68Å; Y417-F459 HydrophobicContact CE1-CZ 4.1Å; Y417-F459 HydrophobicContact CE2-CE1 4.07Å; Y417-F459 AromaticContact CE2-CZ 3.84Å; Y417-F459 HydrophobicContact CE2-CZ 3.84Å; Y417-F459 HydrophobicContact CG-CE1 4.06Å; Y417-F459 AromaticContact CG-CZ 3.65Å; Y417-F459 HydrophobicContact CG-CZ 3.65Å; Y417-F459 AromaticContact CZ-CE1 3.8Å; Y417-N460 PolarHBondContact OH-OD1 2.99Å; Y417-F463 HydrophobicContact CD2-CB 3.92Å; Y417-F463 HydrophobicContact CE2-CB 3.56Å; Y417-F467 AromaticContact CD2-CE2 3.57Å; Y417-F467 HydrophobicContact CD2-CE2 3.57Å; Y417-F467 AromaticContact CD2-CZ 3.99Å; Y417-F467 HydrophobicContact CD2-CZ 3.99Å; Y417-F467 HydrophobicContact CE2-CD2 4.34Å; Y417-F467 AromaticContact CE2-CE2 3.62Å; Y417-F467 HydrophobicContact CE2-CE2 3.62Å; Y417-F467 HydrophobicContact CE2-CZ 4.48Å; Y417-F467 HydrophobicContact CG-CE2 4.16Å; Y417-F467 HydrophobicContact CG-CZ 4.36Å
418T97.2Very high97.6Very high29 Ų2914.4 Ų14.418%0.1787%0.074CC..Hα-helixtrans-75.5-39.7179.655.30000113.1F386 G389 H414 F415 G422F386-T418 HydrophobicContact CE2-CG2 4.36Å; F386-T418 WeakPolarHBondContact CE2-O 3.26Å; G389-T418 VanDerWaalsContact C-CG2 3.49Å; H414-T418 PolarHBondContact O-N 3.26Å; H414-T418 PolarHBondContact O-OG1 2.92Å; F415-T418 WeakPolarHBondContact CA-OG1 3.44Å; F415-T418 PolarHBondContact O-N 3.22Å; F415-T418 PolarHBondContact O-OG1 3.09Å; T418-G422 WeakPolarHBondContact O-CA 3.15Å; T418-G422 PolarHBondContact O-N 3.37Å
419L96Very high97.6Very high34 Ų3413.7 Ų13.718%0.1787%0.069CC..Hα-helixtrans-86.6-42.2-174.5-166.979.1000113.4I107 V285 F415 V423 V424I107-L419 HydrophobicContact CD1-CD1 4.42Å; I107-L419 HydrophobicContact CD1-CD2 3.32Å; I107-L419 HydrophobicContact CD1-CG 4.49Å; V285-L419 HydrophobicContact CG2-CD1 3.75Å; F415-L419 WeakPolarHBondContact O-CB 3.46Å; F415-L419 PolarHBondContact O-N 2.98Å; L419-V423 HydrophobicContact CD1-CB 4.27Å; L419-V423 HydrophobicContact CD1-CG2 3.7Å; L419-V423 HydrophobicContact CG-CG2 4.37Å; L419-V423 WeakPolarHBondContact O-CA 3.36Å; L419-V423 VanDerWaalsContact O-CB 3.23Å; L419-V423 WeakPolarHBondContact O-CB 3.38Å; L419-V423 PolarHBondContact O-N 3.06Å; L419-V424 PolarHBondContact O-N 3.25Å
420V97.2Very high97.6Very high18 Ų1813.1 Ų13.111%0.1097%0.067CC..Iπ-helixtrans-69.1-49.2-179.7-179.30000109.5H416 V424 F425 F455 F459H416-V420 HydrophobicContact CB-CG2 4.27Å; H416-V420 WeakPolarHBondContact O-CB 3.49Å; H416-V420 VanDerWaalsContact O-CG2 3.29Å; H416-V420 WeakPolarHBondContact O-CG2 3.41Å; H416-V420 PolarHBondContact O-N 3.39Å; V420-V424 HydrophobicContact CG1-CB 4.11Å; V420-V424 HydrophobicContact CG1-CG2 4.47Å; V420-V424 CarbonylContact O-C 3.55Å; V420-V424 WeakPolarHBondContact O-CA 3.28Å; V420-V424 VanDerWaalsContact O-CB 3.28Å; V420-V424 WeakPolarHBondContact O-CB 3.47Å; V420-V424 PolarHBondContact O-N 3.19Å; V420-F425 HydrophobicContact CG1-CD1 4.24Å; V420-F425 HydrophobicContact CG1-CE1 4Å; V420-F425 WeakPolarHBondContact O-CD1 3.31Å; V420-F425 PolarHBondContact O-N 2.94Å; V420-F455 HydrophobicContact CG1-CE1 4.03Å; V420-F459 HydrophobicContact CB-CD2 3.99Å; V420-F459 HydrophobicContact CB-CE2 3.73Å; V420-F459 HydrophobicContact CG1-CD2 3.71Å; V420-F459 HydrophobicContact CG1-CE2 4Å; V420-F459 HydrophobicContact CG2-CD2 4.5Å; V420-F459 HydrophobicContact CG2-CE2 4.18Å
421T97.1Very high97.5Very high0 Ų013.2 Ų13.20%07%0.068CC..Iπ-helixtrans-79.5-28.4-179.276.90000112.6Y293 F382 N385 F386 Y417 F425 F459Y293-T421 PolarHBondContact OH-O 3.29Å; F382-T421 VanDerWaalsContact CD2-O 3.29Å; F382-T421 WeakPolarHBondContact CD2-O 3.44Å; N385-T421 HydrophobicContact CB-CG2 3.49Å; N385-T421 VanDerWaalsContact CB-CG2 3.49Å; F386-T421 PolarHBondContact N-OG1 2.94Å; Y417-T421 PolarHBondContact O-OG1 3.06Å; T421-F425 HydrophobicContact CG2-CD2 4.48Å; T421-F425 HydrophobicContact CG2-CE1 4.33Å; T421-F425 HydrophobicContact CG2-CE2 4.15Å; T421-F425 HydrophobicContact CG2-CZ 4.08Å; T421-F425 WeakPolarHBondContact O-CB 3.46Å; T421-F459 HydrophobicContact CG2-CD1 3.76Å; T421-F459 HydrophobicContact CG2-CE1 3.34Å; T421-F459 HydrophobicContact CG2-CE2 4.18Å; T421-F459 HydrophobicContact CG2-CG 4.38Å; T421-F459 HydrophobicContact CG2-CZ 3.64Å
422G96.7Very high97.5Very high0 Ų011.8 Ų11.80%06%0.06CC..Iπ-helixtrans-73.6-49.8174.100000113.1I286 A289 Y293 T418 A426I286-G422 VanDerWaalsContact CD1-CA 3.43Å; A289-G422 VanDerWaalsContact CB-O 3.26Å; A289-G422 WeakPolarHBondContact CB-O 3.4Å; Y293-G422 WeakPolarHBondContact CE2-O 3.28Å; T418-G422 WeakPolarHBondContact O-CA 3.15Å; T418-G422 PolarHBondContact O-N 3.37Å; G422-A426 WeakPolarHBondContact O-CB 3.4Å
423V97.6Very high97.4Very high0 Ų011 Ų110%06%0.056CC..Iπ-helixtrans-104.9-55.2-171.1-175.50000112.1A111 V285 I286 A289 L419 F425 A426 C427A111-V423 HydrophobicContact CB-CG1 4.17Å; V285-V423 HydrophobicContact CB-CG1 4.27Å; V285-V423 HydrophobicContact CB-CG2 4.07Å; V285-V423 HydrophobicContact CG2-CG2 4.02Å; I286-V423 HydrophobicContact CB-CG2 4.38Å; I286-V423 HydrophobicContact CD1-CG2 3.73Å; A289-V423 HydrophobicContact CB-CG2 4.33Å; L419-V423 HydrophobicContact CD1-CB 4.27Å; L419-V423 HydrophobicContact CD1-CG2 3.7Å; L419-V423 HydrophobicContact CG-CG2 4.37Å; L419-V423 WeakPolarHBondContact O-CA 3.36Å; L419-V423 VanDerWaalsContact O-CB 3.23Å; L419-V423 WeakPolarHBondContact O-CB 3.38Å; L419-V423 PolarHBondContact O-N 3.06Å; V423-F425 PolarHBondContact O-N 3.14Å; V423-A426 CarbonylContact O-C 3.55Å; V423-A426 WeakPolarHBondContact O-CB 3.45Å; V423-A426 PolarHBondContact O-N 3.25Å; V423-A426 VanDerWaalsContact O-N 3.08Å; V423-C427 WeakPolarHBondContact O-CB 3.28Å; V423-C427 PolarHBondContact O-N 2.95Å; V423-C427 PolarHBondContact O-SG 3.42Å
424V97.3Very high97.4Very high7 Ų711.1 Ų11.14%0.0426%0.056CC..Iπ-helixtrans-62.6-44.9-174.8177.50000111.1F68 M110 L419 V420 A426 C427 L428 F455F68-V424 HydrophobicContact CE2-CG1 3.61Å; F68-V424 HydrophobicContact CE2-CG2 4.36Å; F68-V424 HydrophobicContact CZ-CG1 3.87Å; M110-V424 HydrophobicContact CE-CG2 3.96Å; L419-V424 PolarHBondContact O-N 3.25Å; V420-V424 HydrophobicContact CG1-CB 4.11Å; V420-V424 HydrophobicContact CG1-CG2 4.47Å; V420-V424 CarbonylContact O-C 3.55Å; V420-V424 WeakPolarHBondContact O-CA 3.28Å; V420-V424 VanDerWaalsContact O-CB 3.28Å; V420-V424 WeakPolarHBondContact O-CB 3.47Å; V420-V424 PolarHBondContact O-N 3.19Å; V424-A426 VanDerWaalsContact C-N 3.27Å; V424-A426 PolarHBondContact O-N 3.44Å; V424-C427 WeakPolarHBondContact O-CB 3.39Å; V424-C427 PolarHBondContact O-N 3.49Å; V424-L428 HydrophobicContact CG1-CD1 4.29Å; V424-L428 HydrophobicContact CG1-CG 4.38Å; V424-L428 WeakPolarHBondContact O-CG 3.24Å; V424-L428 PolarHBondContact O-N 3.18Å; V424-F455 HydrophobicContact CG1-CE1 4.47Å; V424-F455 HydrophobicContact CG1-CZ 4.29Å
425F98.1Very high97.3Very high0 Ų010.5 Ų10.50%05%0.053CC..Hα-helixtrans-61.2-37.9175.5-79.630.2000111.3Y293 F378 A381 V420 T421 V423 L428 A429 F455 M456 F459Y293-F425 WeakPolarHBondContact OH-CB 3.4Å; F378-F425 HydrophobicContact CD1-CB 4.03Å; F378-F425 HydrophobicContact CD1-CD1 4.34Å; F378-F425 AromaticContact CD1-CD2 3.94Å; F378-F425 HydrophobicContact CD1-CD2 3.94Å; F378-F425 AromaticContact CD1-CG 3.83Å; F378-F425 HydrophobicContact CD1-CG 3.83Å; F378-F425 HydrophobicContact CE1-CG 4.48Å; A381-F425 HydrophobicContact CB-CD2 4.33Å; A381-F425 HydrophobicContact CB-CE2 3.99Å; V420-F425 HydrophobicContact CG1-CD1 4.24Å; V420-F425 HydrophobicContact CG1-CE1 4Å; V420-F425 WeakPolarHBondContact O-CD1 3.31Å; V420-F425 PolarHBondContact O-N 2.94Å; T421-F425 HydrophobicContact CG2-CD2 4.48Å; T421-F425 HydrophobicContact CG2-CE1 4.33Å; T421-F425 HydrophobicContact CG2-CE2 4.15Å; T421-F425 HydrophobicContact CG2-CZ 4.08Å; T421-F425 WeakPolarHBondContact O-CB 3.46Å; V423-F425 PolarHBondContact O-N 3.14Å; F425-L428 PolarHBondContact O-N 2.82Å; F425-A429 WeakPolarHBondContact O-CB 3.46Å; F425-A429 PolarHBondContact O-N 3.18Å; F425-F455 HydrophobicContact CD1-CD1 4.28Å; F425-F455 HydrophobicContact CD1-CE1 4.23Å; F425-F455 AromaticContact CE1-CD1 3.53Å; F425-F455 HydrophobicContact CE1-CD1 3.53Å; F425-F455 AromaticContact CE1-CE1 3.69Å; F425-F455 HydrophobicContact CE1-CE1 3.69Å; F425-F455 HydrophobicContact CZ-CD1 4.24Å; F425-M456 HydrophobicContact CE2-SD 4.07Å; F425-M456 HydrophobicContact CZ-SD 4.27Å; F425-F459 HydrophobicContact CZ-CB 4.5Å; F425-F459 HydrophobicContact CZ-CG 4.47Å
426A98.3Very high97.3Very high0 Ų07.4 Ų7.40%04%0.039CC..Hα-helixtrans-68.2-39.9176.700000111.5A289 I292 Y293 G422 V423 V424 A429 G430A289-A426 HydrophobicContact CB-CB 3.57Å; I292-A426 HydrophobicContact CB-CB 4.42Å; I292-A426 HydrophobicContact CD1-CB 4.24Å; Y293-A426 HydrophobicContact CD2-CB 4.35Å; Y293-A426 HydrophobicContact CE1-CB 4.03Å; Y293-A426 HydrophobicContact CE2-CB 3.72Å; Y293-A426 PolarHBondContact OH-N 3.02Å; G422-A426 WeakPolarHBondContact O-CB 3.4Å; V423-A426 CarbonylContact O-C 3.55Å; V423-A426 WeakPolarHBondContact O-CB 3.45Å; V423-A426 PolarHBondContact O-N 3.25Å; V423-A426 VanDerWaalsContact O-N 3.08Å; V424-A426 VanDerWaalsContact C-N 3.27Å; V424-A426 PolarHBondContact O-N 3.44Å; A426-A429 PolarHBondContact O-N 3.05Å; A426-G430 WeakPolarHBondContact O-CA 3.45Å; A426-G430 PolarHBondContact O-N 3.5Å
427C97.6Very high97.1Very high2 Ų26.4 Ų6.41%0.0143%0.034CC..Hα-helixtrans-61.7-46.8174.4-71.80000111F114 V423 V424 G430 L431F114-C427 HydrophobicContact CD1-CB 3.53Å; F114-C427 HydrophobicContact CD2-CB 4.05Å; F114-C427 HydrophobicContact CE1-CB 3.54Å; F114-C427 WeakPolarHBondContact CE1-O 3.45Å; F114-C427 HydrophobicContact CE2-CB 4.05Å; F114-C427 HydrophobicContact CG-CB 3.79Å; F114-C427 HydrophobicContact CZ-CB 3.79Å; F114-C427 WeakPolarHBondContact CZ-O 3.3Å; V423-C427 WeakPolarHBondContact O-CB 3.28Å; V423-C427 PolarHBondContact O-N 2.95Å; V423-C427 PolarHBondContact O-SG 3.42Å; V424-C427 WeakPolarHBondContact O-CB 3.39Å; V424-C427 PolarHBondContact O-N 3.49Å; C427-G430 PolarHBondContact O-N 3.31Å; C427-L431 VanDerWaalsContact O-CB 3.26Å; C427-L431 WeakPolarHBondContact O-CB 3.4Å; C427-L431 PolarHBondContact O-N 2.84Å
428L97.1Very high96.9Very high7 Ų77.3 Ų7.34%0.0374%0.039CC..Hα-helixtrans-63.9-45.2176.1-65.8-178.1000111.8F378 V424 F425 L431 I432 L508F378-L428 HydrophobicContact CE1-CB 4.24Å; F378-L428 HydrophobicContact CE1-CD1 3.89Å; F378-L428 HydrophobicContact CE2-CB 4.45Å; F378-L428 HydrophobicContact CZ-CB 4.18Å; F378-L428 HydrophobicContact CZ-CD1 4.07Å; V424-L428 HydrophobicContact CG1-CD1 4.29Å; V424-L428 HydrophobicContact CG1-CG 4.38Å; V424-L428 WeakPolarHBondContact O-CG 3.24Å; V424-L428 PolarHBondContact O-N 3.18Å; F425-L428 PolarHBondContact O-N 2.82Å; L428-L431 PolarHBondContact O-N 3.34Å; L428-I432 WeakPolarHBondContact O-CG1 3.47Å; L428-I432 PolarHBondContact O-N 2.95Å; L428-I432 VanDerWaalsContact O-N 3.09Å; L428-L508 HydrophobicContact CD2-CD2 3.65Å
429A98.1Very high96.8Very high0 Ų09 Ų90%05%0.046CC..Hα-helixtrans-62.3-46.5177.200000111.4I296 P375 F378 F425 A426 I432 F433I296-A429 HydrophobicContact CD1-CB 3.62Å; P375-A429 HydrophobicContact CB-CB 4.34Å; F378-A429 HydrophobicContact CB-CB 3.77Å; F378-A429 HydrophobicContact CG-CB 4.37Å; F425-A429 WeakPolarHBondContact O-CB 3.46Å; F425-A429 PolarHBondContact O-N 3.18Å; A426-A429 PolarHBondContact O-N 3.05Å; A429-I432 PolarHBondContact O-N 2.82Å; A429-F433 WeakPolarHBondContact O-CB 3.4Å; A429-F433 PolarHBondContact O-N 3.41Å
430G97.6Very high96.6Very high0 Ų07.6 Ų7.60%04%0.04CC..Hα-helixtrans-64-41.4177.400000112.6A426 C427 I432 F433 W434A426-G430 WeakPolarHBondContact O-CA 3.45Å; A426-G430 PolarHBondContact O-N 3.5Å; C427-G430 PolarHBondContact O-N 3.31Å; G430-I432 PolarHBondContact O-N 3.45Å; G430-F433 PolarHBondContact O-N 3.44Å; G430-W434 PolarHBondContact O-N 3.35Å
431L97Very high96.5Very high9 Ų96.9 Ų6.95%0.0474%0.035CC..Hα-helixtrans-57.8-48.8174.418070.8000111.2L61 F114 C427 L428 Y435 M438 L508L61-L431 HydrophobicContact CD1-CD1 4.44Å; F114-L431 HydrophobicContact CE1-CB 4.15Å; F114-L431 HydrophobicContact CZ-CB 3.84Å; F114-L431 HydrophobicContact CZ-CD1 4.37Å; F114-L431 HydrophobicContact CZ-CD2 4.23Å; F114-L431 HydrophobicContact CZ-CG 4.37Å; C427-L431 VanDerWaalsContact O-CB 3.26Å; C427-L431 WeakPolarHBondContact O-CB 3.4Å; C427-L431 PolarHBondContact O-N 2.84Å; L428-L431 PolarHBondContact O-N 3.34Å; L431-Y435 HydrophobicContact CD1-CD2 4.2Å; L431-Y435 HydrophobicContact CD1-CE2 4.48Å; L431-Y435 HydrophobicContact CG-CD2 4.28Å; L431-Y435 WeakPolarHBondContact O-CA 3.13Å; L431-Y435 WeakPolarHBondContact O-CB 3.47Å; L431-Y435 PolarHBondContact O-N 3.03Å; L431-M438 HydrophobicContact CD1-CE 4Å; L431-L508 HydrophobicContact CD2-CD2 4.37Å
432I97.2Very high96.3Very high3 Ų39.2 Ų9.22%0.0155%0.045CC..Hα-helixtrans-67.3-44.1178.8-62.2164.3000110.2P375 F378 L428 A429 G430 Y435 L443 N448 L508 W528P375-I432 HydrophobicContact CG-CB 4.07Å; P375-I432 HydrophobicContact CG-CG2 3.75Å; F378-I432 HydrophobicContact CE2-CD1 3.99Å; L428-I432 WeakPolarHBondContact O-CG1 3.47Å; L428-I432 PolarHBondContact O-N 2.95Å; L428-I432 VanDerWaalsContact O-N 3.09Å; A429-I432 PolarHBondContact O-N 2.82Å; G430-I432 PolarHBondContact O-N 3.45Å; I432-Y435 PolarHBondContact O-N 2.86Å; I432-L443 HydrophobicContact CG1-CD1 4.08Å; I432-N448 HydrophobicContact CD1-CB 4.24Å; I432-L508 HydrophobicContact CD1-CD1 4.44Å; I432-L508 HydrophobicContact CG1-CD1 4.38Å; I432-W528 HydrophobicContact CG2-CH2 4.43Å
433F97.3Very high96.3Very high0 Ų09.7 Ų9.70%05%0.048CC..Hα-helixtrans-61.6-48.1-176.9-174.5-123.1000112.4E295 I296 T299 F300 P375 A429 G430 W528 W537E295-F433 HydrophobicContact CB-CE1 4.46Å; I296-F433 HydrophobicContact CD1-CB 4.25Å; I296-F433 HydrophobicContact CD1-CG 4.42Å; I296-F433 HydrophobicContact CG1-CB 4.29Å; I296-F433 HydrophobicContact CG1-CD1 3.89Å; I296-F433 HydrophobicContact CG1-CD2 4.31Å; I296-F433 HydrophobicContact CG1-CE1 4.26Å; I296-F433 HydrophobicContact CG1-CG 3.92Å; T299-F433 HydrophobicContact CG2-CE2 3.98Å; T299-F433 HydrophobicContact CG2-CZ 4.08Å; F300-F433 AromaticContact CE2-CD2 3.8Å; F300-F433 HydrophobicContact CE2-CD2 3.8Å; F300-F433 AromaticContact CE2-CE2 3.83Å; F300-F433 HydrophobicContact CE2-CE2 3.83Å; F300-F433 AromaticContact CZ-CD2 3.93Å; F300-F433 HydrophobicContact CZ-CD2 3.93Å; F300-F433 AromaticContact CZ-CE2 3.9Å; F300-F433 HydrophobicContact CZ-CE2 3.9Å; P375-F433 HydrophobicContact CB-CB 4.04Å; P375-F433 HydrophobicContact CB-CD2 4.5Å; P375-F433 HydrophobicContact CG-CB 3.99Å; P375-F433 HydrophobicContact CG-CD2 4.43Å; A429-F433 WeakPolarHBondContact O-CB 3.4Å; A429-F433 PolarHBondContact O-N 3.41Å; G430-F433 PolarHBondContact O-N 3.44Å; F433-W528 AromaticContact CD2-CD1 3.9Å; F433-W528 HydrophobicContact CD2-CD2 4.43Å; F433-W528 AromaticContact CD2-CE2 3.75Å; F433-W528 HydrophobicContact CD2-CZ2 4.19Å; F433-W528 AromaticContact CD2-NE1 3.36Å; F433-W528 AromaticContact CE2-CD1 3.6Å; F433-W528 HydrophobicContact CE2-CG 4.23Å; F433-W528 AromaticContact CE2-NE1 3.57Å; F433-W528 WeakPolarHBondContact O-CZ2 3.45Å; F433-W528 PolarHBondContact O-NE1 3.21Å; F433-W537 HydrophobicContact CD1-CZ2 4.04Å; F433-W537 HydrophobicContact CE1-CH2 4.44Å; F433-W537 AromaticContact CE1-CZ2 3.5Å; F433-W537 HydrophobicContact CE1-CZ2 3.5Å; F433-W537 VanDerWaalsContact CE1-CZ2 3.5Å; F433-W537 HydrophobicContact CE2-CZ2 4.05Å; F433-W537 HydrophobicContact CZ-CH2 4.38Å; F433-W537 AromaticContact CZ-CZ2 3.49Å; F433-W537 HydrophobicContact CZ-CZ2 3.49Å; F433-W537 VanDerWaalsContact CZ-CZ2 3.49Å; F433-W537 WeakPolarHBondContact O-CH2 3.27Å
434W97.2Very high96.2Very high1 Ų111.5 Ų11.50%0.0046%0.057CC..Hα-helixtrans-954.9179.6-65.6-67.3000113.9L118 V122 F223 I292 E295 G430 P436 K437 M438 E536 W537L118-W434 HydrophobicContact CD1-CE3 4.47Å; L118-W434 HydrophobicContact CD1-CZ3 4.22Å; L118-W434 HydrophobicContact CD2-CE3 3.98Å; L118-W434 HydrophobicContact CD2-CZ3 4.49Å; V122-W434 HydrophobicContact CG1-CZ2 3.99Å; V122-W434 HydrophobicContact CG2-CB 4.33Å; V122-W434 HydrophobicContact CG2-CD2 3.61Å; V122-W434 HydrophobicContact CG2-CE3 4.12Å; V122-W434 HydrophobicContact CG2-CG 3.69Å; V122-W434 HydrophobicContact CG2-CZ2 4.39Å; F223-W434 HydrophobicContact CD1-CH2 4.45Å; F223-W434 HydrophobicContact CG-CH2 4.43Å; I292-W434 HydrophobicContact CB-CH2 4.18Å; I292-W434 HydrophobicContact CB-CZ3 4.29Å; I292-W434 HydrophobicContact CD1-CZ3 4.33Å; I292-W434 HydrophobicContact CG1-CH2 3.92Å; I292-W434 HydrophobicContact CG1-CZ3 3.84Å; I292-W434 HydrophobicContact CG2-CH2 3.9Å; I292-W434 HydrophobicContact CG2-CZ3 3.75Å; E295-W434 HydrophobicContact CB-CZ2 4.39Å; G430-W434 PolarHBondContact O-N 3.35Å; W434-P436 VanDerWaalsContact C-CD 3.43Å; W434-P436 VanDerWaalsContact C-N 3.32Å; W434-K437 WeakPolarHBondContact O-CA 3.24Å; W434-K437 WeakPolarHBondContact O-CB 3.45Å; W434-K437 PolarHBondContact O-N 3.37Å; W434-M438 PolarHBondContact O-N 3.12Å; W434-E536 PolarHBondContact NE1-OE1 2.97Å; W434-W537 AromaticContact CD1-CH2 3.75Å; W434-W537 AromaticContact CD1-CZ2 3.53Å; W434-W537 AromaticContact NE1-CZ2 3.62Å
435Y96.2Very high96.2Very high17 Ų1713.6 Ų13.67%0.0677%0.067CC..Hα-helixtrans-51.9-43.9177.3-150.8-91.1000113.7L431 I432 K437 M438 M439 Y441 L443 I512L431-Y435 HydrophobicContact CD1-CD2 4.2Å; L431-Y435 HydrophobicContact CD1-CE2 4.48Å; L431-Y435 HydrophobicContact CG-CD2 4.28Å; L431-Y435 WeakPolarHBondContact O-CA 3.13Å; L431-Y435 WeakPolarHBondContact O-CB 3.47Å; L431-Y435 PolarHBondContact O-N 3.03Å; I432-Y435 PolarHBondContact O-N 2.86Å; Y435-K437 PolarHBondContact O-N 2.97Å; Y435-M438 HydrophobicContact CD2-CE 4.11Å; Y435-M438 PolarHBondContact O-N 3.08Å; Y435-M439 HydrophobicContact CD1-CB 4.06Å; Y435-M439 HydrophobicContact CD1-CG 4.05Å; Y435-M439 HydrophobicContact CE1-CB 3.67Å; Y435-M439 HydrophobicContact CE1-CG 3.49Å; Y435-M439 VanDerWaalsContact CE1-CG 3.49Å; Y435-M439 HydrophobicContact CE2-CG 4.41Å; Y435-M439 PolarHBondContact O-N 2.9Å; Y435-Y441 HydrophobicContact CD1-CD2 4.45Å; Y435-Y441 HydrophobicContact CD1-CE2 4.22Å; Y435-Y441 HydrophobicContact CE1-CD2 4.17Å; Y435-Y441 AromaticContact CE1-CE2 3.51Å; Y435-Y441 HydrophobicContact CE1-CE2 3.51Å; Y435-Y441 AromaticContact CE1-CZ 3.81Å; Y435-L443 HydrophobicContact CD1-CD1 4.4Å; Y435-L443 HydrophobicContact CD1-CD2 3.73Å; Y435-L443 HydrophobicContact CD1-CG 3.71Å; Y435-L443 HydrophobicContact CD2-CD1 3.74Å; Y435-L443 HydrophobicContact CD2-CD2 4.24Å; Y435-L443 HydrophobicContact CD2-CG 3.98Å; Y435-L443 HydrophobicContact CE1-CD2 3.54Å; Y435-L443 HydrophobicContact CE1-CG 4.07Å; Y435-L443 HydrophobicContact CE2-CD1 4.11Å; Y435-L443 HydrophobicContact CE2-CD2 4.07Å; Y435-L443 HydrophobicContact CE2-CG 4.31Å; Y435-L443 HydrophobicContact CG-CD1 3.89Å; Y435-L443 HydrophobicContact CG-CD2 4.07Å; Y435-L443 HydrophobicContact CG-CG 3.66Å; Y435-I512 HydrophobicContact CE2-CG1 4.39Å
436P95.4Very high96.1Very high0 Ų017.8 Ų17.80%09%0.092CC..Hα-helixtrans-59.8-29.1176.5-24.636.2000113.2W434 M438 G440 Y441 K442 N527W434-P436 VanDerWaalsContact C-CD 3.43Å; W434-P436 VanDerWaalsContact C-N 3.32Å; P436-M438 VanDerWaalsContact C-N 3.34Å; P436-G440 WeakPolarHBondContact O-CA 3.47Å; P436-G440 PolarHBondContact O-N 3.36Å; P436-Y441 WeakPolarHBondContact CA-O 3.28Å; P436-K442 HydrophobicContact CG-CB 4.48Å; P436-K442 HydrophobicContact CG-CG 3.59Å; P436-N527 HydrophobicContact CB-CB 3.64Å; P436-N527 HydrophobicContact CG-CB 3.97Å
437K94.7Very high96Very high7 Ų719.2 Ų19.23%0.0310%0.1CC..Hα-helixtrans-73.2-24.9176.6-67.1-39.9-176.5-166.80115W434 Y435 G525 N527 E536 W537 T539 S541 A542W434-K437 WeakPolarHBondContact O-CA 3.24Å; W434-K437 WeakPolarHBondContact O-CB 3.45Å; W434-K437 PolarHBondContact O-N 3.37Å; Y435-K437 PolarHBondContact O-N 2.97Å; K437-G525 WeakPolarHBondContact CE-O 3.29Å; K437-G525 PolarHBondContact NZ-O 3.37Å; K437-N527 WeakPolarHBondContact CE-OD1 3.45Å; K437-N527 PolarHBondContact NZ-OD1 3.21Å; K437-E536 WeakPolarHBondContact CE-O 3.5Å; K437-W537 HydrophobicContact CD-CZ3 4.27Å; K437-W537 HydrophobicContact CG-CH2 4.32Å; K437-W537 HydrophobicContact CG-CZ3 4.03Å; K437-T539 PolarHBondContact NZ-OG1 2.82Å; K437-S541 PolarHBondContact NZ-O 2.96Å; K437-A542 WeakPolarHBondContact CA-O 3.41Å; K437-A542 WeakPolarHBondContact CD-O 3.27Å; K437-A542 PolarHBondContact NZ-O 3.46Å
438M94.4Very high96Very high19 Ų1919.1 Ų19.19%0.09410%0.099CC..Hα-helixtrans-90.2-41.5178.8-63.2178.9-76.900111.6I58 L61 I121 L431 W434 Y435 P436I58-M438 HydrophobicContact CD1-CB 4.36Å; I58-M438 HydrophobicContact CG1-CB 4.33Å; I58-M438 HydrophobicContact CG1-CG 4.34Å; L61-M438 HydrophobicContact CD1-CE 4.12Å; L61-M438 HydrophobicContact CD1-SD 3.27Å; L61-M438 WeakPolarHBondContact CD1-SD 3.26Å; I121-M438 HydrophobicContact CD1-CG 3.72Å; I121-M438 HydrophobicContact CD1-SD 3.31Å; I121-M438 WeakPolarHBondContact CD1-SD 3.37Å; I121-M438 HydrophobicContact CG1-CG 4.4Å; I121-M438 HydrophobicContact CG2-CG 4.02Å; L431-M438 HydrophobicContact CD1-CE 4Å; W434-M438 PolarHBondContact O-N 3.12Å; Y435-M438 HydrophobicContact CD2-CE 4.11Å; Y435-M438 PolarHBondContact O-N 3.08Å; P436-M438 VanDerWaalsContact C-N 3.34Å
439M94.1Very high96.1Very high65 Ų6522.5 Ų22.532%0.3211%0.113SC..Hα-helixtrans-120.3-9.7-165.6-53.9-61.9-93.900114.3Y435 Y441 R521Y435-M439 HydrophobicContact CD1-CB 4.06Å; Y435-M439 HydrophobicContact CD1-CG 4.05Å; Y435-M439 HydrophobicContact CE1-CB 3.67Å; Y435-M439 HydrophobicContact CE1-CG 3.49Å; Y435-M439 VanDerWaalsContact CE1-CG 3.49Å; Y435-M439 HydrophobicContact CE2-CG 4.41Å; Y435-M439 PolarHBondContact O-N 2.9Å; M439-Y441 HydrophobicContact CB-CD1 3.97Å; M439-Y441 HydrophobicContact CB-CE1 3.45Å; M439-Y441 VanDerWaalsContact CB-CE1 3.45Å; M439-Y441 HydrophobicContact CB-CE2 4.5Å; M439-Y441 WeakPolarHBondContact O-CD1 3.18Å; M439-Y441 VanDerWaalsContact O-CE1 3.3Å; M439-Y441 WeakPolarHBondContact O-CE1 3.47Å; M439-R521 PolarHBondContact O-NH1 3.5Å
440G93.3Very high96.1Very high5 Ų528.7 Ų28.75%0.05214%0.137CC..SBendtrans7719.9177.500000115.1P436 R521 E522P436-G440 WeakPolarHBondContact O-CA 3.47Å; P436-G440 PolarHBondContact O-N 3.36Å; G440-R521 WeakPolarHBondContact O-CA 3.45Å; G440-E522 PolarHBondContact O-N 3.23Å
441Y93.5Very high96.1Very high3 Ų328.7 Ų28.71%0.01214%0.137CC..SBendtrans-152.9155.917554.9-88.4000111Y435 P436 M439 H516 P520Y435-Y441 HydrophobicContact CD1-CD2 4.45Å; Y435-Y441 HydrophobicContact CD1-CE2 4.22Å; Y435-Y441 HydrophobicContact CE1-CD2 4.17Å; Y435-Y441 AromaticContact CE1-CE2 3.51Å; Y435-Y441 HydrophobicContact CE1-CE2 3.51Å; Y435-Y441 AromaticContact CE1-CZ 3.81Å; P436-Y441 WeakPolarHBondContact CA-O 3.28Å; M439-Y441 HydrophobicContact CB-CD1 3.97Å; M439-Y441 HydrophobicContact CB-CE1 3.45Å; M439-Y441 VanDerWaalsContact CB-CE1 3.45Å; M439-Y441 HydrophobicContact CB-CE2 4.5Å; M439-Y441 WeakPolarHBondContact O-CD1 3.18Å; M439-Y441 VanDerWaalsContact O-CE1 3.3Å; M439-Y441 WeakPolarHBondContact O-CE1 3.47Å; Y441-H516 PolarHBondContact OH-ND1 3.15Å; Y441-P520 VanDerWaalsContact CB-O 3.25Å; Y441-P520 WeakPolarHBondContact CB-O 3.14Å
442K94.4Very high96.2Very high49 Ų4928.7 Ų28.721%0.21314%0.137CC..PPolyproline II helixtrans-81.6144.4172.6-77.3179.9-89.5-166.20111.6P436 S519 E522 N527 W528 D529P436-K442 HydrophobicContact CG-CB 4.48Å; P436-K442 HydrophobicContact CG-CG 3.59Å; K442-S519 VanDerWaalsContact O-CB 3.31Å; K442-S519 WeakPolarHBondContact O-CB 3.29Å; K442-S519 PolarHBondContact O-OG 2.95Å; K442-E522 WeakPolarHBondContact CE-OE1 3.07Å; K442-E522 WeakPolarHBondContact CE-OE2 3.42Å; K442-E522 IonicContact NZ-OE1 2.63Å; K442-E522 IonicContact NZ-OE2 3.59Å; K442-N527 VanDerWaalsContact CD-O 3.31Å; K442-N527 WeakPolarHBondContact CD-O 3.49Å; K442-N527 WeakPolarHBondContact CE-O 3.49Å; K442-N527 PolarHBondContact NZ-O 3.43Å; K442-W528 HydrophobicContact CD-CZ3 4.4Å; K442-D529 IonicContact NZ-OD1 2.75Å
443L96.1Very high96.2Very high10 Ų1034.9 Ų34.95%0.05216%0.16CC..PPolyproline II helixtrans-70.9155169.6-69.5-178.5000110.7I432 Y435 E445 N448 I512 S515I432-L443 HydrophobicContact CG1-CD1 4.08Å; Y435-L443 HydrophobicContact CD1-CD1 4.4Å; Y435-L443 HydrophobicContact CD1-CD2 3.73Å; Y435-L443 HydrophobicContact CD1-CG 3.71Å; Y435-L443 HydrophobicContact CD2-CD1 3.74Å; Y435-L443 HydrophobicContact CD2-CD2 4.24Å; Y435-L443 HydrophobicContact CD2-CG 3.98Å; Y435-L443 HydrophobicContact CE1-CD2 3.54Å; Y435-L443 HydrophobicContact CE1-CG 4.07Å; Y435-L443 HydrophobicContact CE2-CD1 4.11Å; Y435-L443 HydrophobicContact CE2-CD2 4.07Å; Y435-L443 HydrophobicContact CE2-CG 4.31Å; Y435-L443 HydrophobicContact CG-CD1 3.89Å; Y435-L443 HydrophobicContact CG-CD2 4.07Å; Y435-L443 HydrophobicContact CG-CG 3.66Å; L443-E445 PolarHBondContact O-N 3.32Å; L443-N448 VanDerWaalsContact CB-ND2 3.29Å; L443-N448 WeakPolarHBondContact CB-ND2 3.39Å; L443-I512 HydrophobicContact CD1-CG1 4.28Å; L443-I512 HydrophobicContact CD2-CG1 4.06Å; L443-S515 WeakPolarHBondContact CA-OG 3.41Å
444N96Very high96.3Very high38 Ų3837.6 Ų37.620%0.20317%0.172CC..PPolyproline II helixtrans-68.5118.4-177.4-179.2-82.9000110.5T446 L447 N448 S511 Y514 S515N444-T446 PolarHBondContact O-N 3.41Å; N444-T446 WeakPolarHBondContact OD1-CB 3.33Å; N444-T446 PolarHBondContact OD1-N 3.23Å; N444-T446 VanDerWaalsContact OD1-N 3.14Å; N444-L447 HydrophobicContact CB-CB 4.33Å; N444-L447 HydrophobicContact CB-CD1 4.02Å; N444-L447 HydrophobicContact CB-CG 4.34Å; N444-L447 PolarHBondContact O-N 3.37Å; N444-L447 WeakPolarHBondContact OD1-CG 3.32Å; N444-L447 PolarHBondContact OD1-N 2.98Å; N444-N448 WeakPolarHBondContact O-CB 3.45Å; N444-N448 PolarHBondContact O-N 2.94Å; N444-N448 PolarHBondContact O-ND2 2.72Å; N444-S511 PolarHBondContact N-OG 3.47Å; N444-S511 PolarHBondContact O-OG 3.49Å; N444-Y514 HydrophobicContact CB-CD1 3.87Å; N444-Y514 HydrophobicContact CB-CE1 4.21Å; N444-S515 PolarHBondContact N-OG 3.27Å
445E95.6Very high96.3Very high51 Ų5138 Ų3824%0.23817%0.174CC..Hα-helixtrans-66.7-35.2-172.3-172.554.8-153.900113E373 S374 L443 N448 K449E373-E445 WeakPolarHBondContact CA-OE1 3.28Å; S374-E445 WeakPolarHBondContact CB-OE1 3.31Å; S374-E445 PolarHBondContact N-OE1 2.61Å; S374-E445 PolarHBondContact OG-OE1 2.94Å; S374-E445 PolarHBondContact OG-OE2 3.4Å; L443-E445 PolarHBondContact O-N 3.32Å; E445-N448 PolarHBondContact O-N 2.84Å; E445-K449 VanDerWaalsContact O-CG 3.3Å; E445-K449 WeakPolarHBondContact O-CG 3.33Å; E445-K449 PolarHBondContact O-N 3.4Å; E445-K449 WeakPolarHBondContact OE1-CE 3.38Å; E445-K449 IonicContact OE1-NZ 3.79Å
446T96.8Very high96.4Very high88 Ų8838.9 Ų38.954%0.5418%0.179SC..Hα-helixtrans-65.5-46.6177.8-54.40000111.5N444 N448 K449 W450N444-T446 PolarHBondContact O-N 3.41Å; N444-T446 WeakPolarHBondContact OD1-CB 3.33Å; N444-T446 PolarHBondContact OD1-N 3.23Å; N444-T446 VanDerWaalsContact OD1-N 3.14Å; T446-N448 VanDerWaalsContact C-N 3.34Å; T446-K449 PolarHBondContact O-N 3.28Å; T446-W450 PolarHBondContact O-N 3.27Å; T446-W450 VanDerWaalsContact O-N 3.09Å
447L97.4Very high96.5Very high30 Ų3043.1 Ų43.116%0.15720%0.2CC..Hα-helixtrans-65.9-39178.2-66.9172.5000111.4N444 K449 W450 C451 F507 V510 Y514N444-L447 HydrophobicContact CB-CB 4.33Å; N444-L447 HydrophobicContact CB-CD1 4.02Å; N444-L447 HydrophobicContact CB-CG 4.34Å; N444-L447 PolarHBondContact O-N 3.37Å; N444-L447 WeakPolarHBondContact OD1-CG 3.32Å; N444-L447 PolarHBondContact OD1-N 2.98Å; L447-K449 VanDerWaalsContact C-N 3.34Å; L447-K449 PolarHBondContact O-N 3.41Å; L447-W450 PolarHBondContact O-N 3.18Å; L447-C451 PolarHBondContact O-N 3.28Å; L447-F507 HydrophobicContact CD2-CD1 4.1Å; L447-V510 HydrophobicContact CD1-CG1 4Å; L447-V510 HydrophobicContact CD2-CG1 4.3Å; L447-Y514 HydrophobicContact CD1-CD1 4.32Å; L447-Y514 HydrophobicContact CD1-CG 4.14Å
448N97.5Very high96.7Very high0 Ų042.8 Ų42.80%020%0.199CC..Hα-helixtrans-64.1-37.4175.1-68.3-16.9000112.4S374 I432 L443 N444 E445 T446 C451 F452 S511S374-N448 WeakPolarHBondContact OG-CB 3.28Å; I432-N448 HydrophobicContact CD1-CB 4.24Å; L443-N448 VanDerWaalsContact CB-ND2 3.29Å; L443-N448 WeakPolarHBondContact CB-ND2 3.39Å; N444-N448 WeakPolarHBondContact O-CB 3.45Å; N444-N448 PolarHBondContact O-N 2.94Å; N444-N448 PolarHBondContact O-ND2 2.72Å; E445-N448 PolarHBondContact O-N 2.84Å; T446-N448 VanDerWaalsContact C-N 3.34Å; N448-C451 WeakPolarHBondContact O-CB 3.14Å; N448-C451 PolarHBondContact O-N 3.19Å; N448-F452 PolarHBondContact O-N 2.78Å; N448-S511 VanDerWaalsContact OD1-CB 3.29Å; N448-S511 WeakPolarHBondContact OD1-CB 3.32Å; N448-S511 PolarHBondContact OD1-OG 3.24Å
449K98Very high96.9Very high77 Ų7741.9 Ų41.934%0.33519%0.194SC..Hα-helixtrans-64.9-39.6173.2-75.3-179.8178.5-179.30112.5F372 L377 E445 T446 L447 F452 W453F372-K449 VanDerWaalsContact O-CE 3.24Å; F372-K449 WeakPolarHBondContact O-CE 3.44Å; F372-K449 PolarHBondContact O-NZ 3.13Å; L377-K449 HydrophobicContact CD1-CD 4.39Å; L377-K449 HydrophobicContact CD1-CG 3.8Å; E445-K449 VanDerWaalsContact O-CG 3.3Å; E445-K449 WeakPolarHBondContact O-CG 3.33Å; E445-K449 PolarHBondContact O-N 3.4Å; E445-K449 WeakPolarHBondContact OE1-CE 3.38Å; E445-K449 IonicContact OE1-NZ 3.79Å; T446-K449 PolarHBondContact O-N 3.28Å; L447-K449 VanDerWaalsContact C-N 3.34Å; L447-K449 PolarHBondContact O-N 3.41Å; K449-F452 WeakPolarHBondContact O-CB 3.03Å; K449-F452 PolarHBondContact O-N 2.88Å; K449-W453 PolarHBondContact O-N 2.9Å
450W98.2Very high97.1Very high130 Ų13040.4 Ų40.449%0.49219%0.188SC..Hα-helixtrans-64-44.4172.5-76.1116.5000111.9T446 L447 F452 W453 F454 F507T446-W450 PolarHBondContact O-N 3.27Å; T446-W450 VanDerWaalsContact O-N 3.09Å; L447-W450 PolarHBondContact O-N 3.18Å; W450-F452 VanDerWaalsContact C-N 3.3Å; W450-F452 PolarHBondContact O-N 3.06Å; W450-W453 PolarHBondContact O-N 2.72Å; W450-F454 HydrophobicContact CE3-CD2 4.02Å; W450-F454 AromaticContact CE3-CE2 3.6Å; W450-F454 HydrophobicContact CE3-CE2 3.6Å; W450-F454 HydrophobicContact CZ3-CE2 4.01Å; W450-F454 WeakPolarHBondContact O-CD2 3.34Å; W450-F454 PolarHBondContact O-N 3.38Å; W450-F507 HydrophobicContact CB-CB 4.39Å; W450-F507 HydrophobicContact CB-CD1 3.73Å; W450-F507 HydrophobicContact CB-CD2 4.01Å; W450-F507 HydrophobicContact CB-CE1 3.9Å; W450-F507 HydrophobicContact CB-CE2 4.18Å; W450-F507 HydrophobicContact CB-CG 3.79Å; W450-F507 HydrophobicContact CB-CZ 4.12Å; W450-F507 HydrophobicContact CG-CD1 4.44Å; W450-F507 HydrophobicContact CG-CE1 4.2Å; W450-F507 HydrophobicContact CG-CZ 4.41Å
451C97.9Very high97.3Very high1 Ų142.3 Ų42.31%0.00720%0.199CC..Hα-helixtrans-51.8-52.2171172.50000110.5L447 N448 W453 F455 G504 F507 L508L447-C451 PolarHBondContact O-N 3.28Å; N448-C451 WeakPolarHBondContact O-CB 3.14Å; N448-C451 PolarHBondContact O-N 3.19Å; C451-W453 PolarHBondContact O-N 3.26Å; C451-F455 WeakPolarHBondContact O-CB 3.46Å; C451-F455 PolarHBondContact O-N 3.37Å; C451-G504 WeakPolarHBondContact CA-O 3.33Å; C451-G504 WeakPolarHBondContact CB-O 3.38Å; C451-G504 PolarHBondContact SG-O 3.23Å; C451-F507 HydrophobicContact CB-CB 3.88Å; C451-L508 HydrophobicContact CB-CB 4.37Å
452F98.4Very high97.6Very high9 Ų942.3 Ų42.34%0.03920%0.199CC..Hα-helixtrans-55.1-53.9179166.7-99.4000112.5L377 F378 A381 N448 K449 W450 F455 M456L377-F452 HydrophobicContact CB-CD1 3.91Å; L377-F452 HydrophobicContact CB-CD2 3.8Å; L377-F452 HydrophobicContact CB-CE1 3.92Å; L377-F452 HydrophobicContact CB-CE2 3.8Å; L377-F452 HydrophobicContact CB-CG 3.85Å; L377-F452 HydrophobicContact CB-CZ 3.86Å; L377-F452 HydrophobicContact CD1-CD1 3.89Å; L377-F452 HydrophobicContact CD1-CE1 4.3Å; L377-F452 HydrophobicContact CD1-CG 4.28Å; L377-F452 HydrophobicContact CD2-CE1 4.47Å; L377-F452 HydrophobicContact CG-CD1 4.44Å; L377-F452 HydrophobicContact CG-CE1 4.48Å; L377-F452 WeakPolarHBondContact O-CE2 3Å; F378-F452 AromaticContact CD1-CD2 3.95Å; F378-F452 HydrophobicContact CD1-CD2 3.95Å; F378-F452 HydrophobicContact CD2-CD2 4.21Å; F378-F452 HydrophobicContact CE1-CD2 4.08Å; F378-F452 HydrophobicContact CE2-CB 4.01Å; F378-F452 HydrophobicContact CE2-CD2 4.32Å; F378-F452 HydrophobicContact CG-CD2 4.01Å; F378-F452 HydrophobicContact CZ-CB 4Å; F378-F452 HydrophobicContact CZ-CD2 4.26Å; A381-F452 HydrophobicContact CB-CE2 3.65Å; A381-F452 HydrophobicContact CB-CZ 3.96Å; N448-F452 PolarHBondContact O-N 2.78Å; K449-F452 WeakPolarHBondContact O-CB 3.03Å; K449-F452 PolarHBondContact O-N 2.88Å; W450-F452 VanDerWaalsContact C-N 3.3Å; W450-F452 PolarHBondContact O-N 3.06Å; F452-F455 PolarHBondContact O-N 3.47Å; F452-M456 HydrophobicContact CE2-CB 4.25Å; F452-M456 HydrophobicContact CZ-CB 4.33Å; F452-M456 HydrophobicContact CZ-CG 4.33Å; F452-M456 WeakPolarHBondContact O-CB 3.28Å; F452-M456 PolarHBondContact O-N 2.89Å
453W98.4Very high97.8Very high133 Ų13340.7 Ų40.750%0.50419%0.192SC..Hα-helixtrans-65.4-45.9-174.4-76.9117.1000112.9K449 W450 C451 F455 I457K449-W453 PolarHBondContact O-N 2.9Å; W450-W453 PolarHBondContact O-N 2.72Å; C451-W453 PolarHBondContact O-N 3.26Å; W453-F455 VanDerWaalsContact C-N 3.34Å; W453-F455 PolarHBondContact O-N 3.1Å; W453-I457 HydrophobicContact CE3-CD1 4.39Å; W453-I457 VanDerWaalsContact O-CB 3.32Å; W453-I457 WeakPolarHBondContact O-CB 3.47Å; W453-I457 VanDerWaalsContact O-CG1 3.25Å; W453-I457 WeakPolarHBondContact O-CG1 3.04Å; W453-I457 PolarHBondContact O-N 3.24Å
454F98.3Very high97.8Very high57 Ų5744.5 Ų44.525%0.2521%0.212CC..Hα-helixtrans-63.8-40.7177.2-85.9-83.5000111.7W450 G458 L500 I503 F507W450-F454 HydrophobicContact CE3-CD2 4.02Å; W450-F454 AromaticContact CE3-CE2 3.6Å; W450-F454 HydrophobicContact CE3-CE2 3.6Å; W450-F454 HydrophobicContact CZ3-CE2 4.01Å; W450-F454 WeakPolarHBondContact O-CD2 3.34Å; W450-F454 PolarHBondContact O-N 3.38Å; F454-G458 WeakPolarHBondContact O-CA 3.22Å; F454-G458 PolarHBondContact O-N 2.98Å; F454-L500 HydrophobicContact CD1-CD2 4.01Å; F454-L500 HydrophobicContact CE1-CD2 4.18Å; F454-I503 HydrophobicContact CD1-CB 4.27Å; F454-I503 HydrophobicContact CD1-CG2 3.75Å; F454-I503 HydrophobicContact CD2-CG2 4.48Å; F454-I503 HydrophobicContact CE1-CG2 3.93Å; F454-I503 HydrophobicContact CG-CG2 4.05Å; F454-I503 HydrophobicContact CZ-CG2 4.38Å; F454-F507 AromaticContact CD2-CD2 3.98Å; F454-F507 HydrophobicContact CD2-CD2 3.98Å; F454-F507 AromaticContact CD2-CE2 3.53Å; F454-F507 HydrophobicContact CD2-CE2 3.53Å; F454-F507 HydrophobicContact CD2-CZ 4.45Å; F454-F507 HydrophobicContact CE2-CD2 4.44Å; F454-F507 AromaticContact CE2-CE2 3.55Å; F454-F507 HydrophobicContact CE2-CE2 3.55Å; F454-F507 HydrophobicContact CE2-CZ 4.12Å; F454-F507 HydrophobicContact CG-CE2 4.28Å; F454-F507 HydrophobicContact CZ-CE2 4.32Å
455F97.8Very high97.9Very high9 Ų943.3 Ų43.34%0.03921%0.206CC..Hα-helixtrans-70.6-43.5-179.8-153.8-79.6000112F68 V420 V424 F425 C451 F452 W453 F459 M501F68-F455 HydrophobicContact CZ-CE2 4.19Å; F68-F455 HydrophobicContact CZ-CZ 4.04Å; V420-F455 HydrophobicContact CG1-CE1 4.03Å; V424-F455 HydrophobicContact CG1-CE1 4.47Å; V424-F455 HydrophobicContact CG1-CZ 4.29Å; F425-F455 HydrophobicContact CD1-CD1 4.28Å; F425-F455 HydrophobicContact CD1-CE1 4.23Å; F425-F455 AromaticContact CE1-CD1 3.53Å; F425-F455 HydrophobicContact CE1-CD1 3.53Å; F425-F455 AromaticContact CE1-CE1 3.69Å; F425-F455 HydrophobicContact CE1-CE1 3.69Å; F425-F455 HydrophobicContact CZ-CD1 4.24Å; C451-F455 WeakPolarHBondContact O-CB 3.46Å; C451-F455 PolarHBondContact O-N 3.37Å; F452-F455 PolarHBondContact O-N 3.47Å; W453-F455 VanDerWaalsContact C-N 3.34Å; W453-F455 PolarHBondContact O-N 3.1Å; F455-F459 WeakPolarHBondContact O-CB 3.42Å; F455-F459 PolarHBondContact O-N 3.15Å; F455-M501 HydrophobicContact CD2-CB 4.25Å; F455-M501 WeakPolarHBondContact CD2-O 3.48Å; F455-M501 HydrophobicContact CE1-SD 4.47Å; F455-M501 HydrophobicContact CE2-CB 4.2Å
456M98.1Very high98Very high36 Ų3641.1 Ų41.118%0.17720%0.196CC..Hα-helixtrans-66-46.4178.9171.654.4-171.700112.7A381 N385 F425 F452 N460A381-M456 HydrophobicContact CB-CE 4.39Å; A381-M456 HydrophobicContact CB-CG 4.4Å; A381-M456 HydrophobicContact CB-SD 3.89Å; N385-M456 WeakPolarHBondContact ND2-CE 3.24Å; N385-M456 PolarHBondContact ND2-SD 3.46Å; F425-M456 HydrophobicContact CE2-SD 4.07Å; F425-M456 HydrophobicContact CZ-SD 4.27Å; F452-M456 HydrophobicContact CE2-CB 4.25Å; F452-M456 HydrophobicContact CZ-CB 4.33Å; F452-M456 HydrophobicContact CZ-CG 4.33Å; F452-M456 WeakPolarHBondContact O-CB 3.28Å; F452-M456 PolarHBondContact O-N 2.89Å; M456-N460 VanDerWaalsContact CE-ND2 3.28Å; M456-N460 WeakPolarHBondContact CE-ND2 3.43Å; M456-N460 PolarHBondContact O-N 3.4Å; M456-N460 PolarHBondContact O-ND2 3.03Å; M456-N460 VanDerWaalsContact O-ND2 3.11Å; M456-N460 PolarHBondContact SD-ND2 2.76Å
457I98.4Very high98.1Very high88 Ų8838 Ų3845%0.45118%0.175SC..Hα-helixtrans-66.9-48.7176.8-65.7168.8000109.4W453 F459 N460 V461 L500W453-I457 HydrophobicContact CE3-CD1 4.39Å; W453-I457 VanDerWaalsContact O-CB 3.32Å; W453-I457 WeakPolarHBondContact O-CB 3.47Å; W453-I457 VanDerWaalsContact O-CG1 3.25Å; W453-I457 WeakPolarHBondContact O-CG1 3.04Å; W453-I457 PolarHBondContact O-N 3.24Å; I457-F459 VanDerWaalsContact C-N 3.29Å; I457-F459 PolarHBondContact O-N 2.74Å; I457-N460 PolarHBondContact O-N 3.15Å; I457-V461 HydrophobicContact CG2-CG2 4.15Å; I457-V461 WeakPolarHBondContact O-CB 3.41Å; I457-V461 VanDerWaalsContact O-CG2 3.29Å; I457-V461 WeakPolarHBondContact O-CG2 3.23Å; I457-V461 PolarHBondContact O-N 3.06Å; I457-L500 HydrophobicContact CG2-CD1 4.43Å
458G98.3Very high98.1Very high0 Ų041.1 Ų41.10%019%0.191CC..Hα-helixtrans-57.2-41.2178.100000112.9F454 V461 C462 G497F454-G458 WeakPolarHBondContact O-CA 3.22Å; F454-G458 PolarHBondContact O-N 2.98Å; G458-V461 PolarHBondContact O-N 3.47Å; G458-C462 WeakPolarHBondContact O-CB 3.34Å; G458-C462 PolarHBondContact O-N 2.75Å; G458-G497 CarbonylContact C-O 3.27Å; G458-G497 WeakPolarHBondContact CA-O 3.37Å; G458-G497 CarbonylContact O-C 3.49Å; G458-G497 VanDerWaalsContact O-CA 3.27Å; G458-G497 WeakPolarHBondContact O-CA 3.23Å
459F98.4Very high98.1Very high0 Ų041.1 Ų41.10%019%0.191CC..Hα-helixtrans-58.2-51.3176.4170.1-99.1000112N385 Y417 V420 T421 F425 F455 I457 C462 F463 M501N385-F459 HydrophobicContact CB-CE1 4.42Å; Y417-F459 AromaticContact CD1-CE1 3.82Å; Y417-F459 HydrophobicContact CD1-CE1 3.82Å; Y417-F459 AromaticContact CD1-CZ 3.9Å; Y417-F459 HydrophobicContact CD1-CZ 3.9Å; Y417-F459 HydrophobicContact CD2-CE1 4.18Å; Y417-F459 AromaticContact CD2-CZ 3.62Å; Y417-F459 HydrophobicContact CD2-CZ 3.62Å; Y417-F459 AromaticContact CE1-CE1 3.68Å; Y417-F459 HydrophobicContact CE1-CE1 3.68Å; Y417-F459 HydrophobicContact CE1-CZ 4.1Å; Y417-F459 HydrophobicContact CE2-CE1 4.07Å; Y417-F459 AromaticContact CE2-CZ 3.84Å; Y417-F459 HydrophobicContact CE2-CZ 3.84Å; Y417-F459 HydrophobicContact CG-CE1 4.06Å; Y417-F459 AromaticContact CG-CZ 3.65Å; Y417-F459 HydrophobicContact CG-CZ 3.65Å; Y417-F459 AromaticContact CZ-CE1 3.8Å; V420-F459 HydrophobicContact CB-CD2 3.99Å; V420-F459 HydrophobicContact CB-CE2 3.73Å; V420-F459 HydrophobicContact CG1-CD2 3.71Å; V420-F459 HydrophobicContact CG1-CE2 4Å; V420-F459 HydrophobicContact CG2-CD2 4.5Å; V420-F459 HydrophobicContact CG2-CE2 4.18Å; T421-F459 HydrophobicContact CG2-CD1 3.76Å; T421-F459 HydrophobicContact CG2-CE1 3.34Å; T421-F459 HydrophobicContact CG2-CE2 4.18Å; T421-F459 HydrophobicContact CG2-CG 4.38Å; T421-F459 HydrophobicContact CG2-CZ 3.64Å; F425-F459 HydrophobicContact CZ-CB 4.5Å; F425-F459 HydrophobicContact CZ-CG 4.47Å; F455-F459 WeakPolarHBondContact O-CB 3.42Å; F455-F459 PolarHBondContact O-N 3.15Å; I457-F459 VanDerWaalsContact C-N 3.29Å; I457-F459 PolarHBondContact O-N 2.74Å; F459-C462 WeakPolarHBondContact O-CB 3.4Å; F459-C462 PolarHBondContact O-N 2.94Å; F459-F463 AromaticContact CD2-CD2 3.45Å; F459-F463 HydrophobicContact CD2-CD2 3.45Å; F459-F463 VanDerWaalsContact CD2-CD2 3.45Å; F459-F463 AromaticContact CD2-CE2 3.76Å; F459-F463 HydrophobicContact CD2-CE2 3.76Å; F459-F463 HydrophobicContact CE2-CB 4.44Å; F459-F463 AromaticContact CE2-CD2 3.31Å; F459-F463 HydrophobicContact CE2-CD2 3.31Å; F459-F463 AromaticContact CE2-CE2 3.82Å; F459-F463 HydrophobicContact CE2-CE2 3.82Å; F459-F463 HydrophobicContact CE2-CG 4.13Å; F459-F463 HydrophobicContact CG-CD2 4.38Å; F459-F463 HydrophobicContact CZ-CD2 4.15Å; F459-F463 WeakPolarHBondContact O-CD2 3.45Å; F459-F463 PolarHBondContact O-N 2.88Å; F459-M501 HydrophobicContact CB-CG 4.49Å; F459-M501 HydrophobicContact CB-SD 4.01Å; F459-M501 HydrophobicContact CD2-SD 4.4Å
460N98.4Very high98.1Very high34 Ų3437.5 Ų37.518%0.18218%0.175CC..Hα-helixtrans-66.9-43179.6-80.9-81.5000112N385 Y417 M456 I457 C462 L464N385-N460 PolarHBondContact OD1-ND2 3.2Å; N385-N460 PolarHBondContact OD1-OD1 2.93Å; Y417-N460 PolarHBondContact OH-OD1 2.99Å; M456-N460 VanDerWaalsContact CE-ND2 3.28Å; M456-N460 WeakPolarHBondContact CE-ND2 3.43Å; M456-N460 PolarHBondContact O-N 3.4Å; M456-N460 PolarHBondContact O-ND2 3.03Å; M456-N460 VanDerWaalsContact O-ND2 3.11Å; M456-N460 PolarHBondContact SD-ND2 2.76Å; I457-N460 PolarHBondContact O-N 3.15Å; N460-C462 PolarHBondContact O-N 3.13Å; N460-L464 WeakPolarHBondContact O-CB 3.36Å; N460-L464 PolarHBondContact O-N 2.95Å
461V98.4Very high98Very high46 Ų4635.3 Ų35.328%0.27917%0.173SC..Hα-helixtrans-61.8-31.4175.2175.30000111.4I457 G458 P465 I493I457-V461 HydrophobicContact CG2-CG2 4.15Å; I457-V461 WeakPolarHBondContact O-CB 3.41Å; I457-V461 VanDerWaalsContact O-CG2 3.29Å; I457-V461 WeakPolarHBondContact O-CG2 3.23Å; I457-V461 PolarHBondContact O-N 3.06Å; G458-V461 PolarHBondContact O-N 3.47Å; V461-P465 WeakPolarHBondContact O-CD 3.26Å; V461-P465 VanDerWaalsContact O-CG 3.27Å; V461-P465 WeakPolarHBondContact O-CG 3.26Å; V461-I493 HydrophobicContact CG1-CG2 3.76Å
462C98.4Very high97.9Very high2 Ų239.8 Ų39.81%0.01420%0.197CC..Hα-helixtrans-73.7-52.6179.3-1760000112.4G458 F459 N460 Q466 S494 M501G458-C462 WeakPolarHBondContact O-CB 3.34Å; G458-C462 PolarHBondContact O-N 2.75Å; F459-C462 WeakPolarHBondContact O-CB 3.4Å; F459-C462 PolarHBondContact O-N 2.94Å; N460-C462 PolarHBondContact O-N 3.13Å; C462-Q466 PolarHBondContact O-NE2 3.5Å; C462-S494 VanDerWaalsContact O-CB 3.27Å; C462-S494 WeakPolarHBondContact O-CB 3.36Å; C462-S494 PolarHBondContact O-OG 3.37Å; C462-S494 PolarHBondContact SG-O 3.03Å; C462-M501 HydrophobicContact CB-CE 3.78Å
463F98.4Very high97.7Very high15 Ų1541.2 Ų41.27%0.06621%0.214CC..Hα-helixtrans-102.3-21.9-165.5-64.9-73.6000114.3H416 Y417 F459 Q466 F467 M501H416-F463 HydrophobicContact CB-CD1 3.56Å; H416-F463 HydrophobicContact CB-CD2 4.16Å; H416-F463 HydrophobicContact CB-CE1 3.56Å; H416-F463 HydrophobicContact CB-CE2 4.15Å; H416-F463 HydrophobicContact CB-CG 3.88Å; H416-F463 HydrophobicContact CB-CZ 3.86Å; H416-F463 AromaticContact CD2-CE1 3.35Å; H416-F463 WeakPolarHBondContact CD2-CE1 3.34Å; H416-F463 AromaticContact CD2-CZ 3.27Å; H416-F463 WeakPolarHBondContact CD2-CZ 3.26Å; H416-F463 AromaticContact CE1-CE1 3.8Å; H416-F463 AromaticContact CG-CD1 3.71Å; H416-F463 AromaticContact CG-CE1 3.21Å; H416-F463 AromaticContact CG-CZ 3.57Å; H416-F463 AromaticContact ND1-CE1 3.54Å; H416-F463 AromaticContact NE2-CE1 3.73Å; H416-F463 AromaticContact NE2-CZ 3.86Å; Y417-F463 HydrophobicContact CD2-CB 3.92Å; Y417-F463 HydrophobicContact CE2-CB 3.56Å; F459-F463 AromaticContact CD2-CD2 3.45Å; F459-F463 HydrophobicContact CD2-CD2 3.45Å; F459-F463 VanDerWaalsContact CD2-CD2 3.45Å; F459-F463 AromaticContact CD2-CE2 3.76Å; F459-F463 HydrophobicContact CD2-CE2 3.76Å; F459-F463 HydrophobicContact CE2-CB 4.44Å; F459-F463 AromaticContact CE2-CD2 3.31Å; F459-F463 HydrophobicContact CE2-CD2 3.31Å; F459-F463 AromaticContact CE2-CE2 3.82Å; F459-F463 HydrophobicContact CE2-CE2 3.82Å; F459-F463 HydrophobicContact CE2-CG 4.13Å; F459-F463 HydrophobicContact CG-CD2 4.38Å; F459-F463 HydrophobicContact CZ-CD2 4.15Å; F459-F463 WeakPolarHBondContact O-CD2 3.45Å; F459-F463 PolarHBondContact O-N 2.88Å; F463-Q466 WeakPolarHBondContact O-CB 3.3Å; F463-Q466 PolarHBondContact O-N 3.36Å; F463-Q466 VanDerWaalsContact O-N 3.07Å; F463-F467 PolarHBondContact O-N 3.03Å; F463-M501 HydrophobicContact CE2-CE 3.87Å; F463-M501 HydrophobicContact CE2-SD 4.17Å; F463-M501 HydrophobicContact CZ-CE 4.41Å
464L97.5Very high97.7Very high91 Ų9134.9 Ų34.948%0.47619%0.19SC..Hα-helixtrans-61-43.4175.6-165.568.3000112.2N460 Q466 F467N460-L464 WeakPolarHBondContact O-CB 3.36Å; N460-L464 PolarHBondContact O-N 2.95Å; L464-Q466 PolarHBondContact O-N 3.27Å; L464-F467 HydrophobicContact CD1-CD2 4.34Å; L464-F467 PolarHBondContact O-N 3.42Å
465P98Very high97.7Very high13 Ų1334.7 Ų34.78%0.08419%0.194CC..Hα-helixtrans-61.7-26.4173.7-2334.8000113.5V461 F467 I468 L469 L490 I493V461-P465 WeakPolarHBondContact O-CD 3.26Å; V461-P465 VanDerWaalsContact O-CG 3.27Å; V461-P465 WeakPolarHBondContact O-CG 3.26Å; P465-F467 VanDerWaalsContact C-N 3.33Å; P465-F467 PolarHBondContact O-N 2.84Å; P465-I468 PolarHBondContact O-N 3.02Å; P465-L469 WeakPolarHBondContact O-CG 3.49Å; P465-L469 PolarHBondContact O-N 3.2Å; P465-L490 HydrophobicContact CB-CB 4.19Å; P465-L490 HydrophobicContact CB-CD2 4.09Å; P465-I493 HydrophobicContact CG-CB 4.28Å; P465-I493 HydrophobicContact CG-CG2 3.71Å
466Q98.3Very high97.6Very high5 Ų536.4 Ų36.42%0.02320%0.2CC..Hα-helixtrans-71.5-26.5-178.5-66.5-176.618.300112.9Y409 A413 C462 F463 L464 I468 L469 G470 S494Y409-Q466 CarbonylContact C-O 3.27Å; Y409-Q466 WeakPolarHBondContact CB-O 3.33Å; Y409-Q466 HydrophobicContact CD1-CB 4.05Å; Y409-Q466 HydrophobicContact CD1-CG 3.86Å; Y409-Q466 HydrophobicContact CE1-CG 4.4Å; A413-Q466 HydrophobicContact CB-CB 3.86Å; C462-Q466 PolarHBondContact O-NE2 3.5Å; F463-Q466 WeakPolarHBondContact O-CB 3.3Å; F463-Q466 PolarHBondContact O-N 3.36Å; F463-Q466 VanDerWaalsContact O-N 3.07Å; L464-Q466 PolarHBondContact O-N 3.27Å; Q466-I468 VanDerWaalsContact C-N 3.33Å; Q466-L469 HydrophobicContact CG-CD1 4.32Å; Q466-G470 PolarHBondContact O-N 2.85Å; Q466-S494 PolarHBondContact NE2-OG 3Å
467F98Very high97.5Very high23 Ų2338 Ų3810%0.10120%0.204CC..Hα-helixtrans-60.4-46.3168.1-75.7-61.9000110.7T392 F410 A413 H414 Y417 F463 L464 P465 G470 L471T392-F467 HydrophobicContact CG2-CD1 4.2Å; T392-F467 HydrophobicContact CG2-CE1 3.55Å; T392-F467 HydrophobicContact CG2-CZ 3.76Å; F410-F467 HydrophobicContact CD2-CB 4.47Å; F410-F467 AromaticContact CD2-CD1 3.64Å; F410-F467 HydrophobicContact CD2-CD1 3.64Å; F410-F467 HydrophobicContact CD2-CE1 4.45Å; F410-F467 AromaticContact CE2-CD1 3.66Å; F410-F467 HydrophobicContact CE2-CD1 3.66Å; F410-F467 HydrophobicContact CE2-CE1 4.28Å; F410-F467 HydrophobicContact CG-CD1 4.21Å; F410-F467 HydrophobicContact CZ-CD1 4.23Å; F410-F467 HydrophobicContact CZ-CE1 4.41Å; A413-F467 HydrophobicContact CB-CB 4.41Å; A413-F467 HydrophobicContact CB-CD1 3.46Å; A413-F467 VanDerWaalsContact CB-CD1 3.46Å; A413-F467 HydrophobicContact CB-CD2 3.84Å; A413-F467 HydrophobicContact CB-CE1 3.5Å; A413-F467 HydrophobicContact CB-CE2 3.9Å; A413-F467 HydrophobicContact CB-CG 3.63Å; A413-F467 HydrophobicContact CB-CZ 3.73Å; H414-F467 HydrophobicContact CB-CE1 4.15Å; Y417-F467 AromaticContact CD2-CE2 3.57Å; Y417-F467 HydrophobicContact CD2-CE2 3.57Å; Y417-F467 AromaticContact CD2-CZ 3.99Å; Y417-F467 HydrophobicContact CD2-CZ 3.99Å; Y417-F467 HydrophobicContact CE2-CD2 4.34Å; Y417-F467 AromaticContact CE2-CE2 3.62Å; Y417-F467 HydrophobicContact CE2-CE2 3.62Å; Y417-F467 HydrophobicContact CE2-CZ 4.48Å; Y417-F467 HydrophobicContact CG-CE2 4.16Å; Y417-F467 HydrophobicContact CG-CZ 4.36Å; F463-F467 PolarHBondContact O-N 3.03Å; L464-F467 HydrophobicContact CD1-CD2 4.34Å; L464-F467 PolarHBondContact O-N 3.42Å; P465-F467 VanDerWaalsContact C-N 3.33Å; P465-F467 PolarHBondContact O-N 2.84Å; F467-G470 PolarHBondContact O-N 2.86Å; F467-L471 VanDerWaalsContact O-CG 3.31Å; F467-L471 WeakPolarHBondContact O-CG 3.48Å; F467-L471 PolarHBondContact O-N 3.1Å
468I97.5Very high97.3Very high94 Ų9436.9 Ų36.948%0.48220%0.199SC..Hα-helixtrans-65.2-47.2178.8-56.3173.6000110.2P465 Q466 G470 L471 D472 L490P465-I468 PolarHBondContact O-N 3.02Å; Q466-I468 VanDerWaalsContact C-N 3.33Å; I468-G470 PolarHBondContact O-N 3.25Å; I468-L471 PolarHBondContact O-N 3.36Å; I468-L471 VanDerWaalsContact O-N 3.12Å; I468-D472 VanDerWaalsContact O-CB 3.31Å; I468-D472 WeakPolarHBondContact O-CB 3.47Å; I468-D472 PolarHBondContact O-N 2.72Å; I468-L490 HydrophobicContact CB-CD1 3.98Å; I468-L490 HydrophobicContact CG2-CD1 3.61Å
469L97.5Very high97.2Very high0 Ų041.4 Ų41.40%022%0.217CC..Hα-helixtrans-53.7-42.6175-74.8169.1000112P465 Q466 D472 G473 M474 W487 L490P465-L469 WeakPolarHBondContact O-CG 3.49Å; P465-L469 PolarHBondContact O-N 3.2Å; Q466-L469 HydrophobicContact CG-CD1 4.32Å; L469-D472 PolarHBondContact O-N 3.25Å; L469-G473 PolarHBondContact O-N 3.24Å; L469-M474 HydrophobicContact CB-CB 4.11Å; L469-M474 HydrophobicContact CB-SD 4.08Å; L469-M474 HydrophobicContact CD1-SD 3.95Å; L469-M474 HydrophobicContact CD2-SD 3.84Å; L469-M474 HydrophobicContact CG-SD 4.18Å; L469-M474 WeakPolarHBondContact O-CB 3.31Å; L469-M474 PolarHBondContact O-N 3.49Å; L469-W487 HydrophobicContact CD2-CB 3.58Å; L469-W487 HydrophobicContact CD2-CG 3.76Å; L469-L490 HydrophobicContact CD1-CB 4.01Å; L469-L490 HydrophobicContact CD2-CB 3.66Å; L469-L490 HydrophobicContact CD2-CD1 3.92Å; L469-L490 HydrophobicContact CD2-CG 4.44Å; L469-L490 HydrophobicContact CG-CB 3.67Å; L469-L490 HydrophobicContact CG-CD1 4.01Å
470G97.4Very high97.1Very high1 Ų142.9 Ų42.91%0.0123%0.226CC..Hα-helixtrans-68.3-36.1178.600000114.5T408 Q466 F467 I468 G473T408-G470 VanDerWaalsContact CB-O 3.31Å; T408-G470 WeakPolarHBondContact CB-O 3.49Å; T408-G470 WeakPolarHBondContact OG1-CA 3.2Å; T408-G470 PolarHBondContact OG1-O 3.19Å; Q466-G470 PolarHBondContact O-N 2.85Å; F467-G470 PolarHBondContact O-N 2.86Å; I468-G470 PolarHBondContact O-N 3.25Å; G470-G473 PolarHBondContact O-N 2.66Å
471L96.3Very high97Very high84 Ų8441.6 Ų41.644%0.4422%0.219SC..Hα-helixtrans-72.5-33.3174.5-66.5176.8000111.8Y405 F410 F467 I468 G473Y405-L471 HydrophobicContact CD1-CD2 3.55Å; Y405-L471 HydrophobicContact CE1-CD2 3.08Å; Y405-L471 HydrophobicContact CE1-CG 4.45Å; Y405-L471 HydrophobicContact CE2-CD2 4.38Å; Y405-L471 HydrophobicContact CG-CD2 4.38Å; F410-L471 HydrophobicContact CD2-CD2 3.72Å; F410-L471 HydrophobicContact CD2-CG 3.9Å; F410-L471 HydrophobicContact CE2-CD2 4Å; F410-L471 HydrophobicContact CE2-CG 4.33Å; F467-L471 VanDerWaalsContact O-CG 3.31Å; F467-L471 WeakPolarHBondContact O-CG 3.48Å; F467-L471 PolarHBondContact O-N 3.1Å; I468-L471 PolarHBondContact O-N 3.36Å; I468-L471 VanDerWaalsContact O-N 3.12Å; L471-G473 PolarHBondContact O-N 3.27Å
472D95.9Very high96.8Very high96 Ų9644.9 Ų44.951%0.51323%0.232SC..THydrogen-bonded Turntrans-78.75.2176-158.844.3000112.9I468 L469 W487I468-D472 VanDerWaalsContact O-CB 3.31Å; I468-D472 WeakPolarHBondContact O-CB 3.47Å; I468-D472 PolarHBondContact O-N 2.72Å; L469-D472 PolarHBondContact O-N 3.25Å; D472-W487 PolarHBondContact OD2-NE1 3.49Å
473G95.2Very high96.6Very high38 Ų3848.9 Ų48.939%0.39226%0.258SS..THydrogen-bonded Turntrans94.65169.100000115.7L469 G470 L471 P475L469-G473 PolarHBondContact O-N 3.24Å; G470-G473 PolarHBondContact O-N 2.66Å; L471-G473 PolarHBondContact O-N 3.27Å; G473-P475 WeakPolarHBondContact O-CD 3.42Å; G473-P475 VanDerWaalsContact O-N 3.16Å
474M97.5Very high96.3Very high0 Ų053 Ų530%029%0.289CS..  trans-64.6111177.3-169.8-175.8-17800110.8T408 Y409 L469 Y481 W487 N491T408-M474 WeakPolarHBondContact CA-O 3.27Å; T408-M474 WeakPolarHBondContact CB-O 3.42Å; Y409-M474 HydrophobicContact CD2-CB 4.14Å; Y409-M474 HydrophobicContact CD2-CE 4.13Å; Y409-M474 HydrophobicContact CD2-CG 3.64Å; Y409-M474 HydrophobicContact CD2-SD 3.64Å; Y409-M474 HydrophobicContact CE2-CE 3.55Å; Y409-M474 HydrophobicContact CE2-CG 3.96Å; Y409-M474 HydrophobicContact CE2-SD 3.71Å; Y409-M474 HydrophobicContact CG-SD 4.26Å; Y409-M474 PolarHBondContact N-O 3.2Å; L469-M474 HydrophobicContact CB-CB 4.11Å; L469-M474 HydrophobicContact CB-SD 4.08Å; L469-M474 HydrophobicContact CD1-SD 3.95Å; L469-M474 HydrophobicContact CD2-SD 3.84Å; L469-M474 HydrophobicContact CG-SD 4.18Å; L469-M474 WeakPolarHBondContact O-CB 3.31Å; L469-M474 PolarHBondContact O-N 3.49Å; M474-Y481 HydrophobicContact CE-CD1 4.15Å; M474-W487 HydrophobicContact CB-CD2 3.82Å; M474-W487 HydrophobicContact CB-CE3 3.9Å; M474-W487 HydrophobicContact CB-CG 4.48Å; M474-W487 HydrophobicContact CB-CH2 4.08Å; M474-W487 HydrophobicContact CB-CZ2 3.98Å; M474-W487 HydrophobicContact CB-CZ3 4.04Å; M474-W487 HydrophobicContact CG-CD2 3.96Å; M474-W487 HydrophobicContact CG-CE3 3.58Å; M474-W487 HydrophobicContact CG-CH2 4.31Å; M474-W487 HydrophobicContact CG-CZ3 3.78Å; M474-W487 HydrophobicContact SD-CD2 4.46Å; M474-W487 HydrophobicContact SD-CE3 4.23Å; M474-N491 PolarHBondContact SD-ND2 3.49Å; M474-N491 VanDerWaalsContact SD-ND2 3.42Å
475P97.2Very high96.1Very high53 Ų5351.5 Ų51.534%0.34428%0.281SS..BIsolated β-bridgetrans-70.4150.2176.1-16.732.9000111.6Y409 G473 L478Y409-P475 WeakPolarHBondContact CD2-O 3.02Å; Y409-P475 WeakPolarHBondContact CE2-O 3.32Å; G473-P475 WeakPolarHBondContact O-CD 3.42Å; G473-P475 VanDerWaalsContact O-N 3.16Å; P475-L478 HydrophobicContact CB-CD1 4.11Å; P475-L478 HydrophobicContact CB-CG 4.27Å; P475-L478 HydrophobicContact CG-CD1 3.91Å
476R97Very high96Very high46 Ų4653.5 Ų53.517%0.17431%0.305CS..THydrogen-bonded Turntrans-70.4160.4170.275-173.4-68.9-171.23.6110.8N407 V412 L478N407-R476 HydrophobicContact CB-CG 4.14Å; N407-R476 WeakPolarHBondContact O-CB 3.37Å; N407-R476 WeakPolarHBondContact O-CG 3.32Å; N407-R476 PolarHBondContact O-N 3.38Å; N407-R476 VanDerWaalsContact OD1-CD 3.3Å; N407-R476 WeakPolarHBondContact OD1-CD 3.48Å; N407-R476 PolarHBondContact OD1-NH1 3.29Å; V412-R476 HydrophobicContact CG2-CB 3.81Å; R476-L478 PolarHBondContact O-N 3.45Å
477R96.2Very high95.9Very high68 Ų6854.5 Ų54.526%0.25731%0.308SS..THydrogen-bonded Turntrans62.920.5173.8-56169.5-179.5-179.1-0.4114.3F99 T167F99-R477 HydrophobicContact CD2-CG 4.18Å; F99-R477 HydrophobicContact CE1-CB 4.05Å; F99-R477 HydrophobicContact CE1-CG 4.02Å; F99-R477 HydrophobicContact CE2-CG 3.63Å; F99-R477 HydrophobicContact CZ-CB 4.02Å; F99-R477 HydrophobicContact CZ-CG 3.59Å; T167-R477 PolarHBondContact OG1-NH2 2.98Å
478L94.5Very high95.8Very high65 Ų6557.6 Ų57.634%0.3432%0.322SS..  trans-82.5135.8162.1-68.4-179.3000109.6L82 Y95 P475 R476L82-L478 WeakPolarHBondContact CD2-O 3.21Å; Y95-L478 WeakPolarHBondContact CE1-O 3.11Å; Y95-L478 PolarHBondContact OH-O 3.01Å; P475-L478 HydrophobicContact CB-CD1 4.11Å; P475-L478 HydrophobicContact CB-CG 4.27Å; P475-L478 HydrophobicContact CG-CD1 3.91Å; R476-L478 PolarHBondContact O-N 3.45Å
479Y95Very high95.8Very high96 Ų9658.3 Ų58.338%0.37633%0.326SS..SBendtrans-88.8-17.1176.978-84.9000112.7Q81 Y95Q81-Y479 VanDerWaalsContact CG-O 3.27Å; Q81-Y479 WeakPolarHBondContact CG-O 2.9Å; Q81-Y479 PolarHBondContact NE2-O 3.48Å; Y95-Y479 VanDerWaalsContact CG-CB 3.48Å
480T96.2Very high95.8Very high31 Ų3160 Ų6019%0.1934%0.335CS..  trans-149.3162.7177.2-167.60000110.6D86D86-T480 VanDerWaalsContact CA-OG1 3.28Å; D86-T480 WeakPolarHBondContact CA-OG1 3.4Å; D86-T480 PolarHBondContact N-OG1 3.2Å
481Y95.8Very high95.8Very high7 Ų760 Ų603%0.02734%0.335CS..  trans-141.7161.1173.157-87.6000109.2L82 T83 P85 D86 M474 W487 F488 N491L82-Y481 VanDerWaalsContact O-CE1 3.32Å; L82-Y481 WeakPolarHBondContact O-CE1 3.43Å; L82-Y481 PolarHBondContact O-OH 2.87Å; L82-Y481 VanDerWaalsContact O-OH 3.07Å; T83-Y481 PolarHBondContact O-OH 2.83Å; P85-Y481 VanDerWaalsContact CA-O 3.27Å; P85-Y481 WeakPolarHBondContact CA-O 3.4Å; P85-Y481 HydrophobicContact CB-CD2 3.84Å; P85-Y481 HydrophobicContact CB-CE2 3.68Å; P85-Y481 WeakPolarHBondContact CB-O 3.19Å; P85-Y481 HydrophobicContact CG-CE2 4.24Å; D86-Y481 PolarHBondContact N-O 3.44Å; D86-Y481 VanDerWaalsContact N-O 3.14Å; M474-Y481 HydrophobicContact CE-CD1 4.15Å; Y481-W487 HydrophobicContact CD2-CB 4.17Å; Y481-W487 HydrophobicContact CE2-CB 4.33Å; Y481-W487 HydrophobicContact CG-CE3 4.16Å; Y481-F488 HydrophobicContact CE2-CB 4.39Å; Y481-N491 HydrophobicContact CE1-CB 4.27Å; Y481-N491 WeakPolarHBondContact OH-CB 3.31Å
482M95.2Very high95.9Very high114 Ų11458.7 Ų58.756%0.56233%0.328SS*.  trans-90.5152.8-178-62.8-173.4-175.800111.1S484 D485M482-S484 WeakPolarHBondContact CB-OG 3.38Å; M482-S484 PolarHBondContact O-N 3.11Å; M482-D485 PolarHBondContact N-OD2 3.47Å; M482-D485 WeakPolarHBondContact O-CB 3.48Å; M482-D485 PolarHBondContact O-N 2.81Å; M482-D485 VanDerWaalsContact O-N 3.1Å
483P93.5Very high96Very high87 Ų8756.8 Ų56.857%0.56532%0.317SS*.G310 helixtrans-58.4-30.6173.6-23.533.2000113.4P85 D86 D485 G486P85-P483 HydrophobicContact CB-CG 3.85Å; P85-P483 HydrophobicContact CG-CB 4.26Å; P85-P483 HydrophobicContact CG-CG 3.81Å; D86-P483 WeakPolarHBondContact OD2-CD 3.49Å; P483-D485 PolarHBondContact O-N 3.06Å; P483-G486 PolarHBondContact O-N 2.88Å
484S93.7Very high96.2Very high102 Ų10255 Ų5571%0.71330%0.298SS*.G310 helixtrans-64.4-21177.750.90000114.1M482 G486M482-S484 WeakPolarHBondContact CB-OG 3.38Å; M482-S484 PolarHBondContact O-N 3.11Å; S484-G486 PolarHBondContact O-N 3.25Å
485D92.9Very high96.2Very high58 Ų5855.6 Ų55.631%0.3130%0.302SS..G310 helixtrans-74.1-15.8-178.5-56.7-27.6000111.8M482 P483 W487M482-D485 PolarHBondContact N-OD2 3.47Å; M482-D485 WeakPolarHBondContact O-CB 3.48Å; M482-D485 PolarHBondContact O-N 2.81Å; M482-D485 VanDerWaalsContact O-N 3.1Å; P483-D485 PolarHBondContact O-N 3.06Å; D485-W487 HydrophobicContact CB-CD2 3.63Å; D485-W487 HydrophobicContact CB-CE3 3.68Å; D485-W487 HydrophobicContact CB-CG 4.12Å; D485-W487 HydrophobicContact CB-CH2 4.17Å; D485-W487 HydrophobicContact CB-CZ2 4.15Å; D485-W487 HydrophobicContact CB-CZ3 3.95Å; D485-W487 PolarHBondContact O-N 3.14Å; D485-W487 PolarHBondContact O-NE1 2.87Å
486G94.3Very high96.2Very high56 Ų5657 Ų5758%0.57731%0.306SS*.  trans75.21.6178.400000115.1P483 S484 F488P483-G486 PolarHBondContact O-N 2.88Å; S484-G486 PolarHBondContact O-N 3.25Å; G486-F488 VanDerWaalsContact C-N 3.32Å; G486-F488 PolarHBondContact O-N 3.02Å
487W97Very high96.3Very high26 Ų2654.8 Ų54.810%0.09830%0.297CS..  trans-81-2.2-173.5-59.7-22.8000115.8L469 D472 M474 Y481 D485 L489 N491L469-W487 HydrophobicContact CD2-CB 3.58Å; L469-W487 HydrophobicContact CD2-CG 3.76Å; D472-W487 PolarHBondContact OD2-NE1 3.49Å; M474-W487 HydrophobicContact CB-CD2 3.82Å; M474-W487 HydrophobicContact CB-CE3 3.9Å; M474-W487 HydrophobicContact CB-CG 4.48Å; M474-W487 HydrophobicContact CB-CH2 4.08Å; M474-W487 HydrophobicContact CB-CZ2 3.98Å; M474-W487 HydrophobicContact CB-CZ3 4.04Å; M474-W487 HydrophobicContact CG-CD2 3.96Å; M474-W487 HydrophobicContact CG-CE3 3.58Å; M474-W487 HydrophobicContact CG-CH2 4.31Å; M474-W487 HydrophobicContact CG-CZ3 3.78Å; M474-W487 HydrophobicContact SD-CD2 4.46Å; M474-W487 HydrophobicContact SD-CE3 4.23Å; Y481-W487 HydrophobicContact CD2-CB 4.17Å; Y481-W487 HydrophobicContact CE2-CB 4.33Å; Y481-W487 HydrophobicContact CG-CE3 4.16Å; D485-W487 HydrophobicContact CB-CD2 3.63Å; D485-W487 HydrophobicContact CB-CE3 3.68Å; D485-W487 HydrophobicContact CB-CG 4.12Å; D485-W487 HydrophobicContact CB-CH2 4.17Å; D485-W487 HydrophobicContact CB-CZ2 4.15Å; D485-W487 HydrophobicContact CB-CZ3 3.95Å; D485-W487 PolarHBondContact O-N 3.14Å; D485-W487 PolarHBondContact O-NE1 2.87Å; W487-L489 PolarHBondContact O-N 3.2Å; W487-N491 WeakPolarHBondContact O-CB 3.4Å; W487-N491 PolarHBondContact O-N 3.49Å; W487-N491 VanDerWaalsContact O-N 3.07Å; W487-N491 PolarHBondContact O-ND2 3.05Å; W487-N491 VanDerWaalsContact O-ND2 3.14Å
488F96.9Very high96.4Very high87 Ų8751.8 Ų51.838%0.38229%0.287SS..Hα-helixtrans-57.2-54-173.4169-119.5000112.8T83 V84 Y481 G486 L490 N491 L492T83-F488 WeakPolarHBondContact O-CE2 3.34Å; V84-F488 HydrophobicContact CB-CE2 4.36Å; V84-F488 HydrophobicContact CG1-CE2 3.78Å; Y481-F488 HydrophobicContact CE2-CB 4.39Å; G486-F488 VanDerWaalsContact C-N 3.32Å; G486-F488 PolarHBondContact O-N 3.02Å; F488-L490 PolarHBondContact O-N 3.41Å; F488-N491 PolarHBondContact O-N 3.04Å; F488-L492 HydrophobicContact CE1-CD2 4.5Å; F488-L492 HydrophobicContact CE2-CB 4.26Å; F488-L492 HydrophobicContact CE2-CD2 4.4Å; F488-L492 HydrophobicContact CZ-CD2 3.92Å; F488-L492 WeakPolarHBondContact O-CB 3.38Å; F488-L492 PolarHBondContact O-N 3.27Å
489L96.9Very high96.5Very high109 Ų10953.3 Ų53.357%0.57130%0.295SS*.Hα-helixtrans-62.2-45-173.7179.961.5000111.9W487 L492 I493W487-L489 PolarHBondContact O-N 3.2Å; L489-L492 PolarHBondContact O-N 3Å; L489-I493 HydrophobicContact CD1-CD1 4.16Å; L489-I493 HydrophobicContact CD1-CG1 4.42Å; L489-I493 HydrophobicContact CG-CD1 4.02Å; L489-I493 VanDerWaalsContact O-CG1 3.26Å; L489-I493 WeakPolarHBondContact O-CG1 3.39Å; L489-I493 PolarHBondContact O-N 2.88Å
490L97.7Very high96.7Very high37 Ų3750.6 Ų50.619%0.19429%0.287CS..Hα-helixtrans-66.9-37.4-179.7-64.3175.1000111.8P465 I468 L469 F488 S494P465-L490 HydrophobicContact CB-CB 4.19Å; P465-L490 HydrophobicContact CB-CD2 4.09Å; I468-L490 HydrophobicContact CB-CD1 3.98Å; I468-L490 HydrophobicContact CG2-CD1 3.61Å; L469-L490 HydrophobicContact CD1-CB 4.01Å; L469-L490 HydrophobicContact CD2-CB 3.66Å; L469-L490 HydrophobicContact CD2-CD1 3.92Å; L469-L490 HydrophobicContact CD2-CG 4.44Å; L469-L490 HydrophobicContact CG-CB 3.67Å; L469-L490 HydrophobicContact CG-CD1 4.01Å; F488-L490 PolarHBondContact O-N 3.41Å; L490-S494 WeakPolarHBondContact O-CB 3.43Å; L490-S494 PolarHBondContact O-N 3.48Å
491N97.9Very high96.8Very high0 Ų050.4 Ų50.40%028%0.284CS..Hα-helixtrans-65.8-45.8171.6-91.2-72.3000111.9R79 L82 M474 Y481 W487 F488 I493 S494 T495R79-N491 PolarHBondContact NH1-OD1 3.33Å; R79-N491 PolarHBondContact NH2-O 3.33Å; R79-N491 PolarHBondContact NH2-OD1 2.8Å; L82-N491 WeakPolarHBondContact O-CB 3.29Å; M474-N491 PolarHBondContact SD-ND2 3.49Å; M474-N491 VanDerWaalsContact SD-ND2 3.42Å; Y481-N491 HydrophobicContact CE1-CB 4.27Å; Y481-N491 WeakPolarHBondContact OH-CB 3.31Å; W487-N491 WeakPolarHBondContact O-CB 3.4Å; W487-N491 PolarHBondContact O-N 3.49Å; W487-N491 VanDerWaalsContact O-N 3.07Å; W487-N491 PolarHBondContact O-ND2 3.05Å; W487-N491 VanDerWaalsContact O-ND2 3.14Å; F488-N491 PolarHBondContact O-N 3.04Å; N491-I493 VanDerWaalsContact C-N 3.31Å; N491-I493 PolarHBondContact O-N 3Å; N491-S494 WeakPolarHBondContact O-CA 3.42Å; N491-S494 WeakPolarHBondContact O-CB 3.31Å; N491-S494 PolarHBondContact O-N 3.37Å; N491-T495 PolarHBondContact O-N 3.46Å; N491-T495 PolarHBondContact O-OG1 3.36Å
492L97.7Very high96.9Very high56 Ų5651.5 Ų51.529%0.29330%0.295SS..Hα-helixtrans-56.9-46.7178.3177.661.8000111.4T83 F488 L489 S494 T495 I496T83-L492 HydrophobicContact CG2-CD1 3.57Å; F488-L492 HydrophobicContact CE1-CD2 4.5Å; F488-L492 HydrophobicContact CE2-CB 4.26Å; F488-L492 HydrophobicContact CE2-CD2 4.4Å; F488-L492 HydrophobicContact CZ-CD2 3.92Å; F488-L492 WeakPolarHBondContact O-CB 3.38Å; F488-L492 PolarHBondContact O-N 3.27Å; L489-L492 PolarHBondContact O-N 3Å; L492-S494 VanDerWaalsContact C-N 3.31Å; L492-S494 PolarHBondContact O-N 2.84Å; L492-T495 WeakPolarHBondContact O-CB 3.49Å; L492-T495 PolarHBondContact O-N 2.94Å; L492-I496 HydrophobicContact CG-CD1 4.28Å; L492-I496 WeakPolarHBondContact O-CG1 3.29Å; L492-I496 PolarHBondContact O-N 3.41Å
493I98.2Very high97Very high57 Ų5749.4 Ų49.429%0.29229%0.285SS..Hα-helixtrans-58.8-44.8175.2-64.9166.8000110.5V461 P465 L489 N491 T495 I496 G497V461-I493 HydrophobicContact CG1-CG2 3.76Å; P465-I493 HydrophobicContact CG-CB 4.28Å; P465-I493 HydrophobicContact CG-CG2 3.71Å; L489-I493 HydrophobicContact CD1-CD1 4.16Å; L489-I493 HydrophobicContact CD1-CG1 4.42Å; L489-I493 HydrophobicContact CG-CD1 4.02Å; L489-I493 VanDerWaalsContact O-CG1 3.26Å; L489-I493 WeakPolarHBondContact O-CG1 3.39Å; L489-I493 PolarHBondContact O-N 2.88Å; N491-I493 VanDerWaalsContact C-N 3.31Å; N491-I493 PolarHBondContact O-N 3Å; I493-T495 VanDerWaalsContact C-N 3.3Å; I493-T495 PolarHBondContact O-N 3.2Å; I493-I496 WeakPolarHBondContact O-CB 3.22Å; I493-I496 PolarHBondContact O-N 3.13Å; I493-I496 VanDerWaalsContact O-N 3.16Å; I493-G497 PolarHBondContact O-N 3Å
494S98.1Very high97.2Very high0 Ų045.2 Ų45.20%026%0.258CS..Hα-helixtrans-60.2-39.2178.2-173.40000112.3R79 C462 Q466 L490 N491 L492 G497 A498R79-S494 PolarHBondContact NE-OG 3.5Å; C462-S494 VanDerWaalsContact O-CB 3.27Å; C462-S494 WeakPolarHBondContact O-CB 3.36Å; C462-S494 PolarHBondContact O-OG 3.37Å; C462-S494 PolarHBondContact SG-O 3.03Å; Q466-S494 PolarHBondContact NE2-OG 3Å; L490-S494 WeakPolarHBondContact O-CB 3.43Å; L490-S494 PolarHBondContact O-N 3.48Å; N491-S494 WeakPolarHBondContact O-CA 3.42Å; N491-S494 WeakPolarHBondContact O-CB 3.31Å; N491-S494 PolarHBondContact O-N 3.37Å; L492-S494 VanDerWaalsContact C-N 3.31Å; L492-S494 PolarHBondContact O-N 2.84Å; S494-G497 PolarHBondContact O-N 3.46Å; S494-A498 PolarHBondContact O-N 2.88Å; S494-A498 VanDerWaalsContact O-N 3.1Å
495T98.2Very high97.2Very high13 Ų1341.6 Ų41.68%0.0823%0.23CC..Hα-helixtrans-65.3-43.2174-60.20000112.2R79 T83 N491 L492 I493 G497 A498 L499R79-T495 HydrophobicContact CB-CG2 4.28Å; R79-T495 PolarHBondContact NH2-OG1 3.15Å; R79-T495 PolarHBondContact O-OG1 2.84Å; R79-T495 VanDerWaalsContact O-OG1 3.08Å; T83-T495 HydrophobicContact CG2-CG2 4.29Å; T83-T495 WeakPolarHBondContact OG1-CG2 3.47Å; T83-T495 PolarHBondContact OG1-OG1 3.47Å; N491-T495 PolarHBondContact O-N 3.46Å; N491-T495 PolarHBondContact O-OG1 3.36Å; L492-T495 WeakPolarHBondContact O-CB 3.49Å; L492-T495 PolarHBondContact O-N 2.94Å; I493-T495 VanDerWaalsContact C-N 3.3Å; I493-T495 PolarHBondContact O-N 3.2Å; T495-G497 VanDerWaalsContact C-N 3.27Å; T495-G497 PolarHBondContact O-N 3.41Å; T495-A498 WeakPolarHBondContact O-CB 3.29Å; T495-A498 PolarHBondContact O-N 3.37Å; T495-A498 VanDerWaalsContact O-N 3.1Å; T495-L499 PolarHBondContact O-N 3.39Å
496I98.2Very high97.4Very high81 Ų8143.9 Ų43.942%0.41524%0.241SC..Hα-helixtrans-58.8-43.3176.2-67.2166.3000110L492 I493 A498 L499 L500L492-I496 HydrophobicContact CG-CD1 4.28Å; L492-I496 WeakPolarHBondContact O-CG1 3.29Å; L492-I496 PolarHBondContact O-N 3.41Å; I493-I496 WeakPolarHBondContact O-CB 3.22Å; I493-I496 PolarHBondContact O-N 3.13Å; I493-I496 VanDerWaalsContact O-N 3.16Å; I496-A498 VanDerWaalsContact C-N 3.31Å; I496-A498 PolarHBondContact O-N 3.27Å; I496-L499 PolarHBondContact O-N 3.41Å; I496-L500 HydrophobicContact CG2-CD1 4.45Å; I496-L500 WeakPolarHBondContact O-CG 3.25Å; I496-L500 PolarHBondContact O-N 2.71Å
497G98.4Very high97.5Very high0 Ų043.9 Ų43.90%023%0.226CC..Hα-helixtrans-58.2-41.6174.400000113G458 I493 S494 T495 L499 L500 M501G458-G497 CarbonylContact C-O 3.27Å; G458-G497 WeakPolarHBondContact CA-O 3.37Å; G458-G497 CarbonylContact O-C 3.49Å; G458-G497 VanDerWaalsContact O-CA 3.27Å; G458-G497 WeakPolarHBondContact O-CA 3.23Å; I493-G497 PolarHBondContact O-N 3Å; S494-G497 PolarHBondContact O-N 3.46Å; T495-G497 VanDerWaalsContact C-N 3.27Å; T495-G497 PolarHBondContact O-N 3.41Å; G497-L499 PolarHBondContact O-N 3.03Å; G497-L500 PolarHBondContact O-N 3.41Å; G497-M501 PolarHBondContact O-N 3.4Å
498A98Very high97.5Very high6 Ų642.9 Ų42.95%0.0522%0.222CC..Hα-helixtrans-62.4-40.9175.300000113.2L76 R79 S494 T495 I496 M501 A502L76-A498 HydrophobicContact CD2-CB 4.14Å; R79-A498 HydrophobicContact CB-CB 4.23Å; R79-A498 HydrophobicContact CG-CB 3.84Å; S494-A498 PolarHBondContact O-N 2.88Å; S494-A498 VanDerWaalsContact O-N 3.1Å; T495-A498 WeakPolarHBondContact O-CB 3.29Å; T495-A498 PolarHBondContact O-N 3.37Å; T495-A498 VanDerWaalsContact O-N 3.1Å; I496-A498 VanDerWaalsContact C-N 3.31Å; I496-A498 PolarHBondContact O-N 3.27Å; A498-M501 HydrophobicContact CB-CE 4.25Å; A498-M501 PolarHBondContact O-N 2.94Å; A498-A502 PolarHBondContact O-N 2.63Å; A498-A502 VanDerWaalsContact O-N 3.09Å
499L97.9Very high97.3Very high96 Ų9641.5 Ų41.550%0.50322%0.22SC..Hα-helixtrans-64.6-39.4174.6-66.7173.4000112.2L76 T495 I496 G497 M501 A502 I503L76-L499 HydrophobicContact CD2-CD2 4.17Å; T495-L499 PolarHBondContact O-N 3.39Å; I496-L499 PolarHBondContact O-N 3.41Å; G497-L499 PolarHBondContact O-N 3.03Å; L499-M501 VanDerWaalsContact C-N 3.35Å; L499-M501 PolarHBondContact O-N 3.33Å; L499-A502 WeakPolarHBondContact O-CB 3.2Å; L499-A502 PolarHBondContact O-N 2.83Å; L499-I503 WeakPolarHBondContact O-CG1 3.38Å; L499-I503 PolarHBondContact O-N 2.9Å
500L98.3Very high97.3Very high40 Ų4040 Ų4021%0.20922%0.215CC..Hα-helixtrans-62.2-40.8174.9-69.3175.2000112F454 I457 I496 G497 A502 I503 G504F454-L500 HydrophobicContact CD1-CD2 4.01Å; F454-L500 HydrophobicContact CE1-CD2 4.18Å; I457-L500 HydrophobicContact CG2-CD1 4.43Å; I496-L500 HydrophobicContact CG2-CD1 4.45Å; I496-L500 WeakPolarHBondContact O-CG 3.25Å; I496-L500 PolarHBondContact O-N 2.71Å; G497-L500 PolarHBondContact O-N 3.41Å; L500-A502 VanDerWaalsContact C-N 3.33Å; L500-A502 PolarHBondContact O-N 3.12Å; L500-I503 PolarHBondContact O-N 3.46Å; L500-G504 PolarHBondContact O-N 2.99Å
501M98.1Very high97.3Very high27 Ų2738.2 Ų38.213%0.13321%0.206CC..Hα-helixtrans-62.6-40174-68.1-173-66.700112.1F455 F459 C462 F463 G497 A498 L499 G504 F505F455-M501 HydrophobicContact CD2-CB 4.25Å; F455-M501 WeakPolarHBondContact CD2-O 3.48Å; F455-M501 HydrophobicContact CE1-SD 4.47Å; F455-M501 HydrophobicContact CE2-CB 4.2Å; F459-M501 HydrophobicContact CB-CG 4.49Å; F459-M501 HydrophobicContact CB-SD 4.01Å; F459-M501 HydrophobicContact CD2-SD 4.4Å; C462-M501 HydrophobicContact CB-CE 3.78Å; F463-M501 HydrophobicContact CE2-CE 3.87Å; F463-M501 HydrophobicContact CE2-SD 4.17Å; F463-M501 HydrophobicContact CZ-CE 4.41Å; G497-M501 PolarHBondContact O-N 3.4Å; A498-M501 HydrophobicContact CB-CE 4.25Å; A498-M501 PolarHBondContact O-N 2.94Å; L499-M501 VanDerWaalsContact C-N 3.35Å; L499-M501 PolarHBondContact O-N 3.33Å; M501-G504 PolarHBondContact O-N 2.61Å; M501-F505 PolarHBondContact O-N 2.81Å
502A97.2Very high97.1Very high30 Ų3040.3 Ų40.325%0.24822%0.217CC..Hα-helixtrans-62.1-43.7175.600000111.9L76 A498 L499 L500 G504 F505 L506L76-A502 HydrophobicContact CD1-CB 3.9Å; L76-A502 HydrophobicContact CD2-CB 4.17Å; A498-A502 PolarHBondContact O-N 2.63Å; A498-A502 VanDerWaalsContact O-N 3.09Å; L499-A502 WeakPolarHBondContact O-CB 3.2Å; L499-A502 PolarHBondContact O-N 2.83Å; L500-A502 VanDerWaalsContact C-N 3.33Å; L500-A502 PolarHBondContact O-N 3.12Å; A502-G504 VanDerWaalsContact C-N 3.32Å; A502-G504 PolarHBondContact O-N 3.41Å; A502-F505 PolarHBondContact O-N 3.06Å; A502-L506 WeakPolarHBondContact O-CG 3.38Å; A502-L506 PolarHBondContact O-N 2.88Å
503I97.7Very high97Very high69 Ų6941.3 Ų41.335%0.35423%0.226SC..Hα-helixtrans-59.8-43.6172.9-66.7166.1000110.7F454 L499 L500 F505 L506 F507F454-I503 HydrophobicContact CD1-CB 4.27Å; F454-I503 HydrophobicContact CD1-CG2 3.75Å; F454-I503 HydrophobicContact CD2-CG2 4.48Å; F454-I503 HydrophobicContact CE1-CG2 3.93Å; F454-I503 HydrophobicContact CG-CG2 4.05Å; F454-I503 HydrophobicContact CZ-CG2 4.38Å; L499-I503 WeakPolarHBondContact O-CG1 3.38Å; L499-I503 PolarHBondContact O-N 2.9Å; L500-I503 PolarHBondContact O-N 3.46Å; I503-F505 PolarHBondContact O-N 3.18Å; I503-L506 WeakPolarHBondContact O-CB 3.25Å; I503-L506 PolarHBondContact O-N 2.83Å; I503-F507 HydrophobicContact CG2-CD2 4.14Å; I503-F507 HydrophobicContact CG2-CE2 3.75Å; I503-F507 VanDerWaalsContact O-CD2 3.28Å; I503-F507 WeakPolarHBondContact O-CD2 3.34Å; I503-F507 PolarHBondContact O-N 3.07Å; I503-F507 VanDerWaalsContact O-N 3.17Å
504G97.2Very high96.9Very high0 Ų043.8 Ų43.80%023%0.232CC..Hα-helixtrans-56.7-47.1175.200000112.4C451 L500 M501 A502 L506 F507 L508C451-G504 WeakPolarHBondContact CA-O 3.33Å; C451-G504 WeakPolarHBondContact CB-O 3.38Å; C451-G504 PolarHBondContact SG-O 3.23Å; L500-G504 PolarHBondContact O-N 2.99Å; M501-G504 PolarHBondContact O-N 2.61Å; A502-G504 VanDerWaalsContact C-N 3.32Å; A502-G504 PolarHBondContact O-N 3.41Å; G504-L506 VanDerWaalsContact C-N 3.34Å; G504-L506 PolarHBondContact O-N 3.22Å; G504-F507 WeakPolarHBondContact O-CB 3.41Å; G504-F507 PolarHBondContact O-N 2.93Å; G504-L508 PolarHBondContact O-N 3.44Å
505F95.1Very high96.7Very high26 Ų2643.8 Ų43.811%0.11423%0.232CC..Hα-helixtrans-64.6-36176.8-176.6-103.3000112.9V65 F68 V69 M501 A502 I503 F507 L508 V509V65-F505 HydrophobicContact CG1-CZ 4.41Å; F68-F505 AromaticContact CD1-CD2 3.62Å; F68-F505 HydrophobicContact CD1-CD2 3.62Å; F68-F505 HydrophobicContact CD1-CE1 4.46Å; F68-F505 AromaticContact CD1-CE2 3.3Å; F68-F505 HydrophobicContact CD1-CE2 3.3Å; F68-F505 HydrophobicContact CD1-CG 4.3Å; F68-F505 AromaticContact CD1-CZ 3.78Å; F68-F505 HydrophobicContact CD1-CZ 3.78Å; F68-F505 AromaticContact CE1-CD2 3.32Å; F68-F505 HydrophobicContact CE1-CD2 3.32Å; F68-F505 AromaticContact CE1-CE2 3.55Å; F68-F505 HydrophobicContact CE1-CE2 3.55Å; F68-F505 AromaticContact CE1-CG 3.94Å; F68-F505 HydrophobicContact CE1-CG 3.94Å; F68-F505 HydrophobicContact CE1-CZ 4.34Å; F68-F505 HydrophobicContact CG-CE2 4.48Å; V69-F505 HydrophobicContact CG2-CE1 3.54Å; V69-F505 HydrophobicContact CG2-CZ 3.74Å; M501-F505 PolarHBondContact O-N 2.81Å; A502-F505 PolarHBondContact O-N 3.06Å; I503-F505 PolarHBondContact O-N 3.18Å; F505-F507 VanDerWaalsContact C-N 3.28Å; F505-F507 PolarHBondContact O-N 3.38Å; F505-L508 HydrophobicContact CD2-CD2 4.18Å; F505-L508 HydrophobicContact CE2-CD2 4.03Å; F505-L508 WeakPolarHBondContact O-CB 3.43Å; F505-L508 PolarHBondContact O-N 3.27Å; F505-L508 VanDerWaalsContact O-N 3.08Å; F505-V509 HydrophobicContact CD1-CG2 4.12Å; F505-V509 HydrophobicContact CE1-CG2 3.64Å; F505-V509 HydrophobicContact CZ-CG2 4.01Å; F505-V509 PolarHBondContact O-N 2.87Å; F505-V509 VanDerWaalsContact O-N 3.1Å
506L96.1Very high96.5Very high106 Ų10647.4 Ų47.456%0.55525%0.248SC*.Hα-helixtrans-59.8-38.2174-70.8173.5000112A502 I503 G504 L508 V509 V510A502-L506 WeakPolarHBondContact O-CG 3.38Å; A502-L506 PolarHBondContact O-N 2.88Å; I503-L506 WeakPolarHBondContact O-CB 3.25Å; I503-L506 PolarHBondContact O-N 2.83Å; G504-L506 VanDerWaalsContact C-N 3.34Å; G504-L506 PolarHBondContact O-N 3.22Å; L506-L508 VanDerWaalsContact C-N 3.3Å; L506-L508 PolarHBondContact O-N 2.98Å; L506-V509 PolarHBondContact O-N 3.47Å; L506-V510 VanDerWaalsContact O-CG2 3.32Å; L506-V510 WeakPolarHBondContact O-CG2 3.19Å; L506-V510 PolarHBondContact O-N 2.78Å
507F97.6Very high96.3Very high56 Ų5650.8 Ų50.825%0.24626%0.26CS..Hα-helixtrans-60.9-36.7173.8-80-71.5000112.9L447 W450 C451 F454 I503 G504 F505 V510 S511L447-F507 HydrophobicContact CD2-CD1 4.1Å; W450-F507 HydrophobicContact CB-CB 4.39Å; W450-F507 HydrophobicContact CB-CD1 3.73Å; W450-F507 HydrophobicContact CB-CD2 4.01Å; W450-F507 HydrophobicContact CB-CE1 3.9Å; W450-F507 HydrophobicContact CB-CE2 4.18Å; W450-F507 HydrophobicContact CB-CG 3.79Å; W450-F507 HydrophobicContact CB-CZ 4.12Å; W450-F507 HydrophobicContact CG-CD1 4.44Å; W450-F507 HydrophobicContact CG-CE1 4.2Å; W450-F507 HydrophobicContact CG-CZ 4.41Å; C451-F507 HydrophobicContact CB-CB 3.88Å; F454-F507 AromaticContact CD2-CD2 3.98Å; F454-F507 HydrophobicContact CD2-CD2 3.98Å; F454-F507 AromaticContact CD2-CE2 3.53Å; F454-F507 HydrophobicContact CD2-CE2 3.53Å; F454-F507 HydrophobicContact CD2-CZ 4.45Å; F454-F507 HydrophobicContact CE2-CD2 4.44Å; F454-F507 AromaticContact CE2-CE2 3.55Å; F454-F507 HydrophobicContact CE2-CE2 3.55Å; F454-F507 HydrophobicContact CE2-CZ 4.12Å; F454-F507 HydrophobicContact CG-CE2 4.28Å; F454-F507 HydrophobicContact CZ-CE2 4.32Å; I503-F507 HydrophobicContact CG2-CD2 4.14Å; I503-F507 HydrophobicContact CG2-CE2 3.75Å; I503-F507 VanDerWaalsContact O-CD2 3.28Å; I503-F507 WeakPolarHBondContact O-CD2 3.34Å; I503-F507 PolarHBondContact O-N 3.07Å; I503-F507 VanDerWaalsContact O-N 3.17Å; G504-F507 WeakPolarHBondContact O-CB 3.41Å; G504-F507 PolarHBondContact O-N 2.93Å; F505-F507 VanDerWaalsContact C-N 3.28Å; F505-F507 PolarHBondContact O-N 3.38Å; F507-V510 PolarHBondContact O-N 2.76Å; F507-S511 WeakPolarHBondContact O-CB 3.25Å; F507-S511 PolarHBondContact O-N 3.11Å
508L95.2Very high96.1Very high4 Ų457.9 Ų57.92%0.02129%0.29CS..Hα-helixtrans-64.9-44.2173.9-179.168.3000111.6L428 L431 I432 C451 G504 F505 L506 V510 S511 I512L428-L508 HydrophobicContact CD2-CD2 3.65Å; L431-L508 HydrophobicContact CD2-CD2 4.37Å; I432-L508 HydrophobicContact CD1-CD1 4.44Å; I432-L508 HydrophobicContact CG1-CD1 4.38Å; C451-L508 HydrophobicContact CB-CB 4.37Å; G504-L508 PolarHBondContact O-N 3.44Å; F505-L508 HydrophobicContact CD2-CD2 4.18Å; F505-L508 HydrophobicContact CE2-CD2 4.03Å; F505-L508 WeakPolarHBondContact O-CB 3.43Å; F505-L508 PolarHBondContact O-N 3.27Å; F505-L508 VanDerWaalsContact O-N 3.08Å; L506-L508 VanDerWaalsContact C-N 3.3Å; L506-L508 PolarHBondContact O-N 2.98Å; L508-V510 VanDerWaalsContact C-N 3.33Å; L508-V510 PolarHBondContact O-N 2.69Å; L508-S511 WeakPolarHBondContact O-CB 3.32Å; L508-S511 PolarHBondContact O-N 3.34Å; L508-S511 VanDerWaalsContact O-N 3.15Å; L508-I512 HydrophobicContact CG-CD1 4.16Å; L508-I512 WeakPolarHBondContact O-CG1 3.49Å; L508-I512 PolarHBondContact O-N 2.99Å
509V94.5Very high95.7Very high58 Ų5858.6 Ų58.635%0.35230%0.295SS..Hα-helixtrans-59.9-46.4176.3176.30000110.4F505 L506 S511 I512 V513F505-V509 HydrophobicContact CD1-CG2 4.12Å; F505-V509 HydrophobicContact CE1-CG2 3.64Å; F505-V509 HydrophobicContact CZ-CG2 4.01Å; F505-V509 PolarHBondContact O-N 2.87Å; F505-V509 VanDerWaalsContact O-N 3.1Å; L506-V509 PolarHBondContact O-N 3.47Å; V509-S511 VanDerWaalsContact C-N 3.3Å; V509-S511 PolarHBondContact O-N 2.97Å; V509-I512 PolarHBondContact O-N 3.12Å; V509-V513 WeakPolarHBondContact O-CG2 3.5Å; V509-V513 PolarHBondContact O-N 3.21Å
510V96.4Very high95.3Very high77 Ų7758.6 Ų58.647%0.46730%0.301SS..Hα-helixtrans-61.6-39.1175.6176.50000110.9L447 L506 F507 L508 V513 Y514L447-V510 HydrophobicContact CD1-CG1 4Å; L447-V510 HydrophobicContact CD2-CG1 4.3Å; L506-V510 VanDerWaalsContact O-CG2 3.32Å; L506-V510 WeakPolarHBondContact O-CG2 3.19Å; L506-V510 PolarHBondContact O-N 2.78Å; F507-V510 PolarHBondContact O-N 2.76Å; L508-V510 VanDerWaalsContact C-N 3.33Å; L508-V510 PolarHBondContact O-N 2.69Å; V510-V513 PolarHBondContact O-N 2.98Å; V510-Y514 WeakPolarHBondContact O-CB 3.26Å; V510-Y514 PolarHBondContact O-N 2.99Å
511S96.9Very high94.9Very high0 Ų063.7 Ų63.70%032%0.317CS..Hα-helixtrans-60.3-47.5175.2-171.40000112N444 N448 F507 L508 V509 V513 S515N444-S511 PolarHBondContact N-OG 3.47Å; N444-S511 PolarHBondContact O-OG 3.49Å; N448-S511 VanDerWaalsContact OD1-CB 3.29Å; N448-S511 WeakPolarHBondContact OD1-CB 3.32Å; N448-S511 PolarHBondContact OD1-OG 3.24Å; F507-S511 WeakPolarHBondContact O-CB 3.25Å; F507-S511 PolarHBondContact O-N 3.11Å; L508-S511 WeakPolarHBondContact O-CB 3.32Å; L508-S511 PolarHBondContact O-N 3.34Å; L508-S511 VanDerWaalsContact O-N 3.15Å; V509-S511 VanDerWaalsContact C-N 3.3Å; V509-S511 PolarHBondContact O-N 2.97Å; S511-V513 PolarHBondContact O-N 3.46Å; S511-S515 WeakPolarHBondContact O-CB 3.41Å; S511-S515 PolarHBondContact O-N 2.94Å; S511-S515 PolarHBondContact O-OG 3.14Å
512I94.9Very high94.5Very high44 Ų4464 Ų6423%0.22632%0.318CS..Hα-helixtrans-59.9-49177.4-70.1166.6000111Y435 L443 L508 V509 H516Y435-I512 HydrophobicContact CE2-CG1 4.39Å; L443-I512 HydrophobicContact CD1-CG1 4.28Å; L443-I512 HydrophobicContact CD2-CG1 4.06Å; L508-I512 HydrophobicContact CG-CD1 4.16Å; L508-I512 WeakPolarHBondContact O-CG1 3.49Å; L508-I512 PolarHBondContact O-N 2.99Å; V509-I512 PolarHBondContact O-N 3.12Å; I512-H516 WeakPolarHBondContact O-CB 3.48Å; I512-H516 PolarHBondContact O-N 2.98Å; I512-H516 VanDerWaalsContact O-N 3.07Å
513V94.8Very high93.9Very high78 Ų7863.5 Ų63.547%0.47331%0.314SS..Hα-helixtrans-65.4-49.4-179.3174.40000110.8V509 V510 S511 S515 H516 F517V509-V513 WeakPolarHBondContact O-CG2 3.5Å; V509-V513 PolarHBondContact O-N 3.21Å; V510-V513 PolarHBondContact O-N 2.98Å; S511-V513 PolarHBondContact O-N 3.46Å; V513-S515 PolarHBondContact O-N 3.38Å; V513-H516 PolarHBondContact O-N 3.48Å; V513-F517 HydrophobicContact CG1-CD2 4.27Å; V513-F517 HydrophobicContact CG1-CE2 4.02Å; V513-F517 WeakPolarHBondContact O-CD2 3.31Å
514Y95.6Very high93.4Very high109 Ų10961.5 Ų61.543%0.42731%0.305SS..Hα-helixtrans-58.6-49179.4177.7-89.5000111.3N444 L447 V510 H516 F517 K518N444-Y514 HydrophobicContact CB-CD1 3.87Å; N444-Y514 HydrophobicContact CB-CE1 4.21Å; L447-Y514 HydrophobicContact CD1-CD1 4.32Å; L447-Y514 HydrophobicContact CD1-CG 4.14Å; V510-Y514 WeakPolarHBondContact O-CB 3.26Å; V510-Y514 PolarHBondContact O-N 2.99Å; Y514-H516 VanDerWaalsContact C-N 3.33Å; Y514-H516 PolarHBondContact O-N 3Å; Y514-F517 PolarHBondContact O-N 3.18Å; Y514-K518 HydrophobicContact CD1-CB 4.26Å; Y514-K518 HydrophobicContact CD2-CG 4.27Å; Y514-K518 HydrophobicContact CE1-CB 3.84Å; Y514-K518 HydrophobicContact CE1-CG 4.41Å; Y514-K518 HydrophobicContact CE2-CB 4.26Å; Y514-K518 HydrophobicContact CE2-CG 3.92Å; Y514-K518 WeakPolarHBondContact O-CB 3.27Å; Y514-K518 PolarHBondContact O-N 3.48Å
515S95.2Very high92.9Very high0 Ų061.6 Ų61.60%031%0.307CS..Hα-helixtrans-66.7-32.9-177.9-75.10000113.5L443 N444 S511 V513 F517 S519L443-S515 WeakPolarHBondContact CA-OG 3.41Å; N444-S515 PolarHBondContact N-OG 3.27Å; S511-S515 WeakPolarHBondContact O-CB 3.41Å; S511-S515 PolarHBondContact O-N 2.94Å; S511-S515 PolarHBondContact O-OG 3.14Å; V513-S515 PolarHBondContact O-N 3.38Å; S515-F517 PolarHBondContact O-N 3.05Å; S515-S519 WeakPolarHBondContact CA-OG 3.1Å; S515-S519 WeakPolarHBondContact CB-OG 3.35Å; S515-S519 VanDerWaalsContact O-CB 3.25Å; S515-S519 WeakPolarHBondContact O-CB 3.43Å; S515-S519 PolarHBondContact O-N 3.12Å; S515-S519 PolarHBondContact OG-OG 3.16Å
516H93.4Very high92.8Very high88 Ų8861 Ų6141%0.40730%0.304SS..Hα-helixtrans-57-38.2174.1-177.971.3000112.8Y441 I512 V513 Y514 R521Y441-H516 PolarHBondContact OH-ND1 3.15Å; I512-H516 WeakPolarHBondContact O-CB 3.48Å; I512-H516 PolarHBondContact O-N 2.98Å; I512-H516 VanDerWaalsContact O-N 3.07Å; V513-H516 PolarHBondContact O-N 3.48Å; Y514-H516 VanDerWaalsContact C-N 3.33Å; Y514-H516 PolarHBondContact O-N 3Å; H516-R521 PolarHBondContact O-NH2 3.23Å
517F93.6Very high92.4Very high153 Ų15356 Ų5667%0.67128%0.278SS*.Hα-helixtrans-93.9-26.5-177.8-64.6-66000114.5V513 Y514 S515V513-F517 HydrophobicContact CG1-CD2 4.27Å; V513-F517 HydrophobicContact CG1-CE2 4.02Å; V513-F517 WeakPolarHBondContact O-CD2 3.31Å; Y514-F517 PolarHBondContact O-N 3.18Å; S515-F517 PolarHBondContact O-N 3.05Å
518K93.8Very high92.1Very high148 Ų14854 Ų5464%0.64327%0.269SS*.Hα-helixtrans-121-22-167.8-63.3-64.1-173.7179.60115.4Y514Y514-K518 HydrophobicContact CD1-CB 4.26Å; Y514-K518 HydrophobicContact CD2-CG 4.27Å; Y514-K518 HydrophobicContact CE1-CB 3.84Å; Y514-K518 HydrophobicContact CE1-CG 4.41Å; Y514-K518 HydrophobicContact CE2-CB 4.26Å; Y514-K518 HydrophobicContact CE2-CG 3.92Å; Y514-K518 WeakPolarHBondContact O-CB 3.27Å; Y514-K518 PolarHBondContact O-N 3.48Å
519S90.8Very high91.7Very high21 Ų2160.1 Ų60.115%0.14730%0.302CS..SBendtrans-71.8139.4-178.7-70.70000110.8K442 S515K442-S519 VanDerWaalsContact O-CB 3.31Å; K442-S519 WeakPolarHBondContact O-CB 3.29Å; K442-S519 PolarHBondContact O-OG 2.95Å; S515-S519 WeakPolarHBondContact CA-OG 3.1Å; S515-S519 WeakPolarHBondContact CB-OG 3.35Å; S515-S519 VanDerWaalsContact O-CB 3.25Å; S515-S519 WeakPolarHBondContact O-CB 3.43Å; S515-S519 PolarHBondContact O-N 3.12Å; S515-S519 PolarHBondContact OG-OG 3.16Å
520P89.9Confident91.2Very high96 Ų9659.1 Ų59.162%0.62330%0.303SS*.PPolyproline II helixtrans-62.5151.1171.928.3-34.1000110.4Y441Y441-P520 VanDerWaalsContact CB-O 3.25Å; Y441-P520 WeakPolarHBondContact CB-O 3.14Å
521R89.6Confident91Very high148 Ų14856.7 Ų56.756%0.55829%0.287SS*.PPolyproline II helixtrans-81.9132.4174.8-59.3-63.1169.8159.9-8.2108.6M439 G440 H516M439-R521 PolarHBondContact O-NH1 3.5Å; G440-R521 WeakPolarHBondContact O-CA 3.45Å; H516-R521 PolarHBondContact O-NH2 3.23Å
522E88.5Confident90.8Very high33 Ų3356.7 Ų56.715%0.15429%0.287CS..PPolyproline II helixtrans-90.1129.5179.1-59.3-90.6146.900109G440 K442 N527 A542 E654G440-E522 PolarHBondContact O-N 3.23Å; K442-E522 WeakPolarHBondContact CE-OE1 3.07Å; K442-E522 WeakPolarHBondContact CE-OE2 3.42Å; K442-E522 IonicContact NZ-OE1 2.63Å; K442-E522 IonicContact NZ-OE2 3.59Å; E522-N527 WeakPolarHBondContact CB-ND2 3.41Å; E522-N527 WeakPolarHBondContact CG-ND2 3.32Å; E522-N527 PolarHBondContact OE2-ND2 3.25Å; E522-A542 HydrophobicContact CB-CB 3.87Å; E522-A542 WeakPolarHBondContact O-CB 3.49Å; E522-E654 WeakPolarHBondContact CA-OE1 3.43Å
523A84.7Confident90.7Very high19 Ų1955.4 Ų55.416%0.15728%0.28CS..  trans-91-32.3174.900000111.5S541 A542 A650 R651 E654A523-S541 WeakPolarHBondContact O-CA 3.16Å; A523-S541 WeakPolarHBondContact O-CB 3.39Å; A523-A542 PolarHBondContact O-N 3.42Å; A523-A650 HydrophobicContact CB-CB 4.05Å; A523-A650 WeakPolarHBondContact CB-O 3.31Å; A523-R651 HydrophobicContact CB-CG 4.33Å; A523-R651 WeakPolarHBondContact O-CG 3.5Å; A523-E654 HydrophobicContact CB-CB 3.92Å; A523-E654 HydrophobicContact CB-CG 4.43Å; A523-E654 WeakPolarHBondContact CB-OE2 3.48Å; A523-E654 PolarHBondContact N-OE1 2.94Å; A523-E654 PolarHBondContact N-OE2 3.36Å
524T87.9Confident90.7Very high27 Ų2751.7 Ų51.717%0.16626%0.257CS..  trans-71.8146.7-175.9-176.90000113.6D526 N527 A542 E654T524-D526 VanDerWaalsContact C-N 3.31Å; T524-D526 WeakPolarHBondContact CG2-O 3.14Å; T524-D526 PolarHBondContact OG1-N 2.94Å; T524-N527 PolarHBondContact O-ND2 3.12Å; T524-N527 VanDerWaalsContact O-ND2 3.12Å; T524-N527 PolarHBondContact O-OD1 3.48Å; T524-N527 VanDerWaalsContact O-OD1 3.13Å; T524-A542 VanDerWaalsContact O-CA 3.28Å; T524-A542 WeakPolarHBondContact O-CA 3.46Å; T524-A542 WeakPolarHBondContact O-CB 3.06Å; T524-A542 PolarHBondContact O-N 3.48Å; T524-A542 VanDerWaalsContact O-N 3.14Å; T524-E654 WeakPolarHBondContact CA-OE2 3.11Å; T524-E654 WeakPolarHBondContact CB-OE2 3.16Å; T524-E654 WeakPolarHBondContact CG2-OE2 3.03Å; T524-E654 PolarHBondContact N-OE2 3.33Å
525G87.3Confident90.6Very high3 Ų346.5 Ų46.53%0.03124%0.237CC..SBendtrans-69.6-25.3167.400000113.2K437 N527 W537 T539K437-G525 WeakPolarHBondContact CE-O 3.29Å; K437-G525 PolarHBondContact NZ-O 3.37Å; G525-N527 PolarHBondContact O-OD1 3.31Å; G525-W537 CarbonylContact C-O 3.57Å; G525-W537 CarbonylContact O-C 3.52Å; G525-W537 VanDerWaalsContact O-CA 3.32Å; G525-W537 WeakPolarHBondContact O-CA 3.07Å; G525-W537 VanDerWaalsContact O-O 3.07Å; G525-T539 WeakPolarHBondContact CA-O 3.5Å
526D91.8Very high90.6Very high13 Ų1346.6 Ų46.67%0.0724%0.237CC..  trans-108.383.2-178.3-166.3-11.9000109.7T524 W528 G530 L531 G532 W537 F561 K565T524-D526 VanDerWaalsContact C-N 3.31Å; T524-D526 WeakPolarHBondContact CG2-O 3.14Å; T524-D526 PolarHBondContact OG1-N 2.94Å; D526-W528 VanDerWaalsContact C-N 3.29Å; D526-W528 PolarHBondContact O-N 3.42Å; D526-G530 VanDerWaalsContact CG-CA 3.42Å; D526-G530 WeakPolarHBondContact OD2-CA 3.4Å; D526-L531 PolarHBondContact OD1-N 3.24Å; D526-G532 WeakPolarHBondContact OD1-CA 3.49Å; D526-G532 PolarHBondContact OD1-N 3.08Å; D526-G532 PolarHBondContact OD2-N 3.32Å; D526-W537 HydrophobicContact CB-CB 4.47Å; D526-W537 PolarHBondContact N-O 3.09Å; D526-F561 HydrophobicContact CB-CE1 4.48Å; D526-F561 HydrophobicContact CB-CZ 4.47Å; D526-F561 WeakPolarHBondContact OD2-CE1 3.32Å; D526-K565 IonicContact OD2-NZ 3.17Å; D526-K565 PolarHBondContact OD2-NZ 3.35Å
527N88Confident90.6Very high1 Ų142.4 Ų42.41%0.00522%0.218CC..THydrogen-bonded Turntrans-79.7-3.7-167.7-59.186.5000114.6P436 K437 K442 E522 T524 G525 W537 A542P436-N527 HydrophobicContact CB-CB 3.64Å; P436-N527 HydrophobicContact CG-CB 3.97Å; K437-N527 WeakPolarHBondContact CE-OD1 3.45Å; K437-N527 PolarHBondContact NZ-OD1 3.21Å; K442-N527 VanDerWaalsContact CD-O 3.31Å; K442-N527 WeakPolarHBondContact CD-O 3.49Å; K442-N527 WeakPolarHBondContact CE-O 3.49Å; K442-N527 PolarHBondContact NZ-O 3.43Å; E522-N527 WeakPolarHBondContact CB-ND2 3.41Å; E522-N527 WeakPolarHBondContact CG-ND2 3.32Å; E522-N527 PolarHBondContact OE2-ND2 3.25Å; T524-N527 PolarHBondContact O-ND2 3.12Å; T524-N527 VanDerWaalsContact O-ND2 3.12Å; T524-N527 PolarHBondContact O-OD1 3.48Å; T524-N527 VanDerWaalsContact O-OD1 3.13Å; G525-N527 PolarHBondContact O-OD1 3.31Å; N527-W537 HydrophobicContact CB-CZ3 4.4Å; N527-A542 WeakPolarHBondContact ND2-CB 3.49Å
528W91.6Very high90.5Very high15 Ų1535.2 Ų35.26%0.05719%0.186CC..THydrogen-bonded Turntrans-107.752.6-180-65.7106.1000110.3F300 E373 P375 I432 F433 K442 D526 G530 L531 W537F300-W528 HydrophobicContact CE1-CB 4.26Å; F300-W528 HydrophobicContact CE1-CD2 4.04Å; F300-W528 AromaticContact CE1-CE3 3.77Å; F300-W528 HydrophobicContact CE1-CE3 3.77Å; F300-W528 HydrophobicContact CE1-CG 4.26Å; F300-W528 HydrophobicContact CE1-CZ3 4.47Å; F300-W528 AromaticContact CZ-CD2 3.69Å; F300-W528 HydrophobicContact CZ-CD2 3.69Å; F300-W528 AromaticContact CZ-CE3 3.63Å; F300-W528 HydrophobicContact CZ-CE3 3.63Å; F300-W528 HydrophobicContact CZ-CG 4.1Å; F300-W528 HydrophobicContact CZ-CZ3 4.09Å; E373-W528 HydrophobicContact CB-CZ3 4.28Å; E373-W528 HydrophobicContact CG-CE3 4.32Å; E373-W528 HydrophobicContact CG-CZ3 4.15Å; P375-W528 HydrophobicContact CG-CH2 4.14Å; P375-W528 HydrophobicContact CG-CZ2 4.33Å; I432-W528 HydrophobicContact CG2-CH2 4.43Å; F433-W528 AromaticContact CD2-CD1 3.9Å; F433-W528 HydrophobicContact CD2-CD2 4.43Å; F433-W528 AromaticContact CD2-CE2 3.75Å; F433-W528 HydrophobicContact CD2-CZ2 4.19Å; F433-W528 AromaticContact CD2-NE1 3.36Å; F433-W528 AromaticContact CE2-CD1 3.6Å; F433-W528 HydrophobicContact CE2-CG 4.23Å; F433-W528 AromaticContact CE2-NE1 3.57Å; F433-W528 WeakPolarHBondContact O-CZ2 3.45Å; F433-W528 PolarHBondContact O-NE1 3.21Å; K442-W528 HydrophobicContact CD-CZ3 4.4Å; D526-W528 VanDerWaalsContact C-N 3.29Å; D526-W528 PolarHBondContact O-N 3.42Å; W528-G530 PolarHBondContact O-N 3.28Å; W528-L531 HydrophobicContact CB-CB 4.43Å; W528-L531 WeakPolarHBondContact O-CB 3.33Å; W528-L531 WeakPolarHBondContact O-CG 3.32Å; W528-L531 PolarHBondContact O-N 2.83Å; W528-W537 AromaticContact CD1-CH2 3.62Å; W528-W537 AromaticContact CD1-CZ3 3.76Å; W528-W537 AromaticContact NE1-CH2 3.55Å; W528-W537 AromaticContact NE1-CZ3 3.97Å
529D85.4Confident90.4Very high132 Ų13228.2 Ų28.271%0.70616%0.156SC*.THydrogen-bonded Turntrans53.738.7177.5-52-22.3000113.5K442 L531K442-D529 IonicContact NZ-OD1 2.75Å; D529-L531 VanDerWaalsContact C-N 3.33Å; D529-L531 PolarHBondContact O-N 2.99Å
530G84.7Confident90.2Very high37 Ų3727.3 Ų27.338%0.38115%0.15SC..THydrogen-bonded Turntrans76.716.2-178.900000114.2D526 W528 K565D526-G530 VanDerWaalsContact CG-CA 3.42Å; D526-G530 WeakPolarHBondContact OD2-CA 3.4Å; W528-G530 PolarHBondContact O-N 3.28Å; G530-K565 PolarHBondContact O-NZ 3.02Å
531L92.2Very high90.1Very high25 Ų2523.4 Ų23.413%0.13113%0.125CC..  trans-89.2-13-179.6-61.2180000114.2T299 F300 R302 D526 W528 D529 R533T299-L531 HydrophobicContact CG2-CB 3.98Å; F300-L531 HydrophobicContact CD1-CD1 4.16Å; R302-L531 HydrophobicContact CG-CD2 3.91Å; D526-L531 PolarHBondContact OD1-N 3.24Å; W528-L531 HydrophobicContact CB-CB 4.43Å; W528-L531 WeakPolarHBondContact O-CB 3.33Å; W528-L531 WeakPolarHBondContact O-CG 3.32Å; W528-L531 PolarHBondContact O-N 2.83Å; D529-L531 VanDerWaalsContact C-N 3.33Å; D529-L531 PolarHBondContact O-N 2.99Å; L531-R533 WeakPolarHBondContact O-CG 3.16Å; L531-R533 PolarHBondContact O-N 3.5Å
532G92.2Very high90.1Very high0 Ų016.4 Ų16.40%010%0.099CC..  trans-55.4135.7-178.800000112.4D526 F561 K565D526-G532 WeakPolarHBondContact OD1-CA 3.49Å; D526-G532 PolarHBondContact OD1-N 3.08Å; D526-G532 PolarHBondContact OD2-N 3.32Å; G532-F561 WeakPolarHBondContact O-CD1 3.27Å; G532-F561 WeakPolarHBondContact O-CE1 3.49Å; G532-K565 PolarHBondContact O-NZ 3.49Å
533R94Very high90.3Very high18 Ų1819 Ų197%0.06811%0.113CC..  trans-108.7-21.9-173-56-17472.985.6-4.3114.3L531 D559 F561 V562L531-R533 WeakPolarHBondContact O-CG 3.16Å; L531-R533 PolarHBondContact O-N 3.5Å; R533-D559 IonicContact CZ-OD1 3.67Å; R533-D559 IonicContact CZ-OD2 2.83Å; R533-D559 IonicContact NE-OD1 3.29Å; R533-D559 PolarHBondContact NE-OD1 3.18Å; R533-D559 IonicContact NH2-OD1 3.09Å; R533-D559 PolarHBondContact NH2-OD1 2.75Å; R533-D559 IonicContact NH2-OD2 3.29Å; R533-D559 PolarHBondContact NH2-OD2 3.44Å; R533-F561 WeakPolarHBondContact O-CB 3.49Å; R533-V562 HydrophobicContact CB-CG2 4.12Å; R533-V562 HydrophobicContact CG-CG2 4.07Å
534T93.7Very high90.7Very high0 Ų018.4 Ų18.40%011%0.107CC..SBendtrans-114.2168.4-167.944.50000112.7P221 E295 E536 W537P221-T534 HydrophobicContact CB-CG2 3.91Å; P221-T534 HydrophobicContact CG-CG2 3.72Å; E295-T534 VanDerWaalsContact OE2-CG2 3.23Å; E295-T534 WeakPolarHBondContact OE2-CG2 3.31Å; T534-E536 VanDerWaalsContact C-N 3.3Å; T534-E536 VanDerWaalsContact C-OE2 3.31Å; T534-E536 WeakPolarHBondContact CB-OE2 2.98Å; T534-E536 PolarHBondContact O-N 3.47Å; T534-E536 PolarHBondContact OG1-OE1 3.17Å; T534-E536 PolarHBondContact OG1-OE2 2.97Å; T534-W537 PolarHBondContact O-N 3.34Å; T534-W537 PolarHBondContact OG1-NE1 2.94Å
535L94.1Very high90.9Very high0 Ų018 Ų180%011%0.105CC..G310 helixtrans-59.5-30.5-168.9-81.5179.6000115.2L125 M215 W537 T538 F549 P553 W555 Y571L125-L535 WeakPolarHBondContact O-CB 3.33Å; M215-L535 HydrophobicContact CE-CD1 3.73Å; L535-W537 PolarHBondContact O-N 2.84Å; L535-T538 HydrophobicContact CD2-CG2 4.34Å; L535-T538 WeakPolarHBondContact O-CB 3.49Å; L535-T538 PolarHBondContact O-N 2.96Å; L535-T538 PolarHBondContact O-OG1 3.21Å; L535-F549 HydrophobicContact CB-CZ 4.34Å; L535-F549 WeakPolarHBondContact O-CZ 3.4Å; L535-P553 HydrophobicContact CD1-CG 3.86Å; L535-P553 HydrophobicContact CD2-CB 3.77Å; L535-P553 HydrophobicContact CD2-CG 3.71Å; L535-P553 HydrophobicContact CG-CG 4.42Å; L535-W555 HydrophobicContact CD1-CD2 4.29Å; L535-W555 HydrophobicContact CD1-CE3 3.97Å; L535-W555 HydrophobicContact CD2-CD2 4.47Å; L535-W555 HydrophobicContact CD2-CE3 3.41Å; L535-W555 VanDerWaalsContact CD2-CE3 3.41Å; L535-W555 HydrophobicContact CD2-CZ3 3.55Å; L535-W555 HydrophobicContact CG-CD2 4.11Å; L535-W555 HydrophobicContact CG-CE3 3.41Å; L535-W555 VanDerWaalsContact CG-CE3 3.41Å; L535-W555 HydrophobicContact CG-CH2 4.32Å; L535-W555 HydrophobicContact CG-CZ3 3.53Å; L535-Y571 HydrophobicContact CD2-CD2 4.46Å; L535-Y571 HydrophobicContact CD2-CE2 3.63Å
536E94.2Very high91.1Very high1 Ų123.3 Ų23.31%0.00513%0.127CC..G310 helixtrans-60.6-28.1179.671.1-85.5-149.200112.9V122 L125 Q126 W434 K437 T534 T538 T539V122-E536 HydrophobicContact CG1-CG 4.47Å; L125-E536 HydrophobicContact CB-CB 3.6Å; L125-E536 HydrophobicContact CD1-CB 4.13Å; Q126-E536 VanDerWaalsContact CG-CD 3.49Å; Q126-E536 WeakPolarHBondContact CG-OE2 3.41Å; Q126-E536 PolarHBondContact NE2-OE1 3.25Å; W434-E536 PolarHBondContact NE1-OE1 2.97Å; K437-E536 WeakPolarHBondContact CE-O 3.5Å; T534-E536 VanDerWaalsContact C-N 3.3Å; T534-E536 VanDerWaalsContact C-OE2 3.31Å; T534-E536 WeakPolarHBondContact CB-OE2 2.98Å; T534-E536 PolarHBondContact O-N 3.47Å; T534-E536 PolarHBondContact OG1-OE1 3.17Å; T534-E536 PolarHBondContact OG1-OE2 2.97Å; E536-T538 VanDerWaalsContact C-N 3.26Å; E536-T538 PolarHBondContact O-N 2.88Å; E536-T539 WeakPolarHBondContact O-CG2 3.45Å; E536-T539 PolarHBondContact O-OG1 3.1Å
537W94.2Very high91.2Very high1 Ų123 Ų230%0.00413%0.125CC..G310 helixtrans-81.1-6.4177.2-53.2106.6000113.1F433 W434 K437 G525 D526 N527 W528 T534 L535 F561F433-W537 HydrophobicContact CD1-CZ2 4.04Å; F433-W537 HydrophobicContact CE1-CH2 4.44Å; F433-W537 AromaticContact CE1-CZ2 3.5Å; F433-W537 HydrophobicContact CE1-CZ2 3.5Å; F433-W537 VanDerWaalsContact CE1-CZ2 3.5Å; F433-W537 HydrophobicContact CE2-CZ2 4.05Å; F433-W537 HydrophobicContact CZ-CH2 4.38Å; F433-W537 AromaticContact CZ-CZ2 3.49Å; F433-W537 HydrophobicContact CZ-CZ2 3.49Å; F433-W537 VanDerWaalsContact CZ-CZ2 3.49Å; F433-W537 WeakPolarHBondContact O-CH2 3.27Å; W434-W537 AromaticContact CD1-CH2 3.75Å; W434-W537 AromaticContact CD1-CZ2 3.53Å; W434-W537 AromaticContact NE1-CZ2 3.62Å; K437-W537 HydrophobicContact CD-CZ3 4.27Å; K437-W537 HydrophobicContact CG-CH2 4.32Å; K437-W537 HydrophobicContact CG-CZ3 4.03Å; G525-W537 CarbonylContact C-O 3.57Å; G525-W537 CarbonylContact O-C 3.52Å; G525-W537 VanDerWaalsContact O-CA 3.32Å; G525-W537 WeakPolarHBondContact O-CA 3.07Å; G525-W537 VanDerWaalsContact O-O 3.07Å; D526-W537 HydrophobicContact CB-CB 4.47Å; D526-W537 PolarHBondContact N-O 3.09Å; N527-W537 HydrophobicContact CB-CZ3 4.4Å; W528-W537 AromaticContact CD1-CH2 3.62Å; W528-W537 AromaticContact CD1-CZ3 3.76Å; W528-W537 AromaticContact NE1-CH2 3.55Å; W528-W537 AromaticContact NE1-CZ3 3.97Å; T534-W537 PolarHBondContact O-N 3.34Å; T534-W537 PolarHBondContact OG1-NE1 2.94Å; L535-W537 PolarHBondContact O-N 2.84Å; W537-F561 HydrophobicContact CB-CD1 4.38Å; W537-F561 HydrophobicContact CB-CE1 3.88Å
538T91.7Very high91.5Very high1 Ų123 Ų231%0.00613%0.125CC..G310 helixtrans-95.6-0.5-179.778.10000113L535 E536 F549 F561 H570 Y571L535-T538 HydrophobicContact CD2-CG2 4.34Å; L535-T538 WeakPolarHBondContact O-CB 3.49Å; L535-T538 PolarHBondContact O-N 2.96Å; L535-T538 PolarHBondContact O-OG1 3.21Å; E536-T538 VanDerWaalsContact C-N 3.26Å; E536-T538 PolarHBondContact O-N 2.88Å; T538-F549 WeakPolarHBondContact OG1-CE1 3.42Å; T538-F561 HydrophobicContact CG2-CB 3.96Å; T538-F561 HydrophobicContact CG2-CD1 3.68Å; T538-F561 HydrophobicContact CG2-CD2 3.32Å; T538-F561 HydrophobicContact CG2-CE1 3.93Å; T538-F561 HydrophobicContact CG2-CE2 3.59Å; T538-F561 HydrophobicContact CG2-CG 3.37Å; T538-F561 HydrophobicContact CG2-CZ 3.89Å; T538-H570 PolarHBondContact O-CE1 2.79Å; T538-Y571 HydrophobicContact CG2-CD2 4.18Å; T538-Y571 HydrophobicContact CG2-CE2 4.08Å
539T91.2Very high91.6Very high1 Ų122.9 Ų22.91%0.00613%0.125CC..SBendtrans-58.6150.8177.448.80000111.7L125 K437 G525 E536 S541 P544 F549L125-T539 HydrophobicContact CD2-CG2 4.18Å; K437-T539 PolarHBondContact NZ-OG1 2.82Å; G525-T539 WeakPolarHBondContact CA-O 3.5Å; E536-T539 WeakPolarHBondContact O-CG2 3.45Å; E536-T539 PolarHBondContact O-OG1 3.1Å; T539-S541 PolarHBondContact O-N 3.32Å; T539-S541 VanDerWaalsContact O-N 3.08Å; T539-S541 PolarHBondContact OG1-O 3.02Å; T539-P544 HydrophobicContact CG2-CB 3.97Å; T539-P544 HydrophobicContact CG2-CG 3.78Å; T539-F549 HydrophobicContact CG2-CD1 4.45Å; T539-F549 HydrophobicContact CG2-CE1 3.71Å; T539-F549 HydrophobicContact CG2-CZ 3.84Å
540A86.2Confident92Very high2 Ų217 Ų172%0.01710%0.095CC..SBendtrans-61.3-21.8-173.200000114.5L572 E644 L647 R651A540-L572 HydrophobicContact CB-CD1 4.29Å; A540-L572 HydrophobicContact CB-CD2 3.81Å; A540-E644 WeakPolarHBondContact CB-OE2 3.21Å; A540-L647 HydrophobicContact CB-CB 4.25Å; A540-L647 HydrophobicContact CB-CD1 3.62Å; A540-R651 WeakPolarHBondContact O-CD 3.24Å; A540-R651 PolarHBondContact O-NE 3.45Å
541S89.8Confident92.3Very high15 Ų1517.4 Ų17.411%0.1059%0.088CC..SBendtrans-154177.6173.570.50000112.2K437 A523 T539 I543K437-S541 PolarHBondContact NZ-O 2.96Å; A523-S541 WeakPolarHBondContact O-CA 3.16Å; A523-S541 WeakPolarHBondContact O-CB 3.39Å; T539-S541 PolarHBondContact O-N 3.32Å; T539-S541 VanDerWaalsContact O-N 3.08Å; T539-S541 PolarHBondContact OG1-O 3.02Å; S541-I543 VanDerWaalsContact C-N 3.33Å; S541-I543 PolarHBondContact O-N 3.01Å; S541-I543 PolarHBondContact OG-O 2.93Å
542A89Confident92.3Very high1 Ų119.2 Ų19.21%0.00810%0.1CC..SBendtrans-54-48.917700000111.7K437 E522 A523 T524 N527 P544K437-A542 WeakPolarHBondContact CA-O 3.41Å; K437-A542 WeakPolarHBondContact CD-O 3.27Å; K437-A542 PolarHBondContact NZ-O 3.46Å; E522-A542 HydrophobicContact CB-CB 3.87Å; E522-A542 WeakPolarHBondContact O-CB 3.49Å; A523-A542 PolarHBondContact O-N 3.42Å; T524-A542 VanDerWaalsContact O-CA 3.28Å; T524-A542 WeakPolarHBondContact O-CA 3.46Å; T524-A542 WeakPolarHBondContact O-CB 3.06Å; T524-A542 PolarHBondContact O-N 3.48Å; T524-A542 VanDerWaalsContact O-N 3.14Å; N527-A542 WeakPolarHBondContact ND2-CB 3.49Å; A542-P544 WeakPolarHBondContact O-CD 3.49Å
543I93Very high92.2Very high87 Ų8719.2 Ų19.245%0.44610%0.1SC..SBendtrans-95.5110172.5-59.6169.8000108.4S541S541-I543 VanDerWaalsContact C-N 3.33Å; S541-I543 PolarHBondContact O-N 3.01Å; S541-I543 PolarHBondContact OG-O 2.93Å
544P92Very high92Very high6 Ų623 Ų234%0.03912%0.122CC..  trans-60.3144.3-178.3-2334.7000111.8K54 L125 T539 A542K54-P544 HydrophobicContact CD-CB 4.27Å; K54-P544 HydrophobicContact CD-CG 4.49Å; L125-P544 HydrophobicContact CD1-CG 4Å; L125-P544 HydrophobicContact CD2-CB 4.25Å; L125-P544 HydrophobicContact CD2-CG 4.16Å; T539-P544 HydrophobicContact CG2-CB 3.97Å; T539-P544 HydrophobicContact CG2-CG 3.78Å; A542-P544 WeakPolarHBondContact O-CD 3.49Å
545P91.8Very high91.8Very high18 Ų1823 Ų2312%0.11712%0.122CC..  trans-61.116817427.6-34.9000111.1Y547 N548P545-Y547 HydrophobicContact CB-CD1 4.23Å; P545-Y547 HydrophobicContact CB-CD2 4.31Å; P545-Y547 HydrophobicContact CB-CE1 3.79Å; P545-Y547 HydrophobicContact CB-CE2 3.88Å; P545-Y547 HydrophobicContact CB-CG 4.47Å; P545-Y547 HydrophobicContact CG-CD2 3.82Å; P545-Y547 HydrophobicContact CG-CE1 4.17Å; P545-Y547 HydrophobicContact CG-CE2 3.29Å; P545-Y547 HydrophobicContact CG-CG 4.43Å; P545-Y547 VanDerWaalsContact CG-CZ 3.5Å; P545-Y547 PolarHBondContact O-N 3.43Å; P545-N548 WeakPolarHBondContact O-CA 3.13Å; P545-N548 PolarHBondContact O-N 3.33Å
546K92.2Very high91.5Very high116 Ų11628.1 Ų28.150%0.50415%0.149SC..THydrogen-bonded Turntrans-51.4-38.3-177.6-67.7-177.5-179.4177.80112.8K54 M582K54-K546 PolarHBondContact NZ-O 2.8Å; K546-M582 WeakPolarHBondContact O-CE 3.5Å
547Y93.9Very high91.3Very high7 Ų730.7 Ų30.73%0.02716%0.163CC..THydrogen-bonded Turntrans-85.71.1-179.654.5-104.9000114.8R130 P545 F549 A550 I580 I635 V640 E644R130-Y547 WeakPolarHBondContact CG-O 3.38Å; P545-Y547 HydrophobicContact CB-CD1 4.23Å; P545-Y547 HydrophobicContact CB-CD2 4.31Å; P545-Y547 HydrophobicContact CB-CE1 3.79Å; P545-Y547 HydrophobicContact CB-CE2 3.88Å; P545-Y547 HydrophobicContact CB-CG 4.47Å; P545-Y547 HydrophobicContact CG-CD2 3.82Å; P545-Y547 HydrophobicContact CG-CE1 4.17Å; P545-Y547 HydrophobicContact CG-CE2 3.29Å; P545-Y547 HydrophobicContact CG-CG 4.43Å; P545-Y547 VanDerWaalsContact CG-CZ 3.5Å; P545-Y547 PolarHBondContact O-N 3.43Å; Y547-F549 VanDerWaalsContact C-N 3.25Å; Y547-F549 PolarHBondContact O-N 3.14Å; Y547-A550 HydrophobicContact CD2-CB 4.48Å; Y547-A550 HydrophobicContact CE2-CB 3.81Å; Y547-I580 HydrophobicContact CD1-CD1 4.18Å; Y547-I580 HydrophobicContact CD2-CD1 3.95Å; Y547-I580 HydrophobicContact CG-CD1 3.76Å; Y547-I635 HydrophobicContact CD1-CD1 3.92Å; Y547-V640 HydrophobicContact CE1-CG1 4.5Å; Y547-V640 HydrophobicContact CE1-CG2 4.37Å; Y547-E644 WeakPolarHBondContact CE2-OE1 3.21Å; Y547-E644 PolarHBondContact OH-OE1 3.01Å
548N95.1Very high91Very high1 Ų130.7 Ų30.71%0.00516%0.163CC..SBendtrans61.7-69.6-173.8-56.5-21.7000114.8H53 K54 L125 A129 R130 P545H53-N548 PolarHBondContact NE2-ND2 2.92Å; H53-N548 PolarHBondContact NE2-OD1 2.95Å; K54-N548 PolarHBondContact NZ-OD1 3.04Å; L125-N548 HydrophobicContact CD2-CB 3.65Å; L125-N548 VanDerWaalsContact CD2-CG 3.41Å; A129-N548 PolarHBondContact O-ND2 2.99Å; R130-N548 PolarHBondContact O-ND2 3.02Å; P545-N548 WeakPolarHBondContact O-CA 3.13Å; P545-N548 PolarHBondContact O-N 3.33Å
549F93.6Very high90.8Very high12 Ų1231.4 Ų31.45%0.05317%0.166CC..  trans-121.2124.4-179.1-56.1-80.3000109.9L125 L535 T538 T539 Y547 I551 P553L125-F549 HydrophobicContact CD2-CE2 4.36Å; L125-F549 WeakPolarHBondContact O-CE2 3.49Å; L125-F549 WeakPolarHBondContact O-CZ 2.94Å; L535-F549 HydrophobicContact CB-CZ 4.34Å; L535-F549 WeakPolarHBondContact O-CZ 3.4Å; T538-F549 WeakPolarHBondContact OG1-CE1 3.42Å; T539-F549 HydrophobicContact CG2-CD1 4.45Å; T539-F549 HydrophobicContact CG2-CE1 3.71Å; T539-F549 HydrophobicContact CG2-CZ 3.84Å; Y547-F549 VanDerWaalsContact C-N 3.25Å; Y547-F549 PolarHBondContact O-N 3.14Å; F549-I551 VanDerWaalsContact C-N 3.29Å; F549-I551 PolarHBondContact O-N 3.08Å; F549-P553 HydrophobicContact CD1-CG 4.45Å; F549-P553 HydrophobicContact CG-CG 4.49Å
550A92.9Very high90.9Very high9 Ų932 Ų327%0.07417%0.17CC..SBendtrans-62.8-4217700000111R130 Y547 Y577 V640 E644R130-A550 PolarHBondContact NH2-O 2.82Å; Y547-A550 HydrophobicContact CD2-CB 4.48Å; Y547-A550 HydrophobicContact CE2-CB 3.81Å; A550-Y577 HydrophobicContact CB-CD1 3.76Å; A550-Y577 HydrophobicContact CB-CE1 3.66Å; A550-V640 HydrophobicContact CB-CG1 3.57Å; A550-E644 HydrophobicContact CB-CG 3.88Å
551I91.7Very high91.2Very high44 Ų4432 Ų3223%0.22617%0.17CC..SBendtrans-121.3130.5177.2-57.9176.5000107.7F549 P553 N574 Y577F549-I551 VanDerWaalsContact C-N 3.29Å; F549-I551 PolarHBondContact O-N 3.08Å; I551-P553 WeakPolarHBondContact O-CD 3.18Å; I551-N574 HydrophobicContact CD1-CB 3.72Å; I551-N574 WeakPolarHBondContact CD1-O 3.43Å; I551-N574 WeakPolarHBondContact CD1-OD1 3.21Å; I551-Y577 HydrophobicContact CD1-CD1 4.22Å; I551-Y577 HydrophobicContact CD1-CE1 4.29Å; I551-Y577 HydrophobicContact CG1-CD1 4.19Å; I551-Y577 HydrophobicContact CG1-CE1 4.44Å
552T91.4Very high91.3Very high63 Ų6332.4 Ų32.439%0.38717%0.172SC..PPolyproline II helixtrans-60.1122.4178.8-53.70000109.8T212T212-T552 WeakPolarHBondContact OG1-CG2 3.31Å
553P90.7Very high91.4Very high1 Ų135.4 Ų35.41%0.00619%0.188CC..PPolyproline II helixtrans-75.5139.6-175.429-34.3000111.8T212 L535 F549 I551 Y571T212-P553 VanDerWaalsContact CB-O 3.24Å; T212-P553 WeakPolarHBondContact CB-O 3.5Å; T212-P553 WeakPolarHBondContact CG2-O 3.44Å; T212-P553 PolarHBondContact OG1-O 3.31Å; L535-P553 HydrophobicContact CD1-CG 3.86Å; L535-P553 HydrophobicContact CD2-CB 3.77Å; L535-P553 HydrophobicContact CD2-CG 3.71Å; L535-P553 HydrophobicContact CG-CG 4.42Å; F549-P553 HydrophobicContact CD1-CG 4.45Å; F549-P553 HydrophobicContact CG-CG 4.49Å; I551-P553 WeakPolarHBondContact O-CD 3.18Å; P553-Y571 HydrophobicContact CB-CD1 3.59Å; P553-Y571 HydrophobicContact CB-CD2 3.95Å; P553-Y571 HydrophobicContact CB-CE1 3.46Å; P553-Y571 VanDerWaalsContact CB-CE1 3.46Å; P553-Y571 HydrophobicContact CB-CE2 3.83Å; P553-Y571 HydrophobicContact CB-CG 3.84Å
554D89.1Confident91.3Very high98 Ų9832.1 Ų32.152%0.52417%0.17SC..PPolyproline II helixtrans-79125.2170.5-66.7-32.3000110.7T214 Y571T214-D554 HydrophobicContact CG2-CB 4.31Å; D554-Y571 WeakPolarHBondContact O-CE1 3.14Å; D554-Y571 PolarHBondContact O-OH 3.42Å
555W90.2Very high91.2Very high0 Ų035 Ų350%018%0.182CC..  trans-119.6117178.3-165.3-98.5000111.4T212 T214 M215 Q219 L535 D557 Y558 T560 F561T212-W555 HydrophobicContact CG2-CB 3.78Å; T214-W555 CarbonylContact C-O 3.07Å; T214-W555 VanDerWaalsContact C-O 3.27Å; T214-W555 WeakPolarHBondContact CB-O 3.28Å; T214-W555 PolarHBondContact OG1-N 2.73Å; T214-W555 PolarHBondContact OG1-O 2.79Å; M215-W555 HydrophobicContact CB-CB 4.15Å; M215-W555 HydrophobicContact CE-CB 3.83Å; M215-W555 VanDerWaalsContact CE-CD1 3.48Å; M215-W555 HydrophobicContact CE-CD2 4.02Å; M215-W555 HydrophobicContact CE-CG 3.49Å; M215-W555 VanDerWaalsContact CE-CG 3.49Å; M215-W555 HydrophobicContact CG-CG 4.49Å; Q219-W555 PolarHBondContact O-NE1 3.38Å; L535-W555 HydrophobicContact CD1-CD2 4.29Å; L535-W555 HydrophobicContact CD1-CE3 3.97Å; L535-W555 HydrophobicContact CD2-CD2 4.47Å; L535-W555 HydrophobicContact CD2-CE3 3.41Å; L535-W555 VanDerWaalsContact CD2-CE3 3.41Å; L535-W555 HydrophobicContact CD2-CZ3 3.55Å; L535-W555 HydrophobicContact CG-CD2 4.11Å; L535-W555 HydrophobicContact CG-CE3 3.41Å; L535-W555 VanDerWaalsContact CG-CE3 3.41Å; L535-W555 HydrophobicContact CG-CH2 4.32Å; L535-W555 HydrophobicContact CG-CZ3 3.53Å; W555-D557 WeakPolarHBondContact CZ2-O 3.04Å; W555-D557 PolarHBondContact NE1-O 3.1Å; W555-Y558 WeakPolarHBondContact CZ2-O 3.33Å; W555-T560 HydrophobicContact CE3-CG2 4.06Å; W555-T560 HydrophobicContact CZ3-CG2 4.4Å; W555-F561 HydrophobicContact CH2-CB 4.3Å; W555-F561 HydrophobicContact CZ3-CB 4.11Å
556N87.3Confident91.1Very high107 Ų10741.3 Ų41.357%0.57221%0.21SC*.  trans-113.4-20.6-172.5-68.2-40.6000113.9Q219 T560Q219-N556 VanDerWaalsContact CD-O 3.23Å; Q219-N556 PolarHBondContact NE2-O 3.1Å; Q219-N556 PolarHBondContact OE1-O 3.38Å; N556-T560 PolarHBondContact N-OG1 2.9Å; N556-T560 VanDerWaalsContact N-OG1 3.08Å
557D91.1Very high91Very high54 Ų5441.2 Ų41.229%0.28921%0.212SC..SBendtrans-155163178.9-172.837.6000111.9R304 W555 D559 T560R304-D557 IonicContact CZ-OD1 2.79Å; R304-D557 IonicContact CZ-OD2 3.7Å; R304-D557 VanDerWaalsContact CZ-OD2 3.28Å; R304-D557 IonicContact NH1-OD1 3.97Å; R304-D557 IonicContact NH1-OD2 3.16Å; R304-D557 PolarHBondContact NH1-OD2 3.01Å; R304-D557 IonicContact NH2-OD1 2.78Å; R304-D557 PolarHBondContact NH2-OD1 3.16Å; R304-D557 IonicContact NH2-OD2 3.86Å; R304-D557 PolarHBondContact NH2-OD2 3.39Å; W555-D557 WeakPolarHBondContact CZ2-O 3.04Å; W555-D557 PolarHBondContact NE1-O 3.1Å; D557-D559 PolarHBondContact O-N 3.36Å; D557-D559 VanDerWaalsContact O-N 3.13Å; D557-T560 PolarHBondContact N-OG1 2.97Å; D557-T560 WeakPolarHBondContact O-CB 3.41Å; D557-T560 PolarHBondContact O-N 3.19Å; D557-T560 PolarHBondContact O-OG1 3.4Å
558Y86.5Confident90.5Very high1 Ų144.2 Ų44.20%0.00424%0.244CC..THydrogen-bonded Turntrans-54.6-31.7-179.5179.1-95.6000113.9R304 L305 H308 W555R304-Y558 HydrophobicContact CG-CD1 4.17Å; L305-Y558 HydrophobicContact CB-CE1 4.08Å; H308-Y558 AromaticContact CD2-CD2 3.36Å; H308-Y558 WeakPolarHBondContact CD2-CD2 3.41Å; H308-Y558 AromaticContact CD2-CE2 3.46Å; H308-Y558 VanDerWaalsContact CD2-CE2 3.46Å; H308-Y558 WeakPolarHBondContact CD2-CE2 3.41Å; H308-Y558 AromaticContact NE2-CD2 3.44Å; H308-Y558 WeakPolarHBondContact NE2-CD2 3.38Å; H308-Y558 AromaticContact NE2-CE2 3.73Å; W555-Y558 WeakPolarHBondContact CZ2-O 3.33Å
559D88.9Confident89.9Confident16 Ų1650.4 Ų50.49%0.08627%0.267CS..THydrogen-bonded Turntrans-108.128179.5-78.4-38.2000112.6R304 R533 D557 F561 V562 D563R304-D559 WeakPolarHBondContact CB-OD2 3.45Å; R304-D559 VanDerWaalsContact CD-OD2 3.26Å; R304-D559 WeakPolarHBondContact CD-OD2 3.5Å; R304-D559 WeakPolarHBondContact CG-OD2 3.21Å; R304-D559 IonicContact NE-OD2 3.09Å; R533-D559 IonicContact CZ-OD1 3.67Å; R533-D559 IonicContact CZ-OD2 2.83Å; R533-D559 IonicContact NE-OD1 3.29Å; R533-D559 PolarHBondContact NE-OD1 3.18Å; R533-D559 IonicContact NH2-OD1 3.09Å; R533-D559 PolarHBondContact NH2-OD1 2.75Å; R533-D559 IonicContact NH2-OD2 3.29Å; R533-D559 PolarHBondContact NH2-OD2 3.44Å; D557-D559 PolarHBondContact O-N 3.36Å; D557-D559 VanDerWaalsContact O-N 3.13Å; D559-F561 PolarHBondContact O-N 3.39Å; D559-F561 VanDerWaalsContact O-N 3.15Å; D559-V562 HydrophobicContact CB-CB 4.19Å; D559-V562 HydrophobicContact CB-CG2 4.3Å; D559-V562 WeakPolarHBondContact O-CB 3.29Å; D559-V562 PolarHBondContact O-N 3.25Å; D559-D563 PolarHBondContact O-N 2.83Å
560T91.9Very high89.3Confident13 Ų1351.6 Ų51.68%0.0827%0.273CS..Hα-helixtrans-51.5-42-178.3-58.50000111.9W555 N556 D557 V562 D563 M564 Y571W555-T560 HydrophobicContact CE3-CG2 4.06Å; W555-T560 HydrophobicContact CZ3-CG2 4.4Å; N556-T560 PolarHBondContact N-OG1 2.9Å; N556-T560 VanDerWaalsContact N-OG1 3.08Å; D557-T560 PolarHBondContact N-OG1 2.97Å; D557-T560 WeakPolarHBondContact O-CB 3.41Å; D557-T560 PolarHBondContact O-N 3.19Å; D557-T560 PolarHBondContact O-OG1 3.4Å; T560-V562 VanDerWaalsContact C-N 3.35Å; T560-V562 PolarHBondContact O-N 3.34Å; T560-D563 PolarHBondContact O-N 2.83Å; T560-M564 HydrophobicContact CG2-CG 4.38Å; T560-M564 HydrophobicContact CG2-SD 4.14Å; T560-M564 WeakPolarHBondContact O-CB 3.39Å; T560-M564 VanDerWaalsContact O-CG 3.24Å; T560-M564 WeakPolarHBondContact O-CG 3.27Å; T560-M564 PolarHBondContact O-N 3.47Å; T560-Y571 WeakPolarHBondContact CG2-OH 3.28Å
561F93.1Very high88.6Confident3 Ų353 Ų531%0.01328%0.277CS..Hα-helixtrans-70-31.2-180-178.2-137.1000113.3D526 G532 R533 W537 T538 W555 D559 M564 K565D526-F561 HydrophobicContact CB-CE1 4.48Å; D526-F561 HydrophobicContact CB-CZ 4.47Å; D526-F561 WeakPolarHBondContact OD2-CE1 3.32Å; G532-F561 WeakPolarHBondContact O-CD1 3.27Å; G532-F561 WeakPolarHBondContact O-CE1 3.49Å; R533-F561 WeakPolarHBondContact O-CB 3.49Å; W537-F561 HydrophobicContact CB-CD1 4.38Å; W537-F561 HydrophobicContact CB-CE1 3.88Å; T538-F561 HydrophobicContact CG2-CB 3.96Å; T538-F561 HydrophobicContact CG2-CD1 3.68Å; T538-F561 HydrophobicContact CG2-CD2 3.32Å; T538-F561 HydrophobicContact CG2-CE1 3.93Å; T538-F561 HydrophobicContact CG2-CE2 3.59Å; T538-F561 HydrophobicContact CG2-CG 3.37Å; T538-F561 HydrophobicContact CG2-CZ 3.89Å; W555-F561 HydrophobicContact CH2-CB 4.3Å; W555-F561 HydrophobicContact CZ3-CB 4.11Å; D559-F561 PolarHBondContact O-N 3.39Å; D559-F561 VanDerWaalsContact O-N 3.15Å; F561-M564 PolarHBondContact O-N 2.95Å; F561-K565 HydrophobicContact CD2-CG 4.26Å; F561-K565 HydrophobicContact CE1-CD 4.06Å; F561-K565 HydrophobicContact CE2-CD 4.1Å; F561-K565 HydrophobicContact CE2-CG 3.89Å; F561-K565 HydrophobicContact CZ-CD 3.8Å; F561-K565 HydrophobicContact CZ-CG 4.11Å; F561-K565 WeakPolarHBondContact O-CG 3.49Å; F561-K565 PolarHBondContact O-N 3.01Å
562V92.2Very high87.9Confident24 Ų2451.8 Ų51.815%0.14527%0.271CS..Hα-helixtrans-67.3-46.9173.9-1780000109.9R533 D559 T560 M564 K565 E566R533-V562 HydrophobicContact CB-CG2 4.12Å; R533-V562 HydrophobicContact CG-CG2 4.07Å; D559-V562 HydrophobicContact CB-CB 4.19Å; D559-V562 HydrophobicContact CB-CG2 4.3Å; D559-V562 WeakPolarHBondContact O-CB 3.29Å; D559-V562 PolarHBondContact O-N 3.25Å; T560-V562 VanDerWaalsContact C-N 3.35Å; T560-V562 PolarHBondContact O-N 3.34Å; V562-M564 VanDerWaalsContact C-N 3.29Å; V562-M564 PolarHBondContact O-N 3.37Å; V562-K565 PolarHBondContact O-N 3.5Å; V562-K565 VanDerWaalsContact O-N 3.14Å; V562-E566 WeakPolarHBondContact O-CG 3.27Å; V562-E566 PolarHBondContact O-N 3.23Å
563D91.8Very high87.2Confident64 Ų6453.5 Ų53.534%0.34228%0.277SS..Hα-helixtrans-56.8-43.1173.9175.683.9000111.6D559 T560 K565 E566 H567 R569D559-D563 PolarHBondContact O-N 2.83Å; T560-D563 PolarHBondContact O-N 2.83Å; D563-K565 PolarHBondContact O-N 2.91Å; D563-E566 PolarHBondContact O-N 2.82Å; D563-H567 PolarHBondContact O-N 3.3Å; D563-H567 PolarHBondContact O-ND1 3.17Å; D563-H567 IonicContact OD1-CE1 2.81Å; D563-H567 PolarHBondContact OD1-CE1 3.1Å; D563-H567 IonicContact OD1-ND1 2.77Å; D563-H567 PolarHBondContact OD1-ND1 3.44Å; D563-H567 IonicContact OD2-ND1 3.19Å; D563-R569 IonicContact OD2-NH2 2.94Å; D563-R569 PolarHBondContact OD2-NH2 3Å
564M90.8Very high86.8Confident17 Ų1757.1 Ų57.18%0.08430%0.297CS..Hα-helixtrans-60.8-44.4176.1-75.1179.875.500112.3T560 F561 V562 H567 G568 R569 Y571T560-M564 HydrophobicContact CG2-CG 4.38Å; T560-M564 HydrophobicContact CG2-SD 4.14Å; T560-M564 WeakPolarHBondContact O-CB 3.39Å; T560-M564 VanDerWaalsContact O-CG 3.24Å; T560-M564 WeakPolarHBondContact O-CG 3.27Å; T560-M564 PolarHBondContact O-N 3.47Å; F561-M564 PolarHBondContact O-N 2.95Å; V562-M564 VanDerWaalsContact C-N 3.29Å; V562-M564 PolarHBondContact O-N 3.37Å; M564-H567 CarbonylContact O-C 3.56Å; M564-H567 PolarHBondContact O-N 3.34Å; M564-G568 PolarHBondContact O-N 2.79Å; M564-G568 VanDerWaalsContact O-N 3.07Å; M564-R569 CarbonylContact C-O 3.6Å; M564-R569 HydrophobicContact CB-CB 4.42Å; M564-R569 HydrophobicContact CE-CB 4.38Å; M564-R569 PolarHBondContact O-N 3.19Å; M564-Y571 HydrophobicContact CE-CD1 3.79Å; M564-Y571 HydrophobicContact CE-CD2 3.85Å; M564-Y571 HydrophobicContact CE-CE1 3.81Å; M564-Y571 HydrophobicContact CE-CE2 3.88Å; M564-Y571 HydrophobicContact CE-CG 3.81Å; M564-Y571 HydrophobicContact SD-CD1 4.28Å; M564-Y571 HydrophobicContact SD-CD2 4.04Å; M564-Y571 HydrophobicContact SD-CE1 3.7Å; M564-Y571 HydrophobicContact SD-CE2 3.43Å; M564-Y571 WeakPolarHBondContact SD-CE2 3.37Å; M564-Y571 HydrophobicContact SD-CG 4.42Å; M564-Y571 PolarHBondContact SD-OH 3.08Å
565K89.6Confident86.7Confident67 Ų6757.2 Ų57.229%0.29129%0.294SS..Hα-helixtrans-62.9-42.2176.7-76.8-172.9-73-171.70112.4D526 G530 G532 F561 V562 D563 H567 G568D526-K565 IonicContact OD2-NZ 3.17Å; D526-K565 PolarHBondContact OD2-NZ 3.35Å; G530-K565 PolarHBondContact O-NZ 3.02Å; G532-K565 PolarHBondContact O-NZ 3.49Å; F561-K565 HydrophobicContact CD2-CG 4.26Å; F561-K565 HydrophobicContact CE1-CD 4.06Å; F561-K565 HydrophobicContact CE2-CD 4.1Å; F561-K565 HydrophobicContact CE2-CG 3.89Å; F561-K565 HydrophobicContact CZ-CD 3.8Å; F561-K565 HydrophobicContact CZ-CG 4.11Å; F561-K565 WeakPolarHBondContact O-CG 3.49Å; F561-K565 PolarHBondContact O-N 3.01Å; V562-K565 PolarHBondContact O-N 3.5Å; V562-K565 VanDerWaalsContact O-N 3.14Å; D563-K565 PolarHBondContact O-N 2.91Å; K565-H567 VanDerWaalsContact C-N 3.27Å; K565-H567 PolarHBondContact O-N 2.62Å; K565-G568 PolarHBondContact O-N 3.46Å
566E89.4Confident86.7Confident151 Ų15162.5 Ų62.571%0.70632%0.322SS*.Hα-helixtrans-63.5-32.7177.3-71.7177.817500112.5V562 D563V562-E566 WeakPolarHBondContact O-CG 3.27Å; V562-E566 PolarHBondContact O-N 3.23Å; D563-E566 PolarHBondContact O-N 2.82Å
567H89.6Confident87Confident114 Ų11459 Ų5953%0.52830%0.301SS..THydrogen-bonded Turntrans-93.67.3177.4-65.289.6000114.1D563 M564 K565 R569D563-H567 PolarHBondContact O-N 3.3Å; D563-H567 PolarHBondContact O-ND1 3.17Å; D563-H567 IonicContact OD1-CE1 2.81Å; D563-H567 PolarHBondContact OD1-CE1 3.1Å; D563-H567 IonicContact OD1-ND1 2.77Å; D563-H567 PolarHBondContact OD1-ND1 3.44Å; D563-H567 IonicContact OD2-ND1 3.19Å; M564-H567 CarbonylContact O-C 3.56Å; M564-H567 PolarHBondContact O-N 3.34Å; K565-H567 VanDerWaalsContact C-N 3.27Å; K565-H567 PolarHBondContact O-N 2.62Å; H567-R569 HydrophobicContact CB-CG 4.31Å; H567-R569 PolarHBondContact O-N 3.11Å
568G83.4Confident87.1Confident69 Ų6963 Ų6371%0.71132%0.316SS*.THydrogen-bonded Turntrans64.323.8179.900000114.9M564 K565M564-G568 PolarHBondContact O-N 2.79Å; M564-G568 VanDerWaalsContact O-N 3.07Å; K565-G568 PolarHBondContact O-N 3.46Å
569R83.2Confident87.5Confident131 Ų13167.7 Ų67.749%0.49434%0.341SS..  trans-99.5144.6179.3-63-177.3-71176.9-1.6110.7D563 M564 H567D563-R569 IonicContact OD2-NH2 2.94Å; D563-R569 PolarHBondContact OD2-NH2 3Å; M564-R569 CarbonylContact C-O 3.6Å; M564-R569 HydrophobicContact CB-CB 4.42Å; M564-R569 HydrophobicContact CE-CB 4.38Å; M564-R569 PolarHBondContact O-N 3.19Å; H567-R569 HydrophobicContact CB-CG 4.31Å; H567-R569 PolarHBondContact O-N 3.11Å
570H81.4Confident87.8Confident38 Ų3867 Ų6718%0.17634%0.337CS..  trans-137.7144.6171-156.6-62.9000111.7T538 L572 D573T538-H570 PolarHBondContact O-CE1 2.79Å; H570-L572 WeakPolarHBondContact CE1-CD1 3.09Å; H570-L572 WeakPolarHBondContact ND1-CD1 3.42Å; H570-L572 WeakPolarHBondContact ND1-CG 3.17Å; H570-L572 PolarHBondContact ND1-N 2.75Å; H570-L572 PolarHBondContact O-N 3.37Å; H570-D573 PolarHBondContact N-OD2 3.3Å; H570-D573 WeakPolarHBondContact O-CB 3.4Å; H570-D573 VanDerWaalsContact O-CG 3.28Å; H570-D573 PolarHBondContact O-N 3.4Å; H570-D573 VanDerWaalsContact O-OD2 3.14Å
571Y77.6Confident88Confident38 Ų3870.7 Ų70.715%0.14935%0.354CS..G310 helixtrans-58.7-18.3175.6-65.2-67000114L535 T538 P553 D554 T560 M564 D573L535-Y571 HydrophobicContact CD2-CD2 4.46Å; L535-Y571 HydrophobicContact CD2-CE2 3.63Å; T538-Y571 HydrophobicContact CG2-CD2 4.18Å; T538-Y571 HydrophobicContact CG2-CE2 4.08Å; P553-Y571 HydrophobicContact CB-CD1 3.59Å; P553-Y571 HydrophobicContact CB-CD2 3.95Å; P553-Y571 HydrophobicContact CB-CE1 3.46Å; P553-Y571 VanDerWaalsContact CB-CE1 3.46Å; P553-Y571 HydrophobicContact CB-CE2 3.83Å; P553-Y571 HydrophobicContact CB-CG 3.84Å; D554-Y571 WeakPolarHBondContact O-CE1 3.14Å; D554-Y571 PolarHBondContact O-OH 3.42Å; T560-Y571 WeakPolarHBondContact CG2-OH 3.28Å; M564-Y571 HydrophobicContact CE-CD1 3.79Å; M564-Y571 HydrophobicContact CE-CD2 3.85Å; M564-Y571 HydrophobicContact CE-CE1 3.81Å; M564-Y571 HydrophobicContact CE-CE2 3.88Å; M564-Y571 HydrophobicContact CE-CG 3.81Å; M564-Y571 HydrophobicContact SD-CD1 4.28Å; M564-Y571 HydrophobicContact SD-CD2 4.04Å; M564-Y571 HydrophobicContact SD-CE1 3.7Å; M564-Y571 HydrophobicContact SD-CE2 3.43Å; M564-Y571 WeakPolarHBondContact SD-CE2 3.37Å; M564-Y571 HydrophobicContact SD-CG 4.42Å; M564-Y571 PolarHBondContact SD-OH 3.08Å; Y571-D573 VanDerWaalsContact C-N 3.28Å
572L77Confident88.1Confident18 Ų1871 Ų719%0.09436%0.355CS..G310 helixtrans-86-6.2-176.1-62.2167.6000111.8A540 H570 N574 H575 E644 R648A540-L572 HydrophobicContact CB-CD1 4.29Å; A540-L572 HydrophobicContact CB-CD2 3.81Å; H570-L572 WeakPolarHBondContact CE1-CD1 3.09Å; H570-L572 WeakPolarHBondContact ND1-CD1 3.42Å; H570-L572 WeakPolarHBondContact ND1-CG 3.17Å; H570-L572 PolarHBondContact ND1-N 2.75Å; H570-L572 PolarHBondContact O-N 3.37Å; L572-N574 PolarHBondContact O-N 3.31Å; L572-H575 PolarHBondContact O-CE1 3.14Å; L572-E644 WeakPolarHBondContact CD2-OE2 3.49Å; L572-R648 PolarHBondContact O-NH2 2.94Å
573D77.4Confident88.2Confident99 Ų9971.5 Ų71.553%0.52936%0.359SS..G310 helixtrans-76.2-14.2174.1-55.5-26.9000111.4H570 Y571 H575H570-D573 PolarHBondContact N-OD2 3.3Å; H570-D573 WeakPolarHBondContact O-CB 3.4Å; H570-D573 VanDerWaalsContact O-CG 3.28Å; H570-D573 PolarHBondContact O-N 3.4Å; H570-D573 VanDerWaalsContact O-OD2 3.14Å; Y571-D573 VanDerWaalsContact C-N 3.28Å; D573-H575 VanDerWaalsContact C-CE1 3.44Å; D573-H575 PolarHBondContact O-CE1 3.44Å
574N82.4Confident88.3Confident78 Ų7871.1 Ų71.142%0.41736%0.357SS..  trans-83.7124.8172.7-171.1-11.7000110.5I551 L572 N576I551-N574 HydrophobicContact CD1-CB 3.72Å; I551-N574 WeakPolarHBondContact CD1-O 3.43Å; I551-N574 WeakPolarHBondContact CD1-OD1 3.21Å; L572-N574 PolarHBondContact O-N 3.31Å; N574-N576 WeakPolarHBondContact OD1-CB 3.49Å; N574-N576 PolarHBondContact OD1-N 3.1Å
575H86.2Confident88.6Confident99 Ų9973.7 Ų73.746%0.45837%0.371SS..  trans-113.513.5-177.8-54-21.9000113.1L572 D573 Y577 R648L572-H575 PolarHBondContact O-CE1 3.14Å; D573-H575 VanDerWaalsContact C-CE1 3.44Å; D573-H575 PolarHBondContact O-CE1 3.44Å; H575-Y577 HydrophobicContact CB-CE2 4.17Å; H575-Y577 WeakPolarHBondContact O-CD2 3.49Å; H575-Y577 PolarHBondContact O-N 3.37Å; H575-R648 PolarHBondContact CE1-NH1 3.27Å; H575-R648 PolarHBondContact CE1-NH2 3.12Å; H575-R648 PolarHBondContact ND1-NH2 2.85Å; H575-R648 PolarHBondContact NE2-NH1 2.9Å
576N90.3Very high88.8Confident111 Ų11170.6 Ų70.659%0.59436%0.358SS*.  trans-79.966.4177-168.612.7000111.1N574N574-N576 WeakPolarHBondContact OD1-CB 3.49Å; N574-N576 PolarHBondContact OD1-N 3.1Å
577Y92.4Very high89Confident34 Ų3465 Ų6513%0.13333%0.334CS..  trans-71.9143-179.1-57.2-57.9000111.4A550 I551 H575 V640 A641 E644 R648A550-Y577 HydrophobicContact CB-CD1 3.76Å; A550-Y577 HydrophobicContact CB-CE1 3.66Å; I551-Y577 HydrophobicContact CD1-CD1 4.22Å; I551-Y577 HydrophobicContact CD1-CE1 4.29Å; I551-Y577 HydrophobicContact CG1-CD1 4.19Å; I551-Y577 HydrophobicContact CG1-CE1 4.44Å; H575-Y577 HydrophobicContact CB-CE2 4.17Å; H575-Y577 WeakPolarHBondContact O-CD2 3.49Å; H575-Y577 PolarHBondContact O-N 3.37Å; Y577-V640 HydrophobicContact CD1-CG1 3.77Å; Y577-V640 HydrophobicContact CE1-CG1 4.36Å; Y577-V640 HydrophobicContact CG-CG1 4.1Å; Y577-A641 HydrophobicContact CD2-CB 3.56Å; Y577-A641 HydrophobicContact CE2-CB 3.99Å; Y577-A641 HydrophobicContact CG-CB 4.45Å; Y577-E644 HydrophobicContact CE1-CB 4.19Å; Y577-E644 HydrophobicContact CE1-CG 3.74Å; Y577-E644 HydrophobicContact CE2-CB 4.36Å; Y577-E644 VanDerWaalsContact OH-CB 3.27Å; Y577-E644 WeakPolarHBondContact OH-CB 3.48Å; Y577-R648 PolarHBondContact OH-NH2 3.18Å
578K93.2Very high89.3Confident139 Ų13960 Ų6060%0.60431%0.311SS*.  trans-129.2160.5177-63.1-178.5-178.9178.90108.9I580K578-I580 WeakPolarHBondContact O-CG1 3.15Å; K578-I580 PolarHBondContact O-N 3.05Å
579D95Very high89.9Confident99 Ų9956.7 Ų56.753%0.52928%0.278SS..  trans-57.3136.3172.5-66.4-4.5000110.3I635 P636 A637D579-I635 WeakPolarHBondContact CA-O 3.41Å; D579-P636 WeakPolarHBondContact OD1-CA 3.24Å; D579-A637 WeakPolarHBondContact OD1-CB 3.34Å; D579-A637 PolarHBondContact OD1-N 3.33Å
580I95.2Very high90.5Very high0 Ų052 Ų520%026%0.261CS..EExtended strand (participates in β ladder)trans-112.3116.1-176.3-58.2-175.9000109.5Y547 K578 M582 H634 I635 V640Y547-I580 HydrophobicContact CD1-CD1 4.18Å; Y547-I580 HydrophobicContact CD2-CD1 3.95Å; Y547-I580 HydrophobicContact CG-CD1 3.76Å; K578-I580 WeakPolarHBondContact O-CG1 3.15Å; K578-I580 PolarHBondContact O-N 3.05Å; I580-M582 HydrophobicContact CG2-CG 4.05Å; I580-M582 HydrophobicContact CG2-SD 3.93Å; I580-H634 CarbonylContact O-C 3.6Å; I580-H634 WeakPolarHBondContact O-CA 3.38Å; I580-I635 HydrophobicContact CB-CB 4.43Å; I580-I635 PolarHBondContact N-O 2.92Å; I580-I635 PolarHBondContact O-N 3.34Å; I580-V640 HydrophobicContact CD1-CG1 4.26Å; I580-V640 HydrophobicContact CD1-CG2 3.84Å; I580-V640 HydrophobicContact CG1-CG2 4.13Å
581H95.8Very high91.3Very high92 Ų9255.5 Ų55.543%0.42627%0.273SS..EExtended strand (participates in β ladder)trans-73.3131.7169.5-179.1-99.5000111.2H631 Y633 H634H581-H631 PolarHBondContact NE2-O 2.99Å; H581-Y633 WeakPolarHBondContact CA-O 3.41Å; H581-H634 AromaticContact CD2-CE1 3.64Å; H581-H634 AromaticContact CD2-NE2 3.77Å
582M95.6Very high92.2Very high10 Ų1054.3 Ų54.35%0.04927%0.269CS..EExtended strand (participates in β ladder)trans-135.6148.6178.7-67-60.3-68.100111.2R130 K546 I580 G632 Y633 I635R130-M582 HydrophobicContact CB-SD 4.38Å; K546-M582 WeakPolarHBondContact O-CE 3.5Å; I580-M582 HydrophobicContact CG2-CG 4.05Å; I580-M582 HydrophobicContact CG2-SD 3.93Å; M582-G632 CarbonylContact O-C 3.08Å; M582-G632 VanDerWaalsContact O-CA 3.24Å; M582-G632 WeakPolarHBondContact O-CA 3.4Å; M582-Y633 HydrophobicContact CB-CD1 4.21Å; M582-Y633 HydrophobicContact CB-CE1 3.67Å; M582-Y633 HydrophobicContact CB-CE2 4.06Å; M582-Y633 PolarHBondContact N-O 3.45Å; M582-Y633 WeakPolarHBondContact O-CD1 3.44Å; M582-Y633 PolarHBondContact O-N 3.09Å; M582-I635 HydrophobicContact CG-CD1 3.87Å; M582-I635 HydrophobicContact CG-CG1 4.36Å
583P95.3Very high93.2Very high34 Ų3453.6 Ų53.622%0.22127%0.266CS..PPolyproline II helixtrans-74.1146.3178.431.4-36.9000112.5V51 D131 P135 Y633V51-P583 HydrophobicContact CG2-CB 3.99Å; V51-P583 HydrophobicContact CG2-CG 3.75Å; D131-P583 WeakPolarHBondContact OD2-CG 3.47Å; P135-P583 HydrophobicContact CB-CB 4.23Å; P135-P583 HydrophobicContact CB-CG 4.01Å; P135-P583 HydrophobicContact CG-CB 4.21Å; P135-P583 HydrophobicContact CG-CG 3.92Å; P583-Y633 VanDerWaalsContact O-CE1 3.28Å; P583-Y633 WeakPolarHBondContact O-CE1 3.32Å
584N94.4Very high94.1Very high56 Ų5651.3 Ų51.330%0.29925%0.253SS..PPolyproline II helixtrans-76.5154.2173.7-74-49.2000112V51 D630 G632 Y633V51-N584 WeakPolarHBondContact CG1-O 3.45Å; V51-N584 WeakPolarHBondContact CG2-O 3.34Å; N584-D630 WeakPolarHBondContact CB-OD1 3.5Å; N584-D630 PolarHBondContact ND2-OD1 3.44Å; N584-G632 VanDerWaalsContact ND2-C 3.26Å; N584-G632 WeakPolarHBondContact ND2-CA 3.5Å; N584-G632 PolarHBondContact ND2-N 3.23Å; N584-G632 PolarHBondContact ND2-O 3.44Å; N584-G632 VanDerWaalsContact ND2-O 3.16Å; N584-Y633 VanDerWaalsContact OD1-CD1 3.3Å; N584-Y633 WeakPolarHBondContact OD1-CD1 3.48Å
585N95.4Very high94.9Very high71 Ų7150.2 Ų50.238%0.3825%0.245SC..PPolyproline II helixtrans-63.9147.6169.7-78.61000111.2K45 T49K45-N585 PolarHBondContact O-ND2 3.19Å; T49-N585 CarbonylContact O-C 3.59Å; T49-N585 WeakPolarHBondContact O-CA 3.33Å; T49-N585 WeakPolarHBondContact O-CB 3.41Å
586T94.6Very high95.4Very high2 Ų247.2 Ų47.21%0.01223%0.231CC..  trans-136.3134.5-175.8-173.50000112T49 V51 V136 N139 V588T49-T586 WeakPolarHBondContact CA-O 3.3Å; T49-T586 WeakPolarHBondContact CB-O 3.38Å; T49-T586 PolarHBondContact O-N 2.95Å; V51-T586 HydrophobicContact CG1-CG2 3.69Å; V136-T586 HydrophobicContact CB-CG2 4.39Å; V136-T586 HydrophobicContact CG1-CG2 4.08Å; V136-T586 HydrophobicContact CG2-CG2 4.11Å; N139-T586 HydrophobicContact CB-CG2 4.34Å; T586-V588 VanDerWaalsContact C-N 3.3Å; T586-V588 VanDerWaalsContact OG1-CG2 3.26Å; T586-V588 WeakPolarHBondContact OG1-CG2 3.06Å; T586-V588 PolarHBondContact OG1-N 3.4Å
587P94.5Very high95.7Very high33 Ų3343.2 Ų43.221%0.21421%0.211CC..SBendtrans-85.9-0.4173.936.5-36.4000113.5T49 G589 F590 W591T49-P587 HydrophobicContact CG2-CB 3.92Å; P587-G589 PolarHBondContact O-N 3.45Å; P587-F590 PolarHBondContact O-N 3.39Å; P587-W591 VanDerWaalsContact O-CD1 3.27Å; P587-W591 PolarHBondContact O-N 2.95Å; P587-W591 VanDerWaalsContact O-N 3.12Å
588V95Very high95.9Very high8 Ų845.1 Ų45.15%0.04822%0.223CC..Hα-helixtrans-58.5-50.6-171.71710000112.3V140 T586 F590 W591 I592 T621 R625V140-V588 HydrophobicContact CG2-CG1 4.18Å; T586-V588 VanDerWaalsContact C-N 3.3Å; T586-V588 VanDerWaalsContact OG1-CG2 3.26Å; T586-V588 WeakPolarHBondContact OG1-CG2 3.06Å; T586-V588 PolarHBondContact OG1-N 3.4Å; V588-F590 VanDerWaalsContact C-N 3.33Å; V588-F590 PolarHBondContact O-N 3.19Å; V588-W591 PolarHBondContact O-N 3.31Å; V588-I592 HydrophobicContact CG1-CD1 3.72Å; V588-I592 HydrophobicContact CG1-CG1 4.48Å; V588-I592 WeakPolarHBondContact O-CB 3.15Å; V588-I592 WeakPolarHBondContact O-CG1 3.5Å; V588-I592 PolarHBondContact O-N 2.81Å; V588-T621 HydrophobicContact CG1-CG2 4.23Å; V588-R625 HydrophobicContact CG1-CB 4.46Å; V588-R625 HydrophobicContact CG2-CB 3.79Å; V588-R625 HydrophobicContact CG2-CG 3.94Å
589G96.1Very high96.1Very high0 Ų038.9 Ų38.90%020%0.198CC..Hα-helixtrans-63.3-40.4-179.600000112.3N139 W143 P587 W591 I592 G593N139-G589 VanDerWaalsContact OD1-CA 3.24Å; N139-G589 WeakPolarHBondContact OD1-CA 3.32Å; N139-G589 PolarHBondContact OD1-N 3.28Å; W143-G589 WeakPolarHBondContact CB-O 3.4Å; P587-G589 PolarHBondContact O-N 3.45Å; G589-W591 PolarHBondContact O-N 3.04Å; G589-I592 PolarHBondContact O-N 3.11Å; G589-G593 PolarHBondContact O-N 2.74Å
590F96.5Very high96.1Very high34 Ų3434.5 Ų34.515%0.14918%0.176CC..Hα-helixtrans-59.1-48.8178.1-179.3-111000112.3Y44 F48 W143 P587 V588 G593 I594Y44-F590 HydrophobicContact CD2-CE1 4.49Å; Y44-F590 HydrophobicContact CE2-CD1 4.11Å; Y44-F590 HydrophobicContact CE2-CE1 4.1Å; F48-F590 HydrophobicContact CB-CD2 4.17Å; F48-F590 HydrophobicContact CB-CE2 4.47Å; F48-F590 HydrophobicContact CD2-CD2 4.46Å; F48-F590 AromaticContact CD2-CE2 3.94Å; F48-F590 HydrophobicContact CD2-CE2 3.94Å; F48-F590 HydrophobicContact CD2-CZ 4.18Å; F48-F590 HydrophobicContact CE2-CE2 4.43Å; F48-F590 HydrophobicContact CG-CD2 4.42Å; F48-F590 HydrophobicContact CG-CE2 4.28Å; W143-F590 VanDerWaalsContact CD1-N 3.3Å; W143-F590 HydrophobicContact CD2-CB 4.41Å; W143-F590 HydrophobicContact CD2-CD2 4.06Å; W143-F590 AromaticContact CE2-CD2 3.72Å; W143-F590 HydrophobicContact CE3-CD2 4.05Å; W143-F590 AromaticContact CH2-CD2 3.48Å; W143-F590 HydrophobicContact CH2-CD2 3.48Å; W143-F590 VanDerWaalsContact CH2-CD2 3.48Å; W143-F590 AromaticContact CH2-CE2 3.74Å; W143-F590 HydrophobicContact CH2-CE2 3.74Å; W143-F590 HydrophobicContact CZ2-CB 4.48Å; W143-F590 AromaticContact CZ2-CD2 3.45Å; W143-F590 HydrophobicContact CZ2-CD2 3.45Å; W143-F590 VanDerWaalsContact CZ2-CD2 3.45Å; W143-F590 HydrophobicContact CZ2-CE2 4.13Å; W143-F590 HydrophobicContact CZ2-CG 4.4Å; W143-F590 AromaticContact CZ3-CD2 3.77Å; W143-F590 HydrophobicContact CZ3-CD2 3.77Å; W143-F590 HydrophobicContact CZ3-CE2 4.04Å; P587-F590 PolarHBondContact O-N 3.39Å; V588-F590 VanDerWaalsContact C-N 3.33Å; V588-F590 PolarHBondContact O-N 3.19Å; F590-G593 PolarHBondContact O-N 3.37Å; F590-I594 HydrophobicContact CD1-CD1 3.97Å; F590-I594 HydrophobicContact CE1-CD1 3.51Å; F590-I594 HydrophobicContact CE2-CD1 4.3Å; F590-I594 HydrophobicContact CZ-CD1 3.72Å; F590-I594 WeakPolarHBondContact O-CG1 3.42Å; F590-I594 PolarHBondContact O-N 3.42Å
591W96.9Very high96.1Very high111 Ų11136.6 Ų36.642%0.4219%0.185SC..Hα-helixtrans-69.5-40.3179-73.6113.2000113P587 V588 G589 G593 I594 F595 T621P587-W591 VanDerWaalsContact O-CD1 3.27Å; P587-W591 PolarHBondContact O-N 2.95Å; P587-W591 VanDerWaalsContact O-N 3.12Å; V588-W591 PolarHBondContact O-N 3.31Å; G589-W591 PolarHBondContact O-N 3.04Å; W591-G593 VanDerWaalsContact C-N 3.28Å; W591-G593 PolarHBondContact O-N 3.27Å; W591-I594 HydrophobicContact CE3-CD1 3.81Å; W591-I594 HydrophobicContact CZ3-CD1 3.92Å; W591-I594 PolarHBondContact O-N 3.01Å; W591-F595 HydrophobicContact CB-CE2 4.45Å; W591-F595 WeakPolarHBondContact O-CD2 3.46Å; W591-F595 PolarHBondContact O-N 2.79Å; W591-T621 HydrophobicContact CB-CG2 4.13Å
592I97.5Very high96.1Very high12 Ų1234.8 Ų34.86%0.06218%0.176CC..Hα-helixtrans-58.6-43.9172.4-70.7174.1000110.1V140 L144 V588 G589 I594 F595 M596 I618 T621 M622V140-I592 HydrophobicContact CG2-CD1 4.48Å; L144-I592 HydrophobicContact CD2-CG2 3.97Å; V588-I592 HydrophobicContact CG1-CD1 3.72Å; V588-I592 HydrophobicContact CG1-CG1 4.48Å; V588-I592 WeakPolarHBondContact O-CB 3.15Å; V588-I592 WeakPolarHBondContact O-CG1 3.5Å; V588-I592 PolarHBondContact O-N 2.81Å; G589-I592 PolarHBondContact O-N 3.11Å; I592-I594 PolarHBondContact O-N 3.48Å; I592-F595 PolarHBondContact O-N 3.25Å; I592-M596 HydrophobicContact CG2-CG 4.11Å; I592-M596 WeakPolarHBondContact O-CB 3.39Å; I592-M596 WeakPolarHBondContact O-CG 3.18Å; I592-M596 PolarHBondContact O-N 3.17Å; I592-I618 HydrophobicContact CG2-CG2 4.35Å; I592-T621 HydrophobicContact CD1-CG2 4.48Å; I592-T621 HydrophobicContact CG1-CG2 3.95Å; I592-M622 HydrophobicContact CD1-CG 4.07Å
593G97.3Very high96Very high3 Ų336.1 Ų36.13%0.03118%0.183CC..Hα-helixtrans-56.9-47.8175.300000112.5G589 F590 W591 F595 M596 T597G589-G593 PolarHBondContact O-N 2.74Å; F590-G593 PolarHBondContact O-N 3.37Å; W591-G593 VanDerWaalsContact C-N 3.28Å; W591-G593 PolarHBondContact O-N 3.27Å; G593-F595 PolarHBondContact O-N 3.1Å; G593-M596 PolarHBondContact O-N 2.99Å; G593-T597 PolarHBondContact O-N 3.02Å; G593-T597 PolarHBondContact O-OG1 3.4Å; G593-T597 VanDerWaalsContact O-OG1 3.07Å
594I97Very high96Very high51 Ų5134.5 Ų34.526%0.26217%0.173SC..Hα-helixtrans-58.4-50.6176.8-70.8169.6000111.3F590 W591 I592 M596 T597 I598F590-I594 HydrophobicContact CD1-CD1 3.97Å; F590-I594 HydrophobicContact CE1-CD1 3.51Å; F590-I594 HydrophobicContact CE2-CD1 4.3Å; F590-I594 HydrophobicContact CZ-CD1 3.72Å; F590-I594 WeakPolarHBondContact O-CG1 3.42Å; F590-I594 PolarHBondContact O-N 3.42Å; W591-I594 HydrophobicContact CE3-CD1 3.81Å; W591-I594 HydrophobicContact CZ3-CD1 3.92Å; W591-I594 PolarHBondContact O-N 3.01Å; I592-I594 PolarHBondContact O-N 3.48Å; I594-M596 VanDerWaalsContact C-N 3.33Å; I594-M596 PolarHBondContact O-N 3.26Å; I594-T597 PolarHBondContact O-N 2.94Å; I594-I598 HydrophobicContact CG2-CD1 3.75Å; I594-I598 HydrophobicContact CG2-CG1 4.48Å; I594-I598 WeakPolarHBondContact O-CG1 3.39Å; I594-I598 PolarHBondContact O-N 3.43Å
595F97.5Very high95.9Very high56 Ų5632.1 Ų32.125%0.24616%0.159CC..Hα-helixtrans-65.5-36.9-179.7-69.3-59.4000112.2W591 I592 G593 G599 C614 I618W591-F595 HydrophobicContact CB-CE2 4.45Å; W591-F595 WeakPolarHBondContact O-CD2 3.46Å; W591-F595 PolarHBondContact O-N 2.79Å; I592-F595 PolarHBondContact O-N 3.25Å; G593-F595 PolarHBondContact O-N 3.1Å; F595-G599 PolarHBondContact O-N 3.19Å; F595-C614 HydrophobicContact CB-CB 4.47Å; F595-C614 WeakPolarHBondContact O-CB 3.36Å; F595-I618 HydrophobicContact CB-CD1 4.2Å; F595-I618 HydrophobicContact CB-CG1 3.54Å; F595-I618 HydrophobicContact CG-CG1 4.47Å
596M97.4Very high95.7Very high36 Ų3633.5 Ų33.518%0.17716%0.164CC..Hα-helixtrans-64-41.8173.6-75.1-72.1-168.600111.9L144 A147 I191 L194 I592 G593 I594 G600 I618L144-M596 HydrophobicContact CD2-CB 4.47Å; L144-M596 HydrophobicContact CD2-CE 4.09Å; L144-M596 HydrophobicContact CD2-CG 3.74Å; L144-M596 HydrophobicContact CD2-SD 4.48Å; A147-M596 HydrophobicContact CB-CB 4.28Å; I191-M596 HydrophobicContact CD1-CB 4.43Å; I191-M596 HydrophobicContact CG1-SD 4.35Å; I191-M596 HydrophobicContact CG2-CB 4.05Å; I191-M596 HydrophobicContact CG2-CG 4.42Å; L194-M596 HydrophobicContact CD1-CE 4.42Å; I592-M596 HydrophobicContact CG2-CG 4.11Å; I592-M596 WeakPolarHBondContact O-CB 3.39Å; I592-M596 WeakPolarHBondContact O-CG 3.18Å; I592-M596 PolarHBondContact O-N 3.17Å; G593-M596 PolarHBondContact O-N 2.99Å; I594-M596 VanDerWaalsContact C-N 3.33Å; I594-M596 PolarHBondContact O-N 3.26Å; M596-G600 WeakPolarHBondContact O-CA 3.49Å; M596-G600 PolarHBondContact O-N 2.9Å; M596-I618 HydrophobicContact CE-CD1 3.72Å; M596-I618 HydrophobicContact CE-CG1 4.5Å; M596-I618 HydrophobicContact CE-CG2 4.28Å; M596-I618 HydrophobicContact CG-CD1 3.76Å; M596-I618 HydrophobicContact CG-CG1 4.35Å; M596-I618 HydrophobicContact SD-CD1 3.48Å; M596-I618 WeakPolarHBondContact SD-CD1 3.44Å
597T97.2Very high95.6Very high27 Ų2734 Ų3417%0.16617%0.167CC..Hα-helixtrans-63.5-50.7175.4-60.50000111.3A147 I150 L151 G593 I594 F601A147-T597 WeakPolarHBondContact CA-OG1 3.45Å; A147-T597 WeakPolarHBondContact CB-OG1 3.24Å; I150-T597 HydrophobicContact CG2-CG2 4.14Å; L151-T597 HydrophobicContact CD2-CG2 4.24Å; L151-T597 WeakPolarHBondContact CD2-O 3.07Å; L151-T597 HydrophobicContact CG-CG2 4.33Å; G593-T597 PolarHBondContact O-N 3.02Å; G593-T597 PolarHBondContact O-OG1 3.4Å; G593-T597 VanDerWaalsContact O-OG1 3.07Å; I594-T597 PolarHBondContact O-N 2.94Å; T597-F601 WeakPolarHBondContact O-CB 3.25Å; T597-F601 PolarHBondContact O-N 2.95Å
598I96.7Very high95.4Very high74 Ų7434.8 Ų34.838%0.37917%0.171SC..Hα-helixtrans-66.7-47.6-177.6-62.2170.9000110.4I594 G600 F601 F602 C614I594-I598 HydrophobicContact CG2-CD1 3.75Å; I594-I598 HydrophobicContact CG2-CG1 4.48Å; I594-I598 WeakPolarHBondContact O-CG1 3.39Å; I594-I598 PolarHBondContact O-N 3.43Å; I598-G600 PolarHBondContact O-N 3.03Å; I598-F601 PolarHBondContact O-N 3.35Å; I598-F602 HydrophobicContact CG2-CD2 3.82Å; I598-F602 HydrophobicContact CG2-CE2 3.56Å; I598-F602 WeakPolarHBondContact O-CD2 3.15Å; I598-F602 PolarHBondContact O-N 3.46Å; I598-F602 VanDerWaalsContact O-N 3.11Å; I598-C614 VanDerWaalsContact CG2-SG 3.55Å
599G96.2Very high95.3Very high8 Ų839.9 Ų39.98%0.08220%0.196CC..Hα-helixtrans-63.7-42.4179.400000112.5F595 F602 L603 A611F595-G599 PolarHBondContact O-N 3.19Å; G599-F602 PolarHBondContact O-N 3.33Å; G599-L603 WeakPolarHBondContact O-CB 3.49Å; G599-L603 PolarHBondContact O-N 3.38Å; G599-A611 WeakPolarHBondContact O-CB 3.29Å
600G96.4Very high95.1Very high6 Ų640.2 Ų40.26%0.06220%0.199CC..Hα-helixtrans-62.1-42.8174.600000112.4M596 I598 F602 L603 I604M596-G600 WeakPolarHBondContact O-CA 3.49Å; M596-G600 PolarHBondContact O-N 2.9Å; I598-G600 PolarHBondContact O-N 3.03Å; G600-F602 PolarHBondContact O-N 3.15Å; G600-L603 PolarHBondContact O-N 3.28Å; G600-I604 WeakPolarHBondContact O-CD1 3.26Å; G600-I604 VanDerWaalsContact O-CG1 3.25Å; G600-I604 WeakPolarHBondContact O-CG1 3.41Å; G600-I604 PolarHBondContact O-N 3.47Å
601F95.4Very high95Very high44 Ų4439.3 Ų39.319%0.19320%0.198CC..Hα-helixtrans-58.5-46.7176.1179.6-93.6000112F3 L8 L151 L154 I158 T597 I598 L603 I604 F605F3-F601 HydrophobicContact CE2-CE1 4.19Å; F3-F601 AromaticContact CZ-CE1 3.86Å; F3-F601 HydrophobicContact CZ-CE1 3.86Å; F3-F601 HydrophobicContact CZ-CZ 4.28Å; L8-F601 HydrophobicContact CD2-CZ 4.15Å; L151-F601 HydrophobicContact CD2-CB 3.86Å; L154-F601 HydrophobicContact CD1-CD2 4.44Å; I158-F601 HydrophobicContact CG2-CE2 4.01Å; I158-F601 HydrophobicContact CG2-CZ 4.23Å; T597-F601 WeakPolarHBondContact O-CB 3.25Å; T597-F601 PolarHBondContact O-N 2.95Å; I598-F601 PolarHBondContact O-N 3.35Å; F601-L603 VanDerWaalsContact C-N 3.34Å; F601-L603 PolarHBondContact O-N 3.11Å; F601-I604 WeakPolarHBondContact O-CB 3.46Å; F601-I604 PolarHBondContact O-N 3.03Å; F601-F605 HydrophobicContact CD1-CD2 4.5Å; F601-F605 HydrophobicContact CD2-CE2 4.23Å; F601-F605 HydrophobicContact CE1-CD2 4.11Å; F601-F605 HydrophobicContact CE1-CE2 4.21Å; F601-F605 HydrophobicContact CE2-CD2 4.22Å; F601-F605 AromaticContact CE2-CE2 3.61Å; F601-F605 HydrophobicContact CE2-CE2 3.61Å; F601-F605 AromaticContact CZ-CD2 3.96Å; F601-F605 HydrophobicContact CZ-CD2 3.96Å; F601-F605 AromaticContact CZ-CE2 3.58Å; F601-F605 HydrophobicContact CZ-CE2 3.58Å; F601-F605 WeakPolarHBondContact O-CD2 3.47Å; F601-F605 PolarHBondContact O-N 2.62Å
602F94.8Very high94.8Very high54 Ų5438 Ų3824%0.23720%0.198CC..Hα-helixtrans-66.1-36.6177.6-76.7-66.3000112.9F3 I598 G599 G600 I604 F605 E606 T607 P610 A611F3-F602 HydrophobicContact CD2-CD1 4.13Å; F3-F602 HydrophobicContact CD2-CE1 4.24Å; F3-F602 AromaticContact CE2-CD1 3.98Å; F3-F602 HydrophobicContact CE2-CD1 3.98Å; F3-F602 HydrophobicContact CE2-CE1 4.22Å; I598-F602 HydrophobicContact CG2-CD2 3.82Å; I598-F602 HydrophobicContact CG2-CE2 3.56Å; I598-F602 WeakPolarHBondContact O-CD2 3.15Å; I598-F602 PolarHBondContact O-N 3.46Å; I598-F602 VanDerWaalsContact O-N 3.11Å; G599-F602 PolarHBondContact O-N 3.33Å; G600-F602 PolarHBondContact O-N 3.15Å; F602-I604 VanDerWaalsContact C-N 3.32Å; F602-F605 CarbonylContact O-C 3.51Å; F602-F605 PolarHBondContact O-N 3.32Å; F602-E606 PolarHBondContact O-N 3.05Å; F602-T607 HydrophobicContact CD1-CG2 4.43Å; F602-T607 WeakPolarHBondContact O-CA 3.41Å; F602-T607 WeakPolarHBondContact O-CB 3.49Å; F602-T607 PolarHBondContact O-N 3.1Å; F602-P610 HydrophobicContact CB-CB 3.95Å; F602-P610 HydrophobicContact CB-CG 4.45Å; F602-P610 HydrophobicContact CD1-CB 3.81Å; F602-P610 HydrophobicContact CD1-CG 3.83Å; F602-P610 HydrophobicContact CD2-CB 3.36Å; F602-P610 HydrophobicContact CD2-CG 4.29Å; F602-P610 HydrophobicContact CE1-CB 4.1Å; F602-P610 HydrophobicContact CE1-CG 4.07Å; F602-P610 HydrophobicContact CE2-CB 3.67Å; F602-P610 HydrophobicContact CE2-CG 4.49Å; F602-P610 HydrophobicContact CG-CB 3.44Å; F602-P610 VanDerWaalsContact CG-CB 3.44Å; F602-P610 HydrophobicContact CG-CG 3.96Å; F602-P610 HydrophobicContact CZ-CB 4.04Å; F602-P610 HydrophobicContact CZ-CG 4.39Å; F602-A611 HydrophobicContact CB-CB 4.36Å
603L93.7Very high94.7Very high39 Ų3942.4 Ų42.420%0.20422%0.221CC..Hα-helixtrans-67.4-33.1176.5-170.561.2000112.3I187 I253 G599 G600 F601 F605 E606 A611I187-L603 HydrophobicContact CD1-CD2 3.55Å; I187-L603 HydrophobicContact CD1-CG 4.07Å; I187-L603 HydrophobicContact CG1-CD2 4.3Å; I187-L603 HydrophobicContact CG1-CG 4.42Å; I253-L603 HydrophobicContact CD1-CD1 3.67Å; I253-L603 HydrophobicContact CD1-CG 3.71Å; I253-L603 HydrophobicContact CG2-CD1 4.23Å; G599-L603 WeakPolarHBondContact O-CB 3.49Å; G599-L603 PolarHBondContact O-N 3.38Å; G600-L603 PolarHBondContact O-N 3.28Å; F601-L603 VanDerWaalsContact C-N 3.34Å; F601-L603 PolarHBondContact O-N 3.11Å; L603-F605 VanDerWaalsContact C-N 3.26Å; L603-F605 PolarHBondContact O-N 3.23Å; L603-E606 PolarHBondContact O-N 3.13Å; L603-A611 HydrophobicContact CB-CB 4.21Å
604I94.5Very high94.7Very high0 Ų042.9 Ų42.90%022%0.224CC..Hα-helixtrans-60.1-37.4174.8-74155.5000111.9L151 P180 N183 Y184 I187 G600 F601 F602 E606L151-I604 HydrophobicContact CB-CD1 4.49Å; L151-I604 HydrophobicContact CD2-CD1 3.97Å; P180-I604 HydrophobicContact CB-CG2 4.02Å; N183-I604 HydrophobicContact CB-CB 4.32Å; N183-I604 HydrophobicContact CB-CG1 4.38Å; N183-I604 HydrophobicContact CB-CG2 4.11Å; N183-I604 WeakPolarHBondContact CB-O 3.5Å; N183-I604 PolarHBondContact ND2-O 3.02Å; Y184-I604 HydrophobicContact CD1-CD1 3.5Å; Y184-I604 VanDerWaalsContact CD1-CD1 3.5Å; Y184-I604 HydrophobicContact CD1-CG1 4.3Å; Y184-I604 HydrophobicContact CD1-CG2 4.03Å; Y184-I604 HydrophobicContact CD2-CG2 3.65Å; Y184-I604 HydrophobicContact CE1-CD1 3.75Å; Y184-I604 HydrophobicContact CE1-CG2 3.99Å; Y184-I604 HydrophobicContact CE2-CG2 3.6Å; Y184-I604 HydrophobicContact CG-CD1 4.17Å; Y184-I604 HydrophobicContact CG-CG2 3.84Å; I187-I604 HydrophobicContact CB-CD1 4.22Å; I187-I604 HydrophobicContact CB-CG1 3.89Å; I187-I604 HydrophobicContact CG1-CG1 3.96Å; I187-I604 HydrophobicContact CG2-CD1 4.31Å; I187-I604 HydrophobicContact CG2-CG1 4.27Å; G600-I604 WeakPolarHBondContact O-CD1 3.26Å; G600-I604 VanDerWaalsContact O-CG1 3.25Å; G600-I604 WeakPolarHBondContact O-CG1 3.41Å; G600-I604 PolarHBondContact O-N 3.47Å; F601-I604 WeakPolarHBondContact O-CB 3.46Å; F601-I604 PolarHBondContact O-N 3.03Å; F602-I604 VanDerWaalsContact C-N 3.32Å; I604-E606 VanDerWaalsContact C-N 3.28Å
605F93.2Very high94.6Very high5 Ų544 Ų442%0.02223%0.23CC..THydrogen-bonded Turntrans-93.726.3173.8-69.1-78.7000112.7F3 P4 Q7 L8 I158 P180 Y184 F601 F602 L603 T607F3-F605 HydrophobicContact CD2-CB 4.33Å; F3-F605 HydrophobicContact CE2-CB 3.61Å; F3-F605 HydrophobicContact CE2-CD2 4.04Å; F3-F605 AromaticContact CE2-CG 3.9Å; F3-F605 HydrophobicContact CE2-CG 3.9Å; F3-F605 HydrophobicContact CZ-CB 3.94Å; F3-F605 HydrophobicContact CZ-CD1 4.28Å; F3-F605 AromaticContact CZ-CD2 3.74Å; F3-F605 HydrophobicContact CZ-CD2 3.74Å; F3-F605 HydrophobicContact CZ-CE2 4.35Å; F3-F605 AromaticContact CZ-CG 3.71Å; F3-F605 HydrophobicContact CZ-CG 3.71Å; P4-F605 HydrophobicContact CG-CB 3.99Å; P4-F605 HydrophobicContact CG-CD1 3.79Å; P4-F605 HydrophobicContact CG-CG 4.33Å; Q7-F605 HydrophobicContact CB-CD1 4.47Å; Q7-F605 HydrophobicContact CB-CE1 4.08Å; L8-F605 HydrophobicContact CD2-CE1 4.4Å; L8-F605 HydrophobicContact CD2-CE2 4.3Å; L8-F605 HydrophobicContact CD2-CZ 3.99Å; I158-F605 HydrophobicContact CG2-CE2 4.03Å; I158-F605 HydrophobicContact CG2-CZ 3.7Å; P180-F605 HydrophobicContact CB-CD1 4.39Å; P180-F605 HydrophobicContact CB-CE1 4.17Å; P180-F605 HydrophobicContact CG-CE1 4.07Å; Y184-F605 HydrophobicContact CE2-CZ 4.42Å; Y184-F605 WeakPolarHBondContact OH-CE2 3.45Å; F601-F605 HydrophobicContact CD1-CD2 4.5Å; F601-F605 HydrophobicContact CD2-CE2 4.23Å; F601-F605 HydrophobicContact CE1-CD2 4.11Å; F601-F605 HydrophobicContact CE1-CE2 4.21Å; F601-F605 HydrophobicContact CE2-CD2 4.22Å; F601-F605 AromaticContact CE2-CE2 3.61Å; F601-F605 HydrophobicContact CE2-CE2 3.61Å; F601-F605 AromaticContact CZ-CD2 3.96Å; F601-F605 HydrophobicContact CZ-CD2 3.96Å; F601-F605 AromaticContact CZ-CE2 3.58Å; F601-F605 HydrophobicContact CZ-CE2 3.58Å; F601-F605 WeakPolarHBondContact O-CD2 3.47Å; F601-F605 PolarHBondContact O-N 2.62Å; F602-F605 CarbonylContact O-C 3.51Å; F602-F605 PolarHBondContact O-N 3.32Å; L603-F605 VanDerWaalsContact C-N 3.26Å; L603-F605 PolarHBondContact O-N 3.23Å; F605-T607 PolarHBondContact O-N 3.12Å; F605-T607 PolarHBondContact O-OG1 2.84Å
606E91.5Very high94.5Very high100 Ų10048.7 Ų48.747%0.46725%0.251SS..THydrogen-bonded Turntrans54.822.6173.3-67.3164.2-151.900114.2N183 I253 F602 L603 I604 V608N183-E606 PolarHBondContact ND2-OE1 3.03Å; I253-E606 HydrophobicContact CG1-CG 4.22Å; I253-E606 HydrophobicContact CG2-CG 4.49Å; F602-E606 PolarHBondContact O-N 3.05Å; L603-E606 PolarHBondContact O-N 3.13Å; I604-E606 VanDerWaalsContact C-N 3.28Å; E606-V608 PolarHBondContact O-N 3.07Å
607T92Very high94.4Very high14 Ų1447.8 Ų47.89%0.08625%0.251CS..  trans-97.889-178.3-50.90000109.5F3 F602 F605 P610F3-T607 WeakPolarHBondContact CD2-OG1 3.5Å; F602-T607 HydrophobicContact CD1-CG2 4.43Å; F602-T607 WeakPolarHBondContact O-CA 3.41Å; F602-T607 WeakPolarHBondContact O-CB 3.49Å; F602-T607 PolarHBondContact O-N 3.1Å; F605-T607 PolarHBondContact O-N 3.12Å; F605-T607 PolarHBondContact O-OG1 2.84Å; T607-P610 HydrophobicContact CG2-CG 3.77Å; T607-P610 WeakPolarHBondContact O-CD 3.32Å
608V91.1Very high94.3Very high48 Ų4847.1 Ų47.129%0.29125%0.246SC..Hα-helixtrans-70.1-37.8-169.3-178.80000114F254 E606 A611 L612F254-V608 HydrophobicContact CE1-CG2 4.3Å; F254-V608 HydrophobicContact CZ-CG2 4.49Å; E606-V608 PolarHBondContact O-N 3.07Å; V608-A611 WeakPolarHBondContact O-CB 3.46Å; V608-A611 PolarHBondContact O-N 3.11Å; V608-A611 VanDerWaalsContact O-N 3.12Å; V608-L612 HydrophobicContact CG1-CD1 3.89Å; V608-L612 HydrophobicContact CG1-CG 3.97Å; V608-L612 WeakPolarHBondContact O-CG 3.28Å; V608-L612 PolarHBondContact O-N 3.42Å
609I92.4Very high94.3Very high115 Ų11548.8 Ų48.859%0.5925%0.251SS*.Hα-helixtrans-60.8-52.2-172.5-61.7170.8000112.7A611 L612 I613I609-A611 VanDerWaalsContact C-N 3.27Å; I609-A611 PolarHBondContact O-N 3.23Å; I609-L612 PolarHBondContact O-N 3.06Å; I609-I613 HydrophobicContact CG2-CD1 4.42Å; I609-I613 WeakPolarHBondContact O-CG1 3.43Å; I609-I613 PolarHBondContact O-N 3.34Å; I609-I613 VanDerWaalsContact O-N 3.1Å
610P93Very high94.2Very high7 Ų750.2 Ų50.25%0.04527%0.265CS..Hα-helixtrans-59.7-36173.1-21.331.5000113.5M1 F602 T607 L612 I613 C614M1-P610 HydrophobicContact CE-CG 3.58Å; M1-P610 HydrophobicContact SD-CG 3.68Å; F602-P610 HydrophobicContact CB-CB 3.95Å; F602-P610 HydrophobicContact CB-CG 4.45Å; F602-P610 HydrophobicContact CD1-CB 3.81Å; F602-P610 HydrophobicContact CD1-CG 3.83Å; F602-P610 HydrophobicContact CD2-CB 3.36Å; F602-P610 HydrophobicContact CD2-CG 4.29Å; F602-P610 HydrophobicContact CE1-CB 4.1Å; F602-P610 HydrophobicContact CE1-CG 4.07Å; F602-P610 HydrophobicContact CE2-CB 3.67Å; F602-P610 HydrophobicContact CE2-CG 4.49Å; F602-P610 HydrophobicContact CG-CB 3.44Å; F602-P610 VanDerWaalsContact CG-CB 3.44Å; F602-P610 HydrophobicContact CG-CG 3.96Å; F602-P610 HydrophobicContact CZ-CB 4.04Å; F602-P610 HydrophobicContact CZ-CG 4.39Å; T607-P610 HydrophobicContact CG2-CG 3.77Å; T607-P610 WeakPolarHBondContact O-CD 3.32Å; P610-L612 VanDerWaalsContact C-N 3.33Å; P610-L612 PolarHBondContact O-N 3.05Å; P610-I613 PolarHBondContact O-N 2.86Å; P610-C614 PolarHBondContact O-N 3.3Å; P610-C614 PolarHBondContact O-SG 3.38Å
611A92.9Very high94.2Very high16 Ų1650.7 Ų50.713%0.13227%0.267CS..Hα-helixtrans-62.9-41.4177.500000111.2G599 F602 L603 V608 I609 C614 L615G599-A611 WeakPolarHBondContact O-CB 3.29Å; F602-A611 HydrophobicContact CB-CB 4.36Å; L603-A611 HydrophobicContact CB-CB 4.21Å; V608-A611 WeakPolarHBondContact O-CB 3.46Å; V608-A611 PolarHBondContact O-N 3.11Å; V608-A611 VanDerWaalsContact O-N 3.12Å; I609-A611 VanDerWaalsContact C-N 3.27Å; I609-A611 PolarHBondContact O-N 3.23Å; A611-C614 PolarHBondContact O-N 2.65Å; A611-L615 PolarHBondContact O-N 3.14Å
612L93.6Very high94.1Very high83 Ų8353.5 Ų53.544%0.43528%0.282SS..Hα-helixtrans-63.8-39.1173.1-69.1174.6000112.5V608 I609 P610 C614 L615 F616V608-L612 HydrophobicContact CG1-CD1 3.89Å; V608-L612 HydrophobicContact CG1-CG 3.97Å; V608-L612 WeakPolarHBondContact O-CG 3.28Å; V608-L612 PolarHBondContact O-N 3.42Å; I609-L612 PolarHBondContact O-N 3.06Å; P610-L612 VanDerWaalsContact C-N 3.33Å; P610-L612 PolarHBondContact O-N 3.05Å; L612-C614 VanDerWaalsContact C-N 3.32Å; L612-C614 PolarHBondContact O-N 3.18Å; L612-L615 HydrophobicContact CD2-CD2 4.31Å; L612-L615 WeakPolarHBondContact O-CB 3.46Å; L612-L615 PolarHBondContact O-N 3Å; L612-F616 WeakPolarHBondContact O-CD2 3.34Å; L612-F616 PolarHBondContact O-N 3.42Å
613I95.7Very high94.2Very high105 Ų10555.4 Ų55.454%0.53829%0.293SS..Hα-helixtrans-60.6-44.1174.5-65.5169.2000110.5I609 P610 L615 F616 G617I609-I613 HydrophobicContact CG2-CD1 4.42Å; I609-I613 WeakPolarHBondContact O-CG1 3.43Å; I609-I613 PolarHBondContact O-N 3.34Å; I609-I613 VanDerWaalsContact O-N 3.1Å; P610-I613 PolarHBondContact O-N 2.86Å; I613-L615 VanDerWaalsContact C-N 3.31Å; I613-L615 PolarHBondContact O-N 3.01Å; I613-F616 PolarHBondContact O-N 3.07Å; I613-G617 PolarHBondContact O-N 2.97Å; I613-G617 VanDerWaalsContact O-N 3.09Å
614C96.1Very high94.2Very high13 Ų1360.2 Ų60.29%0.08831%0.31CS..Hα-helixtrans-65.3-35.9176.4-63.90000112F595 I598 P610 A611 L612 F616 G617 I618F595-C614 HydrophobicContact CB-CB 4.47Å; F595-C614 WeakPolarHBondContact O-CB 3.36Å; I598-C614 VanDerWaalsContact CG2-SG 3.55Å; P610-C614 PolarHBondContact O-N 3.3Å; P610-C614 PolarHBondContact O-SG 3.38Å; A611-C614 PolarHBondContact O-N 2.65Å; L612-C614 VanDerWaalsContact C-N 3.32Å; L612-C614 PolarHBondContact O-N 3.18Å; C614-F616 VanDerWaalsContact C-N 3.33Å; C614-F616 PolarHBondContact O-N 3.07Å; C614-G617 WeakPolarHBondContact O-CA 3.2Å; C614-G617 PolarHBondContact O-N 2.92Å; C614-I618 WeakPolarHBondContact O-CG1 3.27Å; C614-I618 PolarHBondContact O-N 3.14Å
615L94.9Very high94.1Very high75 Ų7562.9 Ų62.939%0.39332%0.32SS..Hα-helixtrans-59.6-42.7173.2-174.663.8000111.8A611 L612 I613 G617 I618 F619A611-L615 PolarHBondContact O-N 3.14Å; L612-L615 HydrophobicContact CD2-CD2 4.31Å; L612-L615 WeakPolarHBondContact O-CB 3.46Å; L612-L615 PolarHBondContact O-N 3Å; I613-L615 VanDerWaalsContact C-N 3.31Å; I613-L615 PolarHBondContact O-N 3.01Å; L615-G617 VanDerWaalsContact C-N 3.3Å; L615-G617 PolarHBondContact O-N 3.28Å; L615-I618 WeakPolarHBondContact O-CB 3.34Å; L615-I618 PolarHBondContact O-N 3.5Å; L615-F619 HydrophobicContact CD1-CD2 4.11Å; L615-F619 HydrophobicContact CD1-CE2 3.62Å; L615-F619 HydrophobicContact CD1-CZ 4.45Å; L615-F619 HydrophobicContact CD2-CE2 4.23Å; L615-F619 HydrophobicContact CG-CD2 3.96Å; L615-F619 HydrophobicContact CG-CE2 3.69Å; L615-F619 VanDerWaalsContact O-CD2 3.27Å; L615-F619 WeakPolarHBondContact O-CD2 3.05Å; L615-F619 PolarHBondContact O-N 3.48Å
616F96Very high94Very high154 Ų15467.1 Ų67.168%0.67535%0.35SS*.Hα-helixtrans-63.1-34.8171.7-70-64.8000112.5L612 I613 C614 G620L612-F616 WeakPolarHBondContact O-CD2 3.34Å; L612-F616 PolarHBondContact O-N 3.42Å; I613-F616 PolarHBondContact O-N 3.07Å; C614-F616 VanDerWaalsContact C-N 3.33Å; C614-F616 PolarHBondContact O-N 3.07Å; F616-G620 WeakPolarHBondContact O-CA 3.37Å; F616-G620 PolarHBondContact O-N 3.07Å
617G95.2Very high94.1Very high17 Ų1770.3 Ų70.318%0.17536%0.363CS..Hα-helixtrans-62.4-40172.400000113.3I613 C614 L615 T621I613-G617 PolarHBondContact O-N 2.97Å; I613-G617 VanDerWaalsContact O-N 3.09Å; C614-G617 WeakPolarHBondContact O-CA 3.2Å; C614-G617 PolarHBondContact O-N 2.92Å; L615-G617 VanDerWaalsContact C-N 3.3Å; L615-G617 PolarHBondContact O-N 3.28Å; G617-T621 WeakPolarHBondContact O-CB 3.5Å; G617-T621 PolarHBondContact O-N 3.18Å; G617-T621 PolarHBondContact O-OG1 3.18Å
618I95.4Very high93.9Very high13 Ų1372.4 Ų72.47%0.06737%0.372CS..Hα-helixtrans-63.1-54.4175-65.3159.3000110I592 F595 M596 C614 L615 G620 T621 M622I592-I618 HydrophobicContact CG2-CG2 4.35Å; F595-I618 HydrophobicContact CB-CD1 4.2Å; F595-I618 HydrophobicContact CB-CG1 3.54Å; F595-I618 HydrophobicContact CG-CG1 4.47Å; M596-I618 HydrophobicContact CE-CD1 3.72Å; M596-I618 HydrophobicContact CE-CG1 4.5Å; M596-I618 HydrophobicContact CE-CG2 4.28Å; M596-I618 HydrophobicContact CG-CD1 3.76Å; M596-I618 HydrophobicContact CG-CG1 4.35Å; M596-I618 HydrophobicContact SD-CD1 3.48Å; M596-I618 WeakPolarHBondContact SD-CD1 3.44Å; C614-I618 WeakPolarHBondContact O-CG1 3.27Å; C614-I618 PolarHBondContact O-N 3.14Å; L615-I618 WeakPolarHBondContact O-CB 3.34Å; L615-I618 PolarHBondContact O-N 3.5Å; I618-G620 VanDerWaalsContact C-N 3.31Å; I618-G620 PolarHBondContact O-N 3.26Å; I618-T621 WeakPolarHBondContact O-CB 3.42Å; I618-T621 PolarHBondContact O-N 3.41Å; I618-T621 VanDerWaalsContact O-N 3.13Å; I618-M622 HydrophobicContact CG2-SD 4.25Å; I618-M622 WeakPolarHBondContact O-CG 3.42Å; I618-M622 PolarHBondContact O-N 2.82Å
619F95.5Very high93.7Very high109 Ų10977 Ų7748%0.47839%0.393SS..Hα-helixtrans-61.8-39.5178.3-75.7-63.2000112.1L615 T621 M622 I623L615-F619 HydrophobicContact CD1-CD2 4.11Å; L615-F619 HydrophobicContact CD1-CE2 3.62Å; L615-F619 HydrophobicContact CD1-CZ 4.45Å; L615-F619 HydrophobicContact CD2-CE2 4.23Å; L615-F619 HydrophobicContact CG-CD2 3.96Å; L615-F619 HydrophobicContact CG-CE2 3.69Å; L615-F619 VanDerWaalsContact O-CD2 3.27Å; L615-F619 WeakPolarHBondContact O-CD2 3.05Å; L615-F619 PolarHBondContact O-N 3.48Å; F619-T621 VanDerWaalsContact C-N 3.31Å; F619-T621 PolarHBondContact O-N 3.08Å; F619-M622 HydrophobicContact CD1-SD 4.41Å; F619-M622 PolarHBondContact O-N 2.94Å; F619-I623 WeakPolarHBondContact O-CB 3.48Å; F619-I623 WeakPolarHBondContact O-CG1 3.48Å; F619-I623 PolarHBondContact O-N 3.23Å
620G96.1Very high93.4Very high37 Ų3773.9 Ų73.938%0.38138%0.378SS..Hα-helixtrans-59.4-40.2174.200000112.4F616 I618 I623 Y624F616-G620 WeakPolarHBondContact O-CA 3.37Å; F616-G620 PolarHBondContact O-N 3.07Å; I618-G620 VanDerWaalsContact C-N 3.31Å; I618-G620 PolarHBondContact O-N 3.26Å; G620-I623 PolarHBondContact O-N 2.88Å; G620-Y624 VanDerWaalsContact O-CB 3.28Å; G620-Y624 WeakPolarHBondContact O-CB 3.49Å; G620-Y624 PolarHBondContact O-N 3.09Å
621T95.2Very high93.1Very high17 Ų1780.7 Ų80.710%0.10441%0.408CS..Hα-helixtrans-67.4-40.4175.4-53.90000111.6V588 W591 I592 G617 I618 F619 Y624 R625V588-T621 HydrophobicContact CG1-CG2 4.23Å; W591-T621 HydrophobicContact CB-CG2 4.13Å; I592-T621 HydrophobicContact CD1-CG2 4.48Å; I592-T621 HydrophobicContact CG1-CG2 3.95Å; G617-T621 WeakPolarHBondContact O-CB 3.5Å; G617-T621 PolarHBondContact O-N 3.18Å; G617-T621 PolarHBondContact O-OG1 3.18Å; I618-T621 WeakPolarHBondContact O-CB 3.42Å; I618-T621 PolarHBondContact O-N 3.41Å; I618-T621 VanDerWaalsContact O-N 3.13Å; F619-T621 VanDerWaalsContact C-N 3.31Å; F619-T621 PolarHBondContact O-N 3.08Å; T621-Y624 PolarHBondContact O-N 3.13Å; T621-R625 PolarHBondContact O-N 3.14Å
622M94.5Very high93.1Very high103 Ų10380.9 Ų80.951%0.50741%0.412SS..Hα-helixtrans-65.5-43.9175.7-67.8177.369.500112I592 I618 F619 R625 S626I592-M622 HydrophobicContact CD1-CG 4.07Å; I618-M622 HydrophobicContact CG2-SD 4.25Å; I618-M622 WeakPolarHBondContact O-CG 3.42Å; I618-M622 PolarHBondContact O-N 2.82Å; F619-M622 HydrophobicContact CD1-SD 4.41Å; F619-M622 PolarHBondContact O-N 2.94Å; M622-R625 PolarHBondContact O-N 3.12Å; M622-S626 PolarHBondContact O-N 3.25Å
623I95.4Very high93.1Very high94 Ų9480.7 Ų80.748%0.48241%0.406SS..Hα-helixtrans-61.6-48175.4-69.6166000109.5F619 G620 R625 S626 F627F619-I623 WeakPolarHBondContact O-CB 3.48Å; F619-I623 WeakPolarHBondContact O-CG1 3.48Å; F619-I623 PolarHBondContact O-N 3.23Å; G620-I623 PolarHBondContact O-N 2.88Å; I623-R625 VanDerWaalsContact C-N 3.29Å; I623-R625 PolarHBondContact O-N 3.11Å; I623-S626 WeakPolarHBondContact CA-OG 3.38Å; I623-S626 PolarHBondContact O-N 2.91Å; I623-S626 PolarHBondContact O-OG 3.43Å; I623-F627 HydrophobicContact CG2-CD2 3.93Å; I623-F627 HydrophobicContact CG2-CE2 3.61Å; I623-F627 WeakPolarHBondContact O-CD2 3.34Å; I623-F627 PolarHBondContact O-N 3.38Å
624Y93.5Very high93.1Very high139 Ų13981.4 Ų81.455%0.54541%0.407SS..Hα-helixtrans-54.7-45.7175.7172.1-104.7000111.5G620 T621 S626 F627 Q628G620-Y624 VanDerWaalsContact O-CB 3.28Å; G620-Y624 WeakPolarHBondContact O-CB 3.49Å; G620-Y624 PolarHBondContact O-N 3.09Å; T621-Y624 PolarHBondContact O-N 3.13Å; Y624-S626 PolarHBondContact O-N 2.84Å; Y624-F627 PolarHBondContact O-N 3.23Å; Y624-Q628 HydrophobicContact CE1-CG 4.24Å; Y624-Q628 VanDerWaalsContact CZ-NE2 3.25Å; Y624-Q628 PolarHBondContact O-N 3.42Å; Y624-Q628 PolarHBondContact OH-NE2 2.89Å
625R92.2Very high93Very high57 Ų5781.2 Ų81.222%0.21541%0.405CS..Hα-helixtrans-62.8-38.7175.5179.253.7-176.8178.12.7112.6V588 T621 M622 I623 F627 Q628 D630V588-R625 HydrophobicContact CG1-CB 4.46Å; V588-R625 HydrophobicContact CG2-CB 3.79Å; V588-R625 HydrophobicContact CG2-CG 3.94Å; T621-R625 PolarHBondContact O-N 3.14Å; M622-R625 PolarHBondContact O-N 3.12Å; I623-R625 VanDerWaalsContact C-N 3.29Å; I623-R625 PolarHBondContact O-N 3.11Å; R625-F627 PolarHBondContact O-N 3.28Å; R625-Q628 WeakPolarHBondContact O-CB 3.2Å; R625-Q628 PolarHBondContact O-N 3.1Å; R625-D630 IonicContact CZ-OD2 3.19Å; R625-D630 IonicContact NH1-OD2 3.65Å; R625-D630 PolarHBondContact NH1-OD2 3.22Å; R625-D630 IonicContact NH2-OD2 2.67Å; R625-D630 PolarHBondContact NH2-OD2 3.27Å; R625-D630 VanDerWaalsContact NH2-OD2 3.11Å
626S92.3Very high93Very high94 Ų9480.6 Ų80.666%0.65741%0.405SS*.Hα-helixtrans-64-22.2178.363.90000113.8M622 I623 Y624M622-S626 PolarHBondContact O-N 3.25Å; I623-S626 WeakPolarHBondContact CA-OG 3.38Å; I623-S626 PolarHBondContact O-N 2.91Å; I623-S626 PolarHBondContact O-OG 3.43Å; Y624-S626 PolarHBondContact O-N 2.84Å
627F93.3Very high93Very high167 Ų16774.6 Ų74.673%0.73238%0.384SS*.Hα-helixtrans-87.5-11.1173.7-75-75.6000113.9I623 Y624 R625 I629I623-F627 HydrophobicContact CG2-CD2 3.93Å; I623-F627 HydrophobicContact CG2-CE2 3.61Å; I623-F627 WeakPolarHBondContact O-CD2 3.34Å; I623-F627 PolarHBondContact O-N 3.38Å; Y624-F627 PolarHBondContact O-N 3.23Å; R625-F627 PolarHBondContact O-N 3.28Å; F627-I629 PolarHBondContact O-N 3.33Å
628Q88.6Confident92.9Very high58 Ų5877.4 Ų77.427%0.27141%0.405SS..  trans-77.7119178.5-69.9-174.5-28.600111.1Y624 R625 D630Y624-Q628 HydrophobicContact CE1-CG 4.24Å; Y624-Q628 VanDerWaalsContact CZ-NE2 3.25Å; Y624-Q628 PolarHBondContact O-N 3.42Å; Y624-Q628 PolarHBondContact OH-NE2 2.89Å; R625-Q628 WeakPolarHBondContact O-CB 3.2Å; R625-Q628 PolarHBondContact O-N 3.1Å; Q628-D630 PolarHBondContact O-N 3.15Å
629I86.5Confident92.9Very high145 Ų14581.5 Ų81.574%0.74442%0.424SS*.  trans-86.798.2167.5-56.4176.1000107.8F627 H631F627-I629 PolarHBondContact O-N 3.33Å; I629-H631 WeakPolarHBondContact CG2-NE2 3.29Å
630D86.5Confident92.8Very high49 Ų4976.3 Ų76.326%0.26240%0.402SS..  trans-119.995.4-175.2177.49.9000110.1N584 R625 Q628 G632N584-D630 WeakPolarHBondContact CB-OD1 3.5Å; N584-D630 PolarHBondContact ND2-OD1 3.44Å; R625-D630 IonicContact CZ-OD2 3.19Å; R625-D630 IonicContact NH1-OD2 3.65Å; R625-D630 PolarHBondContact NH1-OD2 3.22Å; R625-D630 IonicContact NH2-OD2 2.67Å; R625-D630 PolarHBondContact NH2-OD2 3.27Å; R625-D630 VanDerWaalsContact NH2-OD2 3.11Å; Q628-D630 PolarHBondContact O-N 3.15Å; D630-G632 VanDerWaalsContact C-N 3.25Å; D630-G632 PolarHBondContact O-N 3.44Å; D630-G632 PolarHBondContact OD1-N 3.48Å; D630-G632 VanDerWaalsContact OD1-N 3.15Å
631H86.7Confident92.7Very high150 Ų15076.3 Ų76.369%0.69440%0.398SS*.  trans-84.310.3-180-64.3-59.2000113.4H581 I629H581-H631 PolarHBondContact NE2-O 2.99Å; I629-H631 WeakPolarHBondContact CG2-NE2 3.29Å
632G91.3Very high92.6Very high20 Ų2082.5 Ų82.521%0.20643%0.426CS..  trans69.1-159.8-171.400000112.9M582 N584 D630M582-G632 CarbonylContact O-C 3.08Å; M582-G632 VanDerWaalsContact O-CA 3.24Å; M582-G632 WeakPolarHBondContact O-CA 3.4Å; N584-G632 VanDerWaalsContact ND2-C 3.26Å; N584-G632 WeakPolarHBondContact ND2-CA 3.5Å; N584-G632 PolarHBondContact ND2-N 3.23Å; N584-G632 PolarHBondContact ND2-O 3.44Å; N584-G632 VanDerWaalsContact ND2-O 3.16Å; D630-G632 VanDerWaalsContact C-N 3.25Å; D630-G632 PolarHBondContact O-N 3.44Å; D630-G632 PolarHBondContact OD1-N 3.48Å; D630-G632 VanDerWaalsContact OD1-N 3.15Å
633Y93.8Very high92.5Very high78 Ų7878.9 Ų78.931%0.30641%0.41SS..EExtended strand (participates in β ladder)trans-138164175.568.1-80.9000110.5H581 M582 P583 N584 I635H581-Y633 WeakPolarHBondContact CA-O 3.41Å; M582-Y633 HydrophobicContact CB-CD1 4.21Å; M582-Y633 HydrophobicContact CB-CE1 3.67Å; M582-Y633 HydrophobicContact CB-CE2 4.06Å; M582-Y633 PolarHBondContact N-O 3.45Å; M582-Y633 WeakPolarHBondContact O-CD1 3.44Å; M582-Y633 PolarHBondContact O-N 3.09Å; P583-Y633 VanDerWaalsContact O-CE1 3.28Å; P583-Y633 WeakPolarHBondContact O-CE1 3.32Å; N584-Y633 VanDerWaalsContact OD1-CD1 3.3Å; N584-Y633 WeakPolarHBondContact OD1-CD1 3.48Å; Y633-I635 HydrophobicContact CD2-CG1 4.26Å; Y633-I635 HydrophobicContact CE2-CD1 4.21Å; Y633-I635 HydrophobicContact CE2-CG1 3.73Å
634H95.2Very high92.3Very high120 Ų12074.5 Ų74.556%0.55639%0.387SS*.EExtended strand (participates in β ladder)trans-111.9135.1175.6-69.781.3000110.2I580 H581I580-H634 CarbonylContact O-C 3.6Å; I580-H634 WeakPolarHBondContact O-CA 3.38Å; H581-H634 AromaticContact CD2-CE1 3.64Å; H581-H634 AromaticContact CD2-NE2 3.77Å
635I94.8Very high92.1Very high10 Ų1070.5 Ų70.55%0.05138%0.382CS..EExtended strand (participates in β ladder)trans-91.6115.4166.4-55.8174.7000106.5Y547 D579 I580 M582 Y633 E639 V640Y547-I635 HydrophobicContact CD1-CD1 3.92Å; D579-I635 WeakPolarHBondContact CA-O 3.41Å; I580-I635 HydrophobicContact CB-CB 4.43Å; I580-I635 PolarHBondContact N-O 2.92Å; I580-I635 PolarHBondContact O-N 3.34Å; M582-I635 HydrophobicContact CG-CD1 3.87Å; M582-I635 HydrophobicContact CG-CG1 4.36Å; Y633-I635 HydrophobicContact CD2-CG1 4.26Å; Y633-I635 HydrophobicContact CE2-CD1 4.21Å; Y633-I635 HydrophobicContact CE2-CG1 3.73Å; I635-E639 HydrophobicContact CG2-CB 4.12Å; I635-E639 HydrophobicContact CG2-CG 4.12Å; I635-V640 HydrophobicContact CB-CG2 4.41Å; I635-V640 HydrophobicContact CG2-CG2 3.75Å
636P96.1Very high92.1Very high62 Ų6275.4 Ų75.440%0.40340%0.401SS..  trans-61.4145.7-178-22.733.5000112.3D579 A638 E639 V640D579-P636 WeakPolarHBondContact OD1-CA 3.24Å; P636-A638 PolarHBondContact O-N 3.07Å; P636-A638 VanDerWaalsContact O-N 3.08Å; P636-E639 WeakPolarHBondContact O-CB 3.46Å; P636-E639 PolarHBondContact O-N 3.14Å; P636-V640 PolarHBondContact O-N 3.34Å; P636-V640 VanDerWaalsContact O-N 3.1Å
637A94.5Very high91.9Very high27 Ų2772 Ų7222%0.22338%0.375CS..Hα-helixtrans-54.4-32.1178.600000113.1D579 V640 A641D579-A637 WeakPolarHBondContact OD1-CB 3.34Å; D579-A637 PolarHBondContact OD1-N 3.33Å; A637-V640 PolarHBondContact O-N 3.18Å; A637-A641 WeakPolarHBondContact O-CB 3.16Å; A637-A641 PolarHBondContact O-N 3.4Å
638A94.6Very high91.6Very high76 Ų7667.2 Ų67.263%0.62835%0.352SS*.Hα-helixtrans-64.9-43175.400000112.7P636 V640 A641 E642P636-A638 PolarHBondContact O-N 3.07Å; P636-A638 VanDerWaalsContact O-N 3.08Å; A638-V640 VanDerWaalsContact C-N 3.35Å; A638-A641 PolarHBondContact O-N 3.4Å; A638-E642 PolarHBondContact O-N 2.99Å
639E94.9Very high91.5Very high100 Ų10069.3 Ų69.347%0.46736%0.362SS..Hα-helixtrans-68-37.3176.8-175.5-176.615700111.1I635 P636 T643I635-E639 HydrophobicContact CG2-CB 4.12Å; I635-E639 HydrophobicContact CG2-CG 4.12Å; P636-E639 WeakPolarHBondContact O-CB 3.46Å; P636-E639 PolarHBondContact O-N 3.14Å; E639-T643 WeakPolarHBondContact O-CB 3.21Å; E639-T643 PolarHBondContact O-N 3.19Å; E639-T643 PolarHBondContact O-OG1 2.85Å
640V93.7Very high91.5Very high0 Ų064.3 Ų64.30%034%0.343CS..Hα-helixtrans-62.2-48.2172.7179.50000110.2Y547 A550 Y577 I580 I635 P636 A637 A638 E642 T643 E644Y547-V640 HydrophobicContact CE1-CG1 4.5Å; Y547-V640 HydrophobicContact CE1-CG2 4.37Å; A550-V640 HydrophobicContact CB-CG1 3.57Å; Y577-V640 HydrophobicContact CD1-CG1 3.77Å; Y577-V640 HydrophobicContact CE1-CG1 4.36Å; Y577-V640 HydrophobicContact CG-CG1 4.1Å; I580-V640 HydrophobicContact CD1-CG1 4.26Å; I580-V640 HydrophobicContact CD1-CG2 3.84Å; I580-V640 HydrophobicContact CG1-CG2 4.13Å; I635-V640 HydrophobicContact CB-CG2 4.41Å; I635-V640 HydrophobicContact CG2-CG2 3.75Å; P636-V640 PolarHBondContact O-N 3.34Å; P636-V640 VanDerWaalsContact O-N 3.1Å; A637-V640 PolarHBondContact O-N 3.18Å; A638-V640 VanDerWaalsContact C-N 3.35Å; V640-E642 PolarHBondContact O-N 3.02Å; V640-T643 PolarHBondContact O-N 3.04Å; V640-E644 HydrophobicContact CG1-CG 4.19Å; V640-E644 WeakPolarHBondContact O-CB 3.49Å; V640-E644 VanDerWaalsContact O-CG 3.26Å; V640-E644 WeakPolarHBondContact O-CG 3.48Å; V640-E644 PolarHBondContact O-N 3.39Å
641A92.7Very high91.3Very high37 Ų3763 Ų6331%0.30633%0.334SS..Hα-helixtrans-60.2-44.1179.100000112.3Y577 A637 A638 A645Y577-A641 HydrophobicContact CD2-CB 3.56Å; Y577-A641 HydrophobicContact CE2-CB 3.99Å; Y577-A641 HydrophobicContact CG-CB 4.45Å; A637-A641 WeakPolarHBondContact O-CB 3.16Å; A637-A641 PolarHBondContact O-N 3.4Å; A638-A641 PolarHBondContact O-N 3.4Å; A641-A645 VanDerWaalsContact O-CB 3.27Å; A641-A645 WeakPolarHBondContact O-CB 3.31Å; A641-A645 PolarHBondContact O-N 3.14Å
642E93.2Very high91.2Very high147 Ų14759.7 Ų59.769%0.68732%0.321SS*.Hα-helixtrans-62-45.9175.8-175-176.3171.600111.5A638 V640 A645 R646A638-E642 PolarHBondContact O-N 2.99Å; V640-E642 PolarHBondContact O-N 3.02Å; E642-A645 PolarHBondContact O-N 3.01Å; E642-R646 PolarHBondContact O-N 3.4Å
643T92.5Very high90.9Very high27 Ų2764.3 Ų64.317%0.16634%0.335CS..Hα-helixtrans-61.3-49.6178.6-61.80000111.1E639 V640 A645 R646 L647E639-T643 WeakPolarHBondContact O-CB 3.21Å; E639-T643 PolarHBondContact O-N 3.19Å; E639-T643 PolarHBondContact O-OG1 2.85Å; V640-T643 PolarHBondContact O-N 3.04Å; T643-A645 VanDerWaalsContact C-N 3.35Å; T643-A645 PolarHBondContact O-N 3.32Å; T643-R646 PolarHBondContact O-N 2.98Å; T643-L647 HydrophobicContact CG2-CD1 4.16Å; T643-L647 HydrophobicContact CG2-CG 4.45Å; T643-L647 VanDerWaalsContact O-CG 3.3Å; T643-L647 WeakPolarHBondContact O-CG 3.27Å; T643-L647 PolarHBondContact O-N 3.28Å
644E91.3Very high90.3Very high2 Ų262.5 Ų62.51%0.00933%0.33CS..Hα-helixtrans-64.5-36.9179.9-69.6-65.5143.500112.5A540 Y547 A550 L572 Y577 V640 L647 R648A540-E644 WeakPolarHBondContact CB-OE2 3.21Å; Y547-E644 WeakPolarHBondContact CE2-OE1 3.21Å; Y547-E644 PolarHBondContact OH-OE1 3.01Å; A550-E644 HydrophobicContact CB-CG 3.88Å; L572-E644 WeakPolarHBondContact CD2-OE2 3.49Å; Y577-E644 HydrophobicContact CE1-CB 4.19Å; Y577-E644 HydrophobicContact CE1-CG 3.74Å; Y577-E644 HydrophobicContact CE2-CB 4.36Å; Y577-E644 VanDerWaalsContact OH-CB 3.27Å; Y577-E644 WeakPolarHBondContact OH-CB 3.48Å; V640-E644 HydrophobicContact CG1-CG 4.19Å; V640-E644 WeakPolarHBondContact O-CB 3.49Å; V640-E644 VanDerWaalsContact O-CG 3.26Å; V640-E644 WeakPolarHBondContact O-CG 3.48Å; V640-E644 PolarHBondContact O-N 3.39Å; E644-L647 PolarHBondContact O-N 3.41Å; E644-R648 WeakPolarHBondContact O-CB 3.31Å; E644-R648 PolarHBondContact O-N 3.26Å
645A90.2Very high89.5Confident54 Ų5464.6 Ų64.645%0.44633%0.332SS..Hα-helixtrans-62.7-47.9174.200000111.3A641 E642 T643 L647 R648 E649A641-A645 VanDerWaalsContact O-CB 3.27Å; A641-A645 WeakPolarHBondContact O-CB 3.31Å; A641-A645 PolarHBondContact O-N 3.14Å; E642-A645 PolarHBondContact O-N 3.01Å; T643-A645 VanDerWaalsContact C-N 3.35Å; T643-A645 PolarHBondContact O-N 3.32Å; A645-L647 PolarHBondContact O-N 3.3Å; A645-R648 WeakPolarHBondContact O-CB 2.99Å; A645-R648 PolarHBondContact O-N 3.21Å; A645-E649 PolarHBondContact O-N 2.97Å
646R90.8Very high89Confident160 Ų16069 Ų6960%0.60435%0.353SS*.Hα-helixtrans-60.4-43.6176.7-176.6-175.964.1161-2.2112.3E642 T643 R648 E649 A650E642-R646 PolarHBondContact O-N 3.4Å; T643-R646 PolarHBondContact O-N 2.98Å; R646-R648 VanDerWaalsContact C-N 3.32Å; R646-E649 PolarHBondContact O-N 2.96Å; R646-A650 PolarHBondContact O-N 3.49Å; R646-A650 VanDerWaalsContact O-N 3.11Å
647L88.6Confident88.2Confident23 Ų2368.6 Ų68.612%0.1236%0.355CS..Hα-helixtrans-67.6-33.6178.1-65.6-178.7000112A540 T643 E644 A645 R651A540-L647 HydrophobicContact CB-CB 4.25Å; A540-L647 HydrophobicContact CB-CD1 3.62Å; T643-L647 HydrophobicContact CG2-CD1 4.16Å; T643-L647 HydrophobicContact CG2-CG 4.45Å; T643-L647 VanDerWaalsContact O-CG 3.3Å; T643-L647 WeakPolarHBondContact O-CG 3.27Å; T643-L647 PolarHBondContact O-N 3.28Å; E644-L647 PolarHBondContact O-N 3.41Å; A645-L647 PolarHBondContact O-N 3.3Å; L647-R651 WeakPolarHBondContact O-CG 3.47Å; L647-R651 PolarHBondContact O-N 2.81Å; L647-R651 PolarHBondContact O-NE 3.33Å
648R86.4Confident87.1Confident66 Ų6671.6 Ų71.625%0.24937%0.37CS..Hα-helixtrans-66.5-45.6173.3-171.1-178-49.517511112.3L572 H575 Y577 E644 A645 R646 A650 R651 I652L572-R648 PolarHBondContact O-NH2 2.94Å; H575-R648 PolarHBondContact CE1-NH1 3.27Å; H575-R648 PolarHBondContact CE1-NH2 3.12Å; H575-R648 PolarHBondContact ND1-NH2 2.85Å; H575-R648 PolarHBondContact NE2-NH1 2.9Å; Y577-R648 PolarHBondContact OH-NH2 3.18Å; E644-R648 WeakPolarHBondContact O-CB 3.31Å; E644-R648 PolarHBondContact O-N 3.26Å; A645-R648 WeakPolarHBondContact O-CB 2.99Å; A645-R648 PolarHBondContact O-N 3.21Å; R646-R648 VanDerWaalsContact C-N 3.32Å; R648-A650 VanDerWaalsContact C-N 3.29Å; R648-A650 PolarHBondContact O-N 3.45Å; R648-R651 PolarHBondContact O-N 3.3Å; R648-I652 HydrophobicContact CG-CD1 4.09Å; R648-I652 WeakPolarHBondContact O-CG1 3.38Å; R648-I652 PolarHBondContact O-N 3.41Å
649E87.6Confident85.9Confident102 Ų10271.2 Ų71.248%0.47736%0.363SS..Hα-helixtrans-58.6-43.1177.1-168.2-170.3161.300111.3A645 R646 R651 I652 K653A645-E649 PolarHBondContact O-N 2.97Å; R646-E649 PolarHBondContact O-N 2.96Å; E649-R651 VanDerWaalsContact C-N 3.32Å; E649-R651 PolarHBondContact O-N 3.02Å; E649-I652 PolarHBondContact O-N 2.95Å; E649-K653 WeakPolarHBondContact O-CG 3.34Å; E649-K653 PolarHBondContact O-N 3.19Å; E649-K653 WeakPolarHBondContact OE1-CE 3.34Å; E649-K653 IonicContact OE1-NZ 2.66Å; E649-K653 PolarHBondContact OE1-NZ 3.05Å
650A86.3Confident84.4Confident41 Ų4174 Ų7434%0.33938%0.376SS..Hα-helixtrans-59.4-41176.300000112.7A523 R646 R648 K653 E654A523-A650 HydrophobicContact CB-CB 4.05Å; A523-A650 WeakPolarHBondContact CB-O 3.31Å; R646-A650 PolarHBondContact O-N 3.49Å; R646-A650 VanDerWaalsContact O-N 3.11Å; R648-A650 VanDerWaalsContact C-N 3.29Å; R648-A650 PolarHBondContact O-N 3.45Å; A650-K653 PolarHBondContact O-N 2.74Å; A650-E654 PolarHBondContact O-N 3.21Å
651R82.3Confident82.6Confident21 Ų2182.5 Ų82.58%0.07942%0.415CS..Hα-helixtrans-69.2-37.7177.2-71.8-178.6-66.4143.5-0.4113.2A523 A540 L647 R648 E649 E654 R655A523-R651 HydrophobicContact CB-CG 4.33Å; A523-R651 WeakPolarHBondContact O-CG 3.5Å; A540-R651 WeakPolarHBondContact O-CD 3.24Å; A540-R651 PolarHBondContact O-NE 3.45Å; L647-R651 WeakPolarHBondContact O-CG 3.47Å; L647-R651 PolarHBondContact O-N 2.81Å; L647-R651 PolarHBondContact O-NE 3.33Å; R648-R651 PolarHBondContact O-N 3.3Å; E649-R651 VanDerWaalsContact C-N 3.32Å; E649-R651 PolarHBondContact O-N 3.02Å; R651-E654 PolarHBondContact O-N 2.94Å; R651-R655 WeakPolarHBondContact O-CB 3.34Å; R651-R655 WeakPolarHBondContact O-CG 3.1Å; R651-R655 PolarHBondContact O-N 3.19Å
652I83.7Confident80.4Confident81 Ų8187.6 Ų87.642%0.41545%0.448SS..Hα-helixtrans-62.6-48.1175.8-68.7167.8000109.1R648 E649 E654 R655 E656R648-I652 HydrophobicContact CG-CD1 4.09Å; R648-I652 WeakPolarHBondContact O-CG1 3.38Å; R648-I652 PolarHBondContact O-N 3.41Å; E649-I652 PolarHBondContact O-N 2.95Å; I652-E654 VanDerWaalsContact C-N 3.32Å; I652-E654 PolarHBondContact O-N 3.03Å; I652-R655 PolarHBondContact O-N 3.48Å; I652-R655 VanDerWaalsContact O-N 3.16Å; I652-E656 HydrophobicContact CG2-CG 4.33Å; I652-E656 WeakPolarHBondContact CG2-OE1 3.43Å; I652-E656 WeakPolarHBondContact O-CG 3.32Å; I652-E656 PolarHBondContact O-N 3.33Å
653K85.3Confident79.8Confident117 Ų11784.6 Ų84.651%0.50944%0.436SS..Hα-helixtrans-58.3-41.6176.6-72177.1-177.5169.80113E649 A650 A657E649-K653 WeakPolarHBondContact O-CG 3.34Å; E649-K653 PolarHBondContact O-N 3.19Å; E649-K653 WeakPolarHBondContact OE1-CE 3.34Å; E649-K653 IonicContact OE1-NZ 2.66Å; E649-K653 PolarHBondContact OE1-NZ 3.05Å; A650-K653 PolarHBondContact O-N 2.74Å; K653-A657 WeakPolarHBondContact O-CB 3.4Å; K653-A657 PolarHBondContact O-N 3.4Å
654E81.5Confident79.1Confident40 Ų4087.6 Ų87.619%0.18745%0.451CS..Hα-helixtrans-64.3-45.4175.6-179.5-176.9-124.200111.9E522 A523 T524 A650 R651 I652 E656 A657 V658E522-E654 WeakPolarHBondContact CA-OE1 3.43Å; A523-E654 HydrophobicContact CB-CB 3.92Å; A523-E654 HydrophobicContact CB-CG 4.43Å; A523-E654 WeakPolarHBondContact CB-OE2 3.48Å; A523-E654 PolarHBondContact N-OE1 2.94Å; A523-E654 PolarHBondContact N-OE2 3.36Å; T524-E654 WeakPolarHBondContact CA-OE2 3.11Å; T524-E654 WeakPolarHBondContact CB-OE2 3.16Å; T524-E654 WeakPolarHBondContact CG2-OE2 3.03Å; T524-E654 PolarHBondContact N-OE2 3.33Å; A650-E654 PolarHBondContact O-N 3.21Å; R651-E654 PolarHBondContact O-N 2.94Å; I652-E654 VanDerWaalsContact C-N 3.32Å; I652-E654 PolarHBondContact O-N 3.03Å; E654-E656 VanDerWaalsContact C-N 3.35Å; E654-E656 PolarHBondContact O-N 2.98Å; E654-A657 PolarHBondContact O-N 2.92Å; E654-V658 WeakPolarHBondContact O-CG2 3.47Å; E654-V658 PolarHBondContact O-N 2.97Å
655R79.2Confident78.5Confident163 Ų16392.4 Ų92.462%0.61548%0.475SS*.Hα-helixtrans-61.4-42.7177-75.2177.3174.8-165.2-2.1112.2R651 I652 V658 S659R651-R655 WeakPolarHBondContact O-CB 3.34Å; R651-R655 WeakPolarHBondContact O-CG 3.1Å; R651-R655 PolarHBondContact O-N 3.19Å; I652-R655 PolarHBondContact O-N 3.48Å; I652-R655 VanDerWaalsContact O-N 3.16Å; R655-V658 PolarHBondContact O-N 3.13Å; R655-S659 PolarHBondContact O-N 3.29Å; R655-S659 PolarHBondContact O-OG 3.21Å
656E82.8Confident77.8Confident103 Ų10394.6 Ų94.648%0.48148%0.477SS..Hα-helixtrans-62.3-45.6176.2-72.7171.4173.500110.9I652 E654 V658 S659 H660I652-E656 HydrophobicContact CG2-CG 4.33Å; I652-E656 WeakPolarHBondContact CG2-OE1 3.43Å; I652-E656 WeakPolarHBondContact O-CG 3.32Å; I652-E656 PolarHBondContact O-N 3.33Å; E654-E656 VanDerWaalsContact C-N 3.35Å; E654-E656 PolarHBondContact O-N 2.98Å; E656-V658 PolarHBondContact O-N 3.28Å; E656-S659 PolarHBondContact O-N 3.12Å; E656-S659 PolarHBondContact O-OG 2.96Å; E656-H660 PolarHBondContact O-CD2 3.27Å; E656-H660 PolarHBondContact O-N 2.77Å
657A79.6Confident77Confident53 Ų5390.6 Ų90.644%0.43847%0.469SS..Hα-helixtrans-59.6-44.9177.400000112.4K653 E654 S659 H660 E661K653-A657 WeakPolarHBondContact O-CB 3.4Å; K653-A657 PolarHBondContact O-N 3.4Å; E654-A657 PolarHBondContact O-N 2.92Å; A657-S659 VanDerWaalsContact C-N 3.35Å; A657-S659 PolarHBondContact O-N 3.1Å; A657-H660 PolarHBondContact O-N 3.34Å; A657-E661 PolarHBondContact O-N 3Å
658V72.5Confident76.2Confident91 Ų9195.1 Ų95.155%0.55249%0.492SS*.Hα-helixtrans-65.2-38.4177.9175.20000111.6E654 R655 E656 H660 E661 S662E654-V658 WeakPolarHBondContact O-CG2 3.47Å; E654-V658 PolarHBondContact O-N 2.97Å; R655-V658 PolarHBondContact O-N 3.13Å; E656-V658 PolarHBondContact O-N 3.28Å; V658-H660 PolarHBondContact O-N 3.23Å; V658-E661 PolarHBondContact O-N 3.3Å; V658-S662 PolarHBondContact O-N 2.83Å
659S69.6Low75.5Confident67 Ų6797.1 Ų97.147%0.46951%0.51SS..Hα-helixtrans-68.5-20.6179710000114.4R655 E656 A657 S662R655-S659 PolarHBondContact O-N 3.29Å; R655-S659 PolarHBondContact O-OG 3.21Å; E656-S659 PolarHBondContact O-N 3.12Å; E656-S659 PolarHBondContact O-OG 2.96Å; A657-S659 VanDerWaalsContact C-N 3.35Å; A657-S659 PolarHBondContact O-N 3.1Å; S659-S662 PolarHBondContact O-OG 3.38Å
660H61.9Low74.5Confident160 Ų16096.8 Ų96.874%0.74151%0.512SS*.Hα-helixtrans-87.3-17.5175.7-74.7-57.9000113.3E656 A657 V658E656-H660 PolarHBondContact O-CD2 3.27Å; E656-H660 PolarHBondContact O-N 2.77Å; A657-H660 PolarHBondContact O-N 3.34Å; V658-H660 PolarHBondContact O-N 3.23Å
661E57.4Low73.6Confident177 Ų177101.4 Ų101.483%0.82753%0.527SS*.Hα-helixtrans-93.7-19.8177.8-70.1-174.9169.500113.4A657 V658A657-E661 PolarHBondContact O-N 3Å; V658-E661 PolarHBondContact O-N 3.3Å
662S46.9Very low72.8Confident144 Ų144108.7 Ų108.7100%1.00757%0.567SS**  trans-84.90172.267.90000112.4V658 S659V658-S662 PolarHBondContact O-N 2.83Å; S659-S662 PolarHBondContact O-OG 3.38Å

Retrieved 662 of 662 residues in 179.5 ms (Link to these results)

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